A0A5K4F325_SCHMA Loading...

Serine/threonine-protein phosphatase 4 regulatory subunit 4-like

AlphaFold DB , UniProt , Accession A0A5K4F325, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 749 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	53.5	Low	64.8	Low	167 Å²	167	68.1 Å²	68.1	82%	0.823	38%	0.379	S	S	*	.				0	136.6	0	-86.7	178	-170.1	0	0	109.1	E5 Q9	M1-E5 WeakPolarHBondContact CA-OE2 3.24Å; M1-E5 HydrophobicContact CB-CB 4.17Å; M1-E5 HydrophobicContact CG-CB 4.04Å; M1-Q9 PolarHBondContact SD-OE1 3.15Å
2	S	63.6	Low	65	Low	55 Å²	55	74.3 Å²	74.3	39%	0.385	40%	0.399	S	S	.	.			trans	-67.2	155.7	164.4	62.8	0	0	0	0	109.9	L4 E5 A6	S2-L4 PolarHBondContact O-N 2.98Å; S2-L4 VanDerWaalsContact O-N 3.09Å; S2-L4 WeakPolarHBondContact OG-CB 3.33Å; S2-E5 PolarHBondContact N-OE2 3.42Å; S2-E5 PolarHBondContact O-N 3.27Å; S2-E5 VanDerWaalsContact O-N 3.1Å; S2-E5 WeakPolarHBondContact OG-CG 3.4Å; S2-E5 PolarHBondContact OG-N 3.35Å; S2-A6 PolarHBondContact O-N 2.72Å
3	V	59.2	Low	65.3	Low	128 Å²	128	75.2 Å²	75.2	78%	0.776	41%	0.409	S	S	*	.	H	α-helix	trans	-52.4	-31.8	170.9	177.6	0	0	0	0	110.5	A6 V7	V3-A6 WeakPolarHBondContact O-CB 3.32Å; V3-A6 PolarHBondContact O-N 2.86Å; V3-V7 WeakPolarHBondContact O-CG2 3.26Å; V3-V7 PolarHBondContact O-N 2.93Å
4	L	59.1	Low	65.2	Low	42 Å²	42	71.9 Å²	71.9	22%	0.22	39%	0.391	C	S	.	.	H	α-helix	trans	-65.8	-51.6	175	171.6	67.3	0	0	0	113.8	S2 A6 V7 L8 L48 L52	S2-L4 PolarHBondContact O-N 2.98Å; S2-L4 VanDerWaalsContact O-N 3.09Å; S2-L4 WeakPolarHBondContact OG-CB 3.33Å; L4-A6 PolarHBondContact O-N 3.46Å; L4-V7 PolarHBondContact O-N 3.36Å; L4-V7 VanDerWaalsContact O-N 3.08Å; L4-L8 HydrophobicContact CD1-CD1 4.01Å; L4-L8 HydrophobicContact CD1-CG 4.11Å; L4-L8 HydrophobicContact CG-CD1 4.13Å; L4-L8 PolarHBondContact O-N 3.33Å; L4-L48 HydrophobicContact CD1-CD1 3.84Å; L4-L52 HydrophobicContact CD1-CD1 4Å; L4-L52 HydrophobicContact CD1-CD2 3.17Å; L4-L52 HydrophobicContact CD1-CG 3.7Å; L4-L52 HydrophobicContact CD2-CD2 3.22Å; L4-L52 HydrophobicContact CG-CD2 3.73Å
5	E	65	Low	65	Low	103 Å²	103	79.7 Å²	79.7	48%	0.481	41%	0.412	S	S	.	.	H	α-helix	trans	-58.1	-37.4	176.3	-77.1	168.3	159.6	0	0	110.1	M1 S2 Q9	M1-E5 WeakPolarHBondContact CA-OE2 3.24Å; M1-E5 HydrophobicContact CB-CB 4.17Å; M1-E5 HydrophobicContact CG-CB 4.04Å; S2-E5 PolarHBondContact N-OE2 3.42Å; S2-E5 PolarHBondContact O-N 3.27Å; S2-E5 VanDerWaalsContact O-N 3.1Å; S2-E5 WeakPolarHBondContact OG-CG 3.4Å; S2-E5 PolarHBondContact OG-N 3.35Å; E5-Q9 WeakPolarHBondContact O-CB 3.48Å; E5-Q9 PolarHBondContact O-N 2.9Å
6	A	67.5	Low	64.8	Low	39 Å²	39	76.2 Å²	76.2	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-47.3	173.5	0	0	0	0	0	111.6	S2 V3 L4 Q9 T10	S2-A6 PolarHBondContact O-N 2.72Å; V3-A6 WeakPolarHBondContact O-CB 3.32Å; V3-A6 PolarHBondContact O-N 2.86Å; L4-A6 PolarHBondContact O-N 3.46Å; A6-Q9 CarbonylContact O-C 3.33Å; A6-Q9 PolarHBondContact O-N 2.65Å; A6-T10 WeakPolarHBondContact O-CB 3.27Å; A6-T10 PolarHBondContact O-N 3.35Å; A6-T10 PolarHBondContact O-OG1 3.07Å
7	V	67.9	Low	64.1	Low	39 Å²	39	78.9 Å²	78.9	24%	0.236	41%	0.408	C	S	.	.	H	α-helix	trans	-66.9	-44.1	179.1	173.8	0	0	0	0	112.5	V3 L4 Q9 T10 L11 L48	V3-V7 WeakPolarHBondContact O-CG2 3.26Å; V3-V7 PolarHBondContact O-N 2.93Å; L4-V7 PolarHBondContact O-N 3.36Å; L4-V7 VanDerWaalsContact O-N 3.08Å; V7-Q9 VanDerWaalsContact C-N 3.29Å; V7-Q9 PolarHBondContact O-N 3.18Å; V7-T10 WeakPolarHBondContact O-CB 3.34Å; V7-T10 PolarHBondContact O-N 2.81Å; V7-L11 HydrophobicContact CG1-CD1 4.46Å; V7-L11 WeakPolarHBondContact O-CG 3.36Å; V7-L11 PolarHBondContact O-N 3.04Å; V7-L48 HydrophobicContact CB-CD1 4.38Å; V7-L48 HydrophobicContact CG1-CD1 3.97Å; V7-L48 HydrophobicContact CG1-CD2 3.71Å; V7-L48 HydrophobicContact CG1-CG 4.48Å
8	L	65.1	Low	63.3	Low	21 Å²	21	82.2 Å²	82.2	11%	0.11	43%	0.427	C	S	.	.	H	α-helix	trans	-63.5	-38.4	175.7	-73.8	174.4	0	0	0	111	L4 K12 K60 L61	L4-L8 HydrophobicContact CD1-CD1 4.01Å; L4-L8 HydrophobicContact CD1-CG 4.11Å; L4-L8 HydrophobicContact CG-CD1 4.13Å; L4-L8 PolarHBondContact O-N 3.33Å; L8-K12 WeakPolarHBondContact O-CB 3.24Å; L8-K12 VanDerWaalsContact O-CG 3.3Å; L8-K12 WeakPolarHBondContact O-CG 3.3Å; L8-K12 PolarHBondContact O-N 3.25Å; L8-K60 HydrophobicContact CD1-CB 4.29Å; L8-L61 HydrophobicContact CD2-CD1 4.03Å
9	Q	69.7	Low	62.2	Low	90 Å²	90	83.1 Å²	83.1	42%	0.421	44%	0.441	S	S	.	.	H	α-helix	trans	-67.1	-42.2	172.9	-172.2	168.5	3.9	0	0	110.9	M1 E5 A6 V7 L11 K12 T13	M1-Q9 PolarHBondContact SD-OE1 3.15Å; E5-Q9 WeakPolarHBondContact O-CB 3.48Å; E5-Q9 PolarHBondContact O-N 2.9Å; A6-Q9 CarbonylContact O-C 3.33Å; A6-Q9 PolarHBondContact O-N 2.65Å; V7-Q9 VanDerWaalsContact C-N 3.29Å; V7-Q9 PolarHBondContact O-N 3.18Å; Q9-L11 PolarHBondContact O-N 2.93Å; Q9-K12 CarbonylContact O-C 3.38Å; Q9-K12 PolarHBondContact O-N 3.01Å; Q9-K12 VanDerWaalsContact O-N 3.14Å; Q9-T13 HydrophobicContact CG-CG2 3.96Å; Q9-T13 WeakPolarHBondContact O-CB 3.45Å; Q9-T13 WeakPolarHBondContact O-CG2 3.27Å; Q9-T13 PolarHBondContact O-N 3.43Å; Q9-T13 PolarHBondContact O-OG1 2.88Å
10	T	72	Confident	61.2	Low	61 Å²	61	84.5 Å²	84.5	37%	0.374	45%	0.452	S	S	.	.	H	α-helix	trans	-54.2	-53.5	174.1	-60.6	0	0	0	0	109.8	A6 V7 K12 T13 L14	A6-T10 WeakPolarHBondContact O-CB 3.27Å; A6-T10 PolarHBondContact O-N 3.35Å; A6-T10 PolarHBondContact O-OG1 3.07Å; V7-T10 WeakPolarHBondContact O-CB 3.34Å; V7-T10 PolarHBondContact O-N 2.81Å; T10-K12 VanDerWaalsContact C-N 3.31Å; T10-K12 PolarHBondContact O-N 2.84Å; T10-T13 WeakPolarHBondContact CA-OG1 3.3Å; T10-T13 CarbonylContact O-C 3.59Å; T10-T13 PolarHBondContact O-N 3Å; T10-T13 PolarHBondContact O-OG1 3.26Å; T10-L14 WeakPolarHBondContact O-CG 3.44Å; T10-L14 PolarHBondContact O-N 2.9Å
11	L	70.7	Confident	60.1	Low	4 Å²	4	85.4 Å²	85.4	2%	0.021	47%	0.472	C	S	.	.	H	α-helix	trans	-54.7	-43.8	176.9	-74.3	173.5	0	0	0	112.3	V7 Q9 L14 V41 F42 L45 L48 L61 T64	V7-L11 HydrophobicContact CG1-CD1 4.46Å; V7-L11 WeakPolarHBondContact O-CG 3.36Å; V7-L11 PolarHBondContact O-N 3.04Å; Q9-L11 PolarHBondContact O-N 2.93Å; L11-L14 HydrophobicContact CD2-CD1 4.2Å; L11-V41 HydrophobicContact CD2-CG1 3.6Å; L11-V41 HydrophobicContact CG-CG1 4.2Å; L11-F42 HydrophobicContact CD2-CD1 4.09Å; L11-F42 HydrophobicContact CD2-CE1 3.56Å; L11-F42 HydrophobicContact CD2-CZ 4.22Å; L11-L45 HydrophobicContact CD1-CD2 4.42Å; L11-L48 HydrophobicContact CD1-CD2 4.15Å; L11-L61 HydrophobicContact CD1-CD1 4.19Å; L11-T64 HydrophobicContact CB-CG2 4.12Å
12	K	67.3	Low	59.6	Low	142 Å²	142	81 Å²	81	62%	0.617	46%	0.458	S	S	*	.	H	α-helix	trans	-72.3	-25.5	177.6	-72.8	-179.5	178.3	-169.3	0	114	L8 Q9 T10 T64	L8-K12 WeakPolarHBondContact O-CB 3.24Å; L8-K12 VanDerWaalsContact O-CG 3.3Å; L8-K12 WeakPolarHBondContact O-CG 3.3Å; L8-K12 PolarHBondContact O-N 3.25Å; Q9-K12 CarbonylContact O-C 3.38Å; Q9-K12 PolarHBondContact O-N 3.01Å; Q9-K12 VanDerWaalsContact O-N 3.14Å; T10-K12 VanDerWaalsContact C-N 3.31Å; T10-K12 PolarHBondContact O-N 2.84Å; K12-T64 WeakPolarHBondContact CE-OG1 3.3Å; K12-T64 HydrophobicContact CG-CG2 3.91Å
13	T	67.9	Low	58.6	Low	87 Å²	87	84.3 Å²	84.3	53%	0.534	48%	0.481	S	S	.	.	H	α-helix	trans	-92.4	-5.1	179.6	57.3	0	0	0	0	113.3	Q9 T10 R15	Q9-T13 HydrophobicContact CG-CG2 3.96Å; Q9-T13 WeakPolarHBondContact O-CB 3.45Å; Q9-T13 WeakPolarHBondContact O-CG2 3.27Å; Q9-T13 PolarHBondContact O-N 3.43Å; Q9-T13 PolarHBondContact O-OG1 2.88Å; T10-T13 WeakPolarHBondContact CA-OG1 3.3Å; T10-T13 CarbonylContact O-C 3.59Å; T10-T13 PolarHBondContact O-N 3Å; T10-T13 PolarHBondContact O-OG1 3.26Å; T13-R15 PolarHBondContact O-N 3.28Å; T13-R15 VanDerWaalsContact O-N 3.12Å
14	L	64.3	Low	57.9	Low	29 Å²	29	83.1 Å²	83.1	15%	0.152	47%	0.47	C	S	.	.			trans	-58.2	118.3	172.7	-69.8	-179.9	0	0	0	108.3	T10 L11 F16 K38 F42	T10-L14 WeakPolarHBondContact O-CG 3.44Å; T10-L14 PolarHBondContact O-N 2.9Å; L11-L14 HydrophobicContact CD2-CD1 4.2Å; L14-F16 HydrophobicContact CB-CE2 4Å; L14-F16 HydrophobicContact CB-CZ 4.1Å; L14-F16 WeakPolarHBondContact O-CD2 3.32Å; L14-F16 VanDerWaalsContact O-CE2 3.32Å; L14-F16 WeakPolarHBondContact O-CE2 3.34Å; L14-K38 HydrophobicContact CD1-CG 4.35Å; L14-K38 HydrophobicContact CD2-CD 4.5Å; L14-K38 HydrophobicContact CD2-CG 3.73Å; L14-F42 HydrophobicContact CD1-CE1 4.23Å; L14-F42 HydrophobicContact CD1-CE2 3.78Å; L14-F42 HydrophobicContact CD1-CZ 3.36Å
15	R	62.9	Low	57.6	Low	188 Å²	188	87.6 Å²	87.6	71%	0.709	50%	0.499	S	S	*	.			trans	-82.3	137.5	173.6	-69.8	-171	-179.4	171.1	-0.6	109.2	T13 K38	T13-R15 PolarHBondContact O-N 3.28Å; T13-R15 VanDerWaalsContact O-N 3.12Å; R15-K38 PolarHBondContact O-NZ 2.94Å
16	F	60.7	Low	57	Low	24 Å²	24	86.2 Å²	86.2	11%	0.105	50%	0.501	C	S	.	.			trans	-112	8.9	175.8	-62.3	-88.5	0	0	0	111.8	L14 N18 V68 N71 A72 A75 I80	L14-F16 HydrophobicContact CB-CE2 4Å; L14-F16 HydrophobicContact CB-CZ 4.1Å; L14-F16 WeakPolarHBondContact O-CD2 3.32Å; L14-F16 VanDerWaalsContact O-CE2 3.32Å; L14-F16 WeakPolarHBondContact O-CE2 3.34Å; F16-N18 PolarHBondContact O-N 3.39Å; F16-V68 HydrophobicContact CZ-CG1 3.82Å; F16-N71 HydrophobicContact CD2-CB 3.63Å; F16-N71 HydrophobicContact CE2-CB 3.95Å; F16-N71 HydrophobicContact CG-CB 4.13Å; F16-A72 HydrophobicContact CD1-CB 4.23Å; F16-A72 HydrophobicContact CE1-CB 3.96Å; F16-A75 HydrophobicContact CB-CB 3.66Å; F16-A75 VanDerWaalsContact O-CB 3.24Å; F16-A75 WeakPolarHBondContact O-CB 3.41Å; F16-I80 HydrophobicContact CD1-CD1 4.36Å; F16-I80 HydrophobicContact CE1-CD1 3.73Å; F16-I80 HydrophobicContact CE1-CG2 4.5Å
17	D	53.9	Low	56.2	Low	122 Å²	122	86.8 Å²	86.8	65%	0.652	50%	0.499	S	S	*	.			trans	-73	116.7	-177.7	-69	-37.2	0	0	0	111.9	S19	D17-S19 VanDerWaalsContact C-N 3.31Å
18	N	49.9	Very low	55.5	Low	139 Å²	139	87.1 Å²	87.1	74%	0.743	51%	0.505	S	S	*	.			trans	-88.7	13.8	169.7	-80.6	-19.8	0	0	0	113.5	F16 T20	F16-N18 PolarHBondContact O-N 3.39Å; N18-T20 PolarHBondContact O-N 3.31Å
19	S	41.8	Very low	55	Low	99 Å²	99	93.6 Å²	93.6	69%	0.692	54%	0.535	S	S	*	.			trans	-86.3	6	-165.1	52.9	0	0	0	0	116.3	D17	D17-S19 VanDerWaalsContact C-N 3.31Å
20	T	41.9	Very low	54.3	Low	110 Å²	110	97.3 Å²	97.3	68%	0.675	55%	0.547	S	S	*	.			trans	-108.4	64.6	173.8	55.4	0	0	0	0	112.3	N18 S22	N18-T20 PolarHBondContact O-N 3.31Å; T20-S22 VanDerWaalsContact C-N 3.26Å; T20-S22 PolarHBondContact O-N 3.23Å
21	A	38.8	Very low	53.6	Low	105 Å²	105	99.7 Å²	99.7	87%	0.868	55%	0.554	S	S	*	*			trans	-72.3	81.2	166.1	0	0	0	0	0	110.2
22	S	41.8	Very low	53	Low	74 Å²	74	104.7 Å²	104.7	52%	0.517	58%	0.58	S	S	.	*			trans	-102.6	124.7	159.3	53.9	0	0	0	0	109.6	T20 N24 D27	T20-S22 VanDerWaalsContact C-N 3.26Å; T20-S22 PolarHBondContact O-N 3.23Å; S22-N24 VanDerWaalsContact C-N 3.3Å; S22-N24 PolarHBondContact O-N 3.25Å; S22-D27 PolarHBondContact OG-OD2 3.09Å
23	S	43	Very low	52.6	Low	125 Å²	125	103 Å²	103	87%	0.874	58%	0.578	S	S	*	*			trans	-75.8	59.5	-166.5	59.9	0	0	0	0	114.9
24	N	45.4	Very low	52.6	Low	102 Å²	102	102.9 Å²	102.9	55%	0.545	57%	0.571	S	S	.	*			trans	-116.3	133.2	175.1	-75.8	-22.2	0	0	0	112.1	S22 S26 D27	S22-N24 VanDerWaalsContact C-N 3.3Å; S22-N24 PolarHBondContact O-N 3.25Å; N24-S26 PolarHBondContact O-N 2.81Å; N24-D27 WeakPolarHBondContact O-CB 3.27Å; N24-D27 PolarHBondContact O-N 2.8Å
25	T	52.2	Low	52.7	Low	136 Å²	136	103.2 Å²	103.2	83%	0.834	58%	0.578	S	S	*	*	H	α-helix	trans	-62.9	-20.6	179	39.1	0	0	0	0	114.3	D27	T25-D27 VanDerWaalsContact C-N 3.26Å
26	S	51.9	Low	53.2	Low	74 Å²	74	97.5 Å²	97.5	52%	0.517	57%	0.567	S	S	.	*	H	α-helix	trans	-66.9	-28.3	171.5	52	0	0	0	0	112.9	N24	N24-S26 PolarHBondContact O-N 2.81Å
27	D	51.6	Low	53.8	Low	52 Å²	52	100.7 Å²	100.7	28%	0.278	58%	0.582	S	S	.	*	H	α-helix	trans	-77.4	-32.9	-172.9	-59.1	-10	0	0	0	109.8	S22 N24 T25 E29 Y30 E31	S22-D27 PolarHBondContact OG-OD2 3.09Å; N24-D27 WeakPolarHBondContact O-CB 3.27Å; N24-D27 PolarHBondContact O-N 2.8Å; T25-D27 VanDerWaalsContact C-N 3.26Å; D27-E29 PolarHBondContact O-N 3.12Å; D27-Y30 PolarHBondContact O-N 3.32Å; D27-Y30 VanDerWaalsContact O-N 3.16Å; D27-E31 WeakPolarHBondContact O-CB 3.29Å; D27-E31 WeakPolarHBondContact O-CG 3.49Å; D27-E31 PolarHBondContact O-N 2.85Å
28	A	51.8	Low	54.8	Low	45 Å²	45	96 Å²	96	37%	0.372	56%	0.556	S	S	.	*	H	α-helix	trans	-65.4	-38.5	178	0	0	0	0	0	113.8	Y30 N32	A28-Y30 VanDerWaalsContact C-N 3.3Å; A28-N32 WeakPolarHBondContact O-CB 3.25Å; A28-N32 VanDerWaalsContact O-CG 3.22Å; A28-N32 PolarHBondContact O-N 3.37Å; A28-N32 PolarHBondContact O-ND2 2.75Å
29	E	55.2	Low	56.3	Low	158 Å²	158	90.9 Å²	90.9	74%	0.738	53%	0.528	S	S	*	.	H	α-helix	trans	-65.9	-36.8	173.8	-76.3	-173.3	171.8	0	0	111.2	D27 L33	D27-E29 PolarHBondContact O-N 3.12Å; E29-L33 WeakPolarHBondContact O-CB 3.26Å; E29-L33 PolarHBondContact O-N 3.48Å; E29-L33 VanDerWaalsContact O-N 3.08Å
30	Y	55.4	Low	58.2	Low	168 Å²	168	92.5 Å²	92.5	66%	0.659	52%	0.519	S	S	*	.	H	α-helix	trans	-71.3	-42.5	178.9	-153.6	-89.8	0	0	0	111.8	D27 A28 L33 E34	D27-Y30 PolarHBondContact O-N 3.32Å; D27-Y30 VanDerWaalsContact O-N 3.16Å; A28-Y30 VanDerWaalsContact C-N 3.3Å; Y30-L33 PolarHBondContact O-N 3.24Å; Y30-E34 WeakPolarHBondContact O-CB 3.35Å; Y30-E34 PolarHBondContact O-N 2.86Å
31	E	56.5	Low	60.1	Low	111 Å²	111	88 Å²	88	52%	0.519	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-44.9	173.5	-76.6	176.7	175.8	0	0	111.6	D27 L33 E34 A35	D27-E31 WeakPolarHBondContact O-CB 3.29Å; D27-E31 WeakPolarHBondContact O-CG 3.49Å; D27-E31 PolarHBondContact O-N 2.85Å; E31-L33 VanDerWaalsContact C-N 3.31Å; E31-L33 PolarHBondContact O-N 3.05Å; E31-E34 PolarHBondContact O-N 3.37Å; E31-A35 WeakPolarHBondContact O-CB 3.45Å; E31-A35 PolarHBondContact O-N 3.19Å
32	N	58.6	Low	62.4	Low	108 Å²	108	83.2 Å²	83.2	58%	0.578	45%	0.451	S	S	*	.	H	α-helix	trans	-62.5	-38.3	176.8	-77.9	-39.9	0	0	0	112.2	A28 S36	A28-N32 WeakPolarHBondContact O-CB 3.25Å; A28-N32 VanDerWaalsContact O-CG 3.22Å; A28-N32 PolarHBondContact O-N 3.37Å; A28-N32 PolarHBondContact O-ND2 2.75Å; N32-S36 VanDerWaalsContact O-CB 3.27Å; N32-S36 WeakPolarHBondContact O-CB 3.31Å; N32-S36 PolarHBondContact O-N 2.87Å; N32-S36 PolarHBondContact O-OG 2.99Å
33	L	58.1	Low	64.7	Low	108 Å²	108	84 Å²	84	57%	0.565	45%	0.446	S	S	*	.	H	α-helix	trans	-68.1	-40.1	175.5	-171.2	66.8	0	0	0	111.2	E29 Y30 E31 S36 E37	E29-L33 WeakPolarHBondContact O-CB 3.26Å; E29-L33 PolarHBondContact O-N 3.48Å; E29-L33 VanDerWaalsContact O-N 3.08Å; Y30-L33 PolarHBondContact O-N 3.24Å; E31-L33 VanDerWaalsContact C-N 3.31Å; E31-L33 PolarHBondContact O-N 3.05Å; L33-S36 PolarHBondContact O-N 3.06Å; L33-E37 PolarHBondContact O-N 3.34Å
34	E	68.2	Low	66.8	Low	83 Å²	83	80.6 Å²	80.6	39%	0.388	42%	0.42	S	S	.	.	H	α-helix	trans	-66.1	-44	177.1	-158.6	-170.7	139.3	0	0	111.8	Y30 E31 E37 K38	Y30-E34 WeakPolarHBondContact O-CB 3.35Å; Y30-E34 PolarHBondContact O-N 2.86Å; E31-E34 PolarHBondContact O-N 3.37Å; E34-E37 PolarHBondContact O-N 3.45Å; E34-K38 WeakPolarHBondContact O-CG 3.36Å; E34-K38 PolarHBondContact O-N 2.92Å; E34-K38 WeakPolarHBondContact OE1-CE 3.49Å; E34-K38 IonicContact OE1-NZ 3.58Å; E34-K38 PolarHBondContact OE1-NZ 3.38Å
35	A	67.1	Low	69	Low	36 Å²	36	75.8 Å²	75.8	30%	0.298	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-45.1	174.1	0	0	0	0	0	111.4	E31 E37 K38 L39	E31-A35 WeakPolarHBondContact O-CB 3.45Å; E31-A35 PolarHBondContact O-N 3.19Å; A35-E37 VanDerWaalsContact C-N 3.34Å; A35-E37 PolarHBondContact O-N 3.04Å; A35-K38 WeakPolarHBondContact O-CB 3.21Å; A35-K38 PolarHBondContact O-N 3.47Å; A35-L39 WeakPolarHBondContact O-CG 3.29Å; A35-L39 PolarHBondContact O-N 3.32Å
36	S	73.6	Confident	71	Confident	69 Å²	69	70.7 Å²	70.7	48%	0.483	36%	0.364	S	S	.	.	H	α-helix	trans	-60.6	-41.5	176.9	-63.5	0	0	0	0	112.3	N32 L33 R40	N32-S36 VanDerWaalsContact O-CB 3.27Å; N32-S36 WeakPolarHBondContact O-CB 3.31Å; N32-S36 PolarHBondContact O-N 2.87Å; N32-S36 PolarHBondContact O-OG 2.99Å; L33-S36 PolarHBondContact O-N 3.06Å; S36-R40 WeakPolarHBondContact O-CB 3.32Å; S36-R40 PolarHBondContact O-N 3.34Å
37	E	73.3	Confident	72.9	Confident	90 Å²	90	72 Å²	72	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-69	-38.7	175.7	-79	-60.7	135.1	0	0	112.2	L33 E34 A35 R40 V41	L33-E37 PolarHBondContact O-N 3.34Å; E34-E37 PolarHBondContact O-N 3.45Å; A35-E37 VanDerWaalsContact C-N 3.34Å; A35-E37 PolarHBondContact O-N 3.04Å; E37-R40 PolarHBondContact O-N 3.35Å; E37-R40 IonicContact OE1-NE 3.78Å; E37-R40 IonicContact OE2-CZ 3.92Å; E37-R40 VanDerWaalsContact OE2-CZ 3.3Å; E37-R40 IonicContact OE2-NE 3.91Å; E37-R40 PolarHBondContact OE2-NE 2.9Å; E37-R40 IonicContact OE2-NH2 2.84Å; E37-R40 PolarHBondContact OE2-NH2 3.36Å; E37-V41 WeakPolarHBondContact O-CG2 3.44Å; E37-V41 PolarHBondContact O-N 3.04Å; E37-V41 VanDerWaalsContact O-N 3.09Å
38	K	75.2	Confident	74.6	Confident	25 Å²	25	70.3 Å²	70.3	11%	0.109	36%	0.36	C	S	.	.	H	α-helix	trans	-56.6	-53.4	171.6	-76.7	173.7	-166.7	172.5	0	110.7	L14 R15 E34 A35 R40 V41 F42 I80	L14-K38 HydrophobicContact CD1-CG 4.35Å; L14-K38 HydrophobicContact CD2-CD 4.5Å; L14-K38 HydrophobicContact CD2-CG 3.73Å; R15-K38 PolarHBondContact O-NZ 2.94Å; E34-K38 WeakPolarHBondContact O-CG 3.36Å; E34-K38 PolarHBondContact O-N 2.92Å; E34-K38 WeakPolarHBondContact OE1-CE 3.49Å; E34-K38 IonicContact OE1-NZ 3.58Å; E34-K38 PolarHBondContact OE1-NZ 3.38Å; A35-K38 WeakPolarHBondContact O-CB 3.21Å; A35-K38 PolarHBondContact O-N 3.47Å; K38-R40 VanDerWaalsContact C-N 3.31Å; K38-R40 PolarHBondContact O-N 3.47Å; K38-V41 WeakPolarHBondContact O-CB 3.25Å; K38-V41 PolarHBondContact O-N 3.33Å; K38-F42 HydrophobicContact CB-CE2 4.18Å; K38-F42 WeakPolarHBondContact O-CD2 3.45Å; K38-F42 PolarHBondContact O-N 2.93Å; K38-F42 VanDerWaalsContact O-N 3.08Å; K38-I80 HydrophobicContact CB-CD1 4.2Å; K38-I80 HydrophobicContact CD-CD1 4.05Å
39	L	80.5	Confident	76.6	Confident	30 Å²	30	68.2 Å²	68.2	16%	0.157	34%	0.342	C	S	.	.	H	α-helix	trans	-59.6	-41.2	179.6	-67.9	172.9	0	0	0	112.1	A35 V41 F42 H43 E79 I80 V83	A35-L39 WeakPolarHBondContact O-CG 3.29Å; A35-L39 PolarHBondContact O-N 3.32Å; L39-V41 VanDerWaalsContact C-N 3.28Å; L39-V41 PolarHBondContact O-N 2.77Å; L39-F42 PolarHBondContact O-N 2.9Å; L39-H43 PolarHBondContact O-CD2 3.34Å; L39-H43 VanDerWaalsContact O-CD2 3.24Å; L39-H43 PolarHBondContact O-N 3.04Å; L39-E79 HydrophobicContact CD2-CB 4.08Å; L39-I80 HydrophobicContact CD2-CG1 4.23Å; L39-V83 HydrophobicContact CD2-CB 4.46Å; L39-V83 HydrophobicContact CD2-CG2 3.85Å
40	R	81.6	Confident	78.4	Confident	133 Å²	133	64.6 Å²	64.6	50%	0.502	34%	0.335	S	S	.	.	H	α-helix	trans	-57.5	-42.2	175.3	-169.7	-172.5	65.1	69.6	3.9	111.3	S36 E37 K38 T44	S36-R40 WeakPolarHBondContact O-CB 3.32Å; S36-R40 PolarHBondContact O-N 3.34Å; E37-R40 PolarHBondContact O-N 3.35Å; E37-R40 IonicContact OE1-NE 3.78Å; E37-R40 IonicContact OE2-CZ 3.92Å; E37-R40 VanDerWaalsContact OE2-CZ 3.3Å; E37-R40 IonicContact OE2-NE 3.91Å; E37-R40 PolarHBondContact OE2-NE 2.9Å; E37-R40 IonicContact OE2-NH2 2.84Å; E37-R40 PolarHBondContact OE2-NH2 3.36Å; K38-R40 VanDerWaalsContact C-N 3.31Å; K38-R40 PolarHBondContact O-N 3.47Å; R40-T44 WeakPolarHBondContact O-CG2 3.36Å
41	V	83	Confident	80	Confident	17 Å²	17	61 Å²	61	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-64.2	-47.7	176.5	175.8	0	0	0	0	110.6	L11 E37 K38 L39 H43 T44	L11-V41 HydrophobicContact CD2-CG1 3.6Å; L11-V41 HydrophobicContact CG-CG1 4.2Å; E37-V41 WeakPolarHBondContact O-CG2 3.44Å; E37-V41 PolarHBondContact O-N 3.04Å; E37-V41 VanDerWaalsContact O-N 3.09Å; K38-V41 WeakPolarHBondContact O-CB 3.25Å; K38-V41 PolarHBondContact O-N 3.33Å; L39-V41 VanDerWaalsContact C-N 3.28Å; L39-V41 PolarHBondContact O-N 2.77Å; V41-H43 VanDerWaalsContact C-N 3.31Å; V41-H43 PolarHBondContact O-N 2.77Å; V41-T44 PolarHBondContact O-N 2.84Å; V41-T44 PolarHBondContact O-OG1 2.83Å
42	F	87.3	Confident	81.6	Confident	3 Å²	3	56.8 Å²	56.8	1%	0.013	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-32	-179.3	-64.9	-60.2	0	0	0	113.9	L11 L14 K38 L39 T44 L45 V68 I80 V83 I84	L11-F42 HydrophobicContact CD2-CD1 4.09Å; L11-F42 HydrophobicContact CD2-CE1 3.56Å; L11-F42 HydrophobicContact CD2-CZ 4.22Å; L14-F42 HydrophobicContact CD1-CE1 4.23Å; L14-F42 HydrophobicContact CD1-CE2 3.78Å; L14-F42 HydrophobicContact CD1-CZ 3.36Å; K38-F42 HydrophobicContact CB-CE2 4.18Å; K38-F42 WeakPolarHBondContact O-CD2 3.45Å; K38-F42 PolarHBondContact O-N 2.93Å; K38-F42 VanDerWaalsContact O-N 3.08Å; L39-F42 PolarHBondContact O-N 2.9Å; F42-T44 PolarHBondContact O-N 2.9Å; F42-L45 HydrophobicContact CD1-CD1 4.19Å; F42-L45 WeakPolarHBondContact O-CB 3.28Å; F42-L45 VanDerWaalsContact O-CG 3.28Å; F42-L45 WeakPolarHBondContact O-CG 3.4Å; F42-L45 PolarHBondContact O-N 2.99Å; F42-V68 HydrophobicContact CE1-CG1 3.68Å; F42-V68 HydrophobicContact CZ-CG1 3.74Å; F42-I80 HydrophobicContact CD2-CB 4.4Å; F42-I80 HydrophobicContact CD2-CD1 4.44Å; F42-I80 HydrophobicContact CD2-CG1 4.03Å; F42-I80 HydrophobicContact CD2-CG2 3.79Å; F42-I80 HydrophobicContact CE1-CG2 4.42Å; F42-I80 HydrophobicContact CE2-CB 4.26Å; F42-I80 HydrophobicContact CE2-CD1 3.74Å; F42-I80 HydrophobicContact CE2-CG1 3.82Å; F42-I80 HydrophobicContact CE2-CG2 3.48Å; F42-I80 VanDerWaalsContact CE2-CG2 3.48Å; F42-I80 HydrophobicContact CG-CG2 4.4Å; F42-I80 HydrophobicContact CZ-CG2 3.81Å; F42-V83 HydrophobicContact CB-CB 4.48Å; F42-V83 HydrophobicContact CB-CG1 3.72Å; F42-I84 HydrophobicContact CB-CG1 4.36Å; F42-I84 HydrophobicContact CD1-CD1 3.87Å; F42-I84 HydrophobicContact CD1-CG1 3.74Å; F42-I84 HydrophobicContact CE1-CD1 3.86Å; F42-I84 HydrophobicContact CE1-CG1 4.25Å; F42-I84 HydrophobicContact CG-CD1 4.43Å; F42-I84 HydrophobicContact CG-CG1 4.07Å; F42-I84 HydrophobicContact CZ-CD1 4.4Å
43	H	88.5	Confident	83.2	Confident	90 Å²	90	52.7 Å²	52.7	42%	0.417	30%	0.298	S	S	.	.	H	α-helix	trans	-61.5	-25.1	172.9	-77.4	-43.8	0	0	0	113.5	L39 V41 V83 K87	L39-H43 PolarHBondContact O-CD2 3.34Å; L39-H43 VanDerWaalsContact O-CD2 3.24Å; L39-H43 PolarHBondContact O-N 3.04Å; V41-H43 VanDerWaalsContact C-N 3.31Å; V41-H43 PolarHBondContact O-N 2.77Å; H43-V83 WeakPolarHBondContact ND1-CG1 3.34Å; H43-K87 WeakPolarHBondContact ND1-CE 3.49Å
44	T	88.8	Confident	85	Confident	54 Å²	54	50.2 Å²	50.2	33%	0.331	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-0.5	179.6	67.4	0	0	0	0	114.4	R40 V41 F42 T47 L48	R40-T44 WeakPolarHBondContact O-CG2 3.36Å; V41-T44 PolarHBondContact O-N 2.84Å; V41-T44 PolarHBondContact O-OG1 2.83Å; F42-T44 PolarHBondContact O-N 2.9Å; T44-T47 WeakPolarHBondContact O-CA 3.34Å; T44-T47 WeakPolarHBondContact O-CB 3.39Å; T44-T47 PolarHBondContact O-N 3.46Å; T44-L48 PolarHBondContact O-N 3.46Å
45	L	91.4	Very high	86.2	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-49.7	-45.4	-178.6	-80.5	179	0	0	0	114.3	L11 F42 T47 L48 A49 L61 I65 I84 K87 F91	L11-L45 HydrophobicContact CD1-CD2 4.42Å; F42-L45 HydrophobicContact CD1-CD1 4.19Å; F42-L45 WeakPolarHBondContact O-CB 3.28Å; F42-L45 VanDerWaalsContact O-CG 3.28Å; F42-L45 WeakPolarHBondContact O-CG 3.4Å; F42-L45 PolarHBondContact O-N 2.99Å; L45-T47 VanDerWaalsContact C-N 3.34Å; L45-T47 PolarHBondContact O-N 3.31Å; L45-L48 PolarHBondContact O-N 2.94Å; L45-A49 WeakPolarHBondContact O-CB 3.04Å; L45-A49 PolarHBondContact O-N 3.21Å; L45-L61 HydrophobicContact CD2-CD1 4.17Å; L45-I65 HydrophobicContact CD1-CD1 4.29Å; L45-I65 HydrophobicContact CD2-CD1 4.05Å; L45-I65 HydrophobicContact CD2-CG1 4.18Å; L45-I84 HydrophobicContact CD1-CG1 4.2Å; L45-K87 HydrophobicContact CB-CB 4.43Å; L45-F91 HydrophobicContact CB-CE2 4.31Å; L45-F91 HydrophobicContact CB-CZ 3.99Å
46	P	93.6	Very high	87.5	Confident	29 Å²	29	50.1 Å²	50.1	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-38.7	176.7	-22.9	34.3	0	0	0	113.2	S50 K87 F91 L94	P46-S50 WeakPolarHBondContact O-CB 3.3Å; P46-S50 PolarHBondContact O-N 2.99Å; P46-K87 HydrophobicContact CG-CB 4.08Å; P46-K87 HydrophobicContact CG-CD 4.11Å; P46-K87 HydrophobicContact CG-CG 4.27Å; P46-F91 HydrophobicContact CB-CE2 4.47Å; P46-F91 HydrophobicContact CG-CE2 4.16Å; P46-L94 HydrophobicContact CB-CD1 4.05Å
47	T	91.1	Very high	88.5	Confident	101 Å²	101	46.9 Å²	46.9	62%	0.62	27%	0.265	S	S	*	.	H	α-helix	trans	-66	-41.9	177	-51.7	0	0	0	0	110.9	T44 L45 S50 S51	T44-T47 WeakPolarHBondContact O-CA 3.34Å; T44-T47 WeakPolarHBondContact O-CB 3.39Å; T44-T47 PolarHBondContact O-N 3.46Å; L45-T47 VanDerWaalsContact C-N 3.34Å; L45-T47 PolarHBondContact O-N 3.31Å; T47-S50 PolarHBondContact O-N 3.48Å; T47-S51 PolarHBondContact O-N 3.45Å
48	L	88.7	Confident	89.6	Confident	17 Å²	17	45.2 Å²	45.2	9%	0.089	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-50.4	176.2	-177.2	64.6	0	0	0	111.1	L4 V7 L11 T44 L45 S50 S51 L52 L61	L4-L48 HydrophobicContact CD1-CD1 3.84Å; V7-L48 HydrophobicContact CB-CD1 4.38Å; V7-L48 HydrophobicContact CG1-CD1 3.97Å; V7-L48 HydrophobicContact CG1-CD2 3.71Å; V7-L48 HydrophobicContact CG1-CG 4.48Å; L11-L48 HydrophobicContact CD1-CD2 4.15Å; T44-L48 PolarHBondContact O-N 3.46Å; L45-L48 PolarHBondContact O-N 2.94Å; L48-S50 VanDerWaalsContact C-N 3.31Å; L48-S50 PolarHBondContact O-N 3.49Å; L48-S51 PolarHBondContact O-N 3.32Å; L48-S51 PolarHBondContact O-OG 3.08Å; L48-L52 HydrophobicContact CG-CD1 4.24Å; L48-L52 WeakPolarHBondContact O-CG 3.19Å; L48-L52 PolarHBondContact O-N 3.48Å; L48-L61 HydrophobicContact CD2-CD1 3.71Å; L48-L61 HydrophobicContact CD2-CD2 4.17Å; L48-L61 HydrophobicContact CG-CD2 4.25Å
49	A	92.7	Very high	90.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-41.6	177.4	0	0	0	0	0	112	L45 S51 L52 G53 T57 L61 F91 L94	L45-A49 WeakPolarHBondContact O-CB 3.04Å; L45-A49 PolarHBondContact O-N 3.21Å; A49-S51 VanDerWaalsContact C-N 3.28Å; A49-S51 PolarHBondContact O-N 3.46Å; A49-L52 PolarHBondContact O-N 3.44Å; A49-G53 PolarHBondContact O-N 2.72Å; A49-T57 WeakPolarHBondContact CA-OG1 3.12Å; A49-T57 HydrophobicContact CB-CG2 3.84Å; A49-T57 PolarHBondContact O-OG1 2.83Å; A49-T57 VanDerWaalsContact O-OG1 3.11Å; A49-L61 HydrophobicContact CB-CD2 3.77Å; A49-F91 HydrophobicContact CB-CD1 4.48Å; A49-F91 HydrophobicContact CB-CE1 3.8Å; A49-F91 HydrophobicContact CB-CZ 3.97Å; A49-L94 HydrophobicContact CB-CB 3.99Å; A49-L94 HydrophobicContact CB-CD1 4.02Å; A49-L94 HydrophobicContact CB-CG 4.43Å
50	S	93	Very high	91	Very high	83 Å²	83	53.1 Å²	53.1	58%	0.58	29%	0.29	S	S	*	.	H	α-helix	trans	-61.6	-35.6	174.7	-174.9	0	0	0	0	112.8	P46 T47 L48	P46-S50 WeakPolarHBondContact O-CB 3.3Å; P46-S50 PolarHBondContact O-N 2.99Å; T47-S50 PolarHBondContact O-N 3.48Å; L48-S50 VanDerWaalsContact C-N 3.31Å; L48-S50 PolarHBondContact O-N 3.49Å
51	S	90.3	Very high	91.5	Very high	91 Å²	91	46.8 Å²	46.8	64%	0.636	27%	0.266	S	S	*	.	H	α-helix	trans	-76.6	-30.7	178.9	72.2	0	0	0	0	113.3	T47 L48 A49	T47-S51 PolarHBondContact O-N 3.45Å; L48-S51 PolarHBondContact O-N 3.32Å; L48-S51 PolarHBondContact O-OG 3.08Å; A49-S51 VanDerWaalsContact C-N 3.28Å; A49-S51 PolarHBondContact O-N 3.46Å
52	L	89.5	Confident	92.1	Very high	23 Å²	23	46.5 Å²	46.5	12%	0.12	26%	0.264	C	S	.	.	H	α-helix	trans	-72	-33.2	175.5	-81.2	177	0	0	0	112.7	L4 L48 A49 D56 L61	L4-L52 HydrophobicContact CD1-CD1 4Å; L4-L52 HydrophobicContact CD1-CD2 3.17Å; L4-L52 HydrophobicContact CD1-CG 3.7Å; L4-L52 HydrophobicContact CD2-CD2 3.22Å; L4-L52 HydrophobicContact CG-CD2 3.73Å; L48-L52 HydrophobicContact CG-CD1 4.24Å; L48-L52 WeakPolarHBondContact O-CG 3.19Å; L48-L52 PolarHBondContact O-N 3.48Å; A49-L52 PolarHBondContact O-N 3.44Å; L52-D56 HydrophobicContact CB-CB 3.98Å; L52-D56 HydrophobicContact CD2-CB 3.74Å; L52-D56 HydrophobicContact CG-CB 4.36Å; L52-L61 HydrophobicContact CD1-CB 3.83Å; L52-L61 HydrophobicContact CD1-CD2 4Å; L52-L61 HydrophobicContact CD1-CG 4.42Å
53	G	92.3	Very high	92.5	Very high	22 Å²	22	49.1 Å²	49.1	23%	0.227	28%	0.282	C	S	.	.	H	α-helix	trans	74.2	174.1	-167	0	0	0	0	0	112.6	A49 V55 T57	A49-G53 PolarHBondContact O-N 2.72Å; G53-V55 PolarHBondContact O-N 3.43Å; G53-T57 VanDerWaalsContact O-CB 3.25Å; G53-T57 WeakPolarHBondContact O-CB 3.3Å; G53-T57 PolarHBondContact O-N 3.43Å; G53-T57 PolarHBondContact O-OG1 3.36Å
54	P	94.6	Very high	92.6	Very high	57 Å²	57	45 Å²	45	37%	0.37	26%	0.263	S	S	.	.	H	α-helix	trans	-61.4	-43.7	-168.6	-29.2	37.8	0	0	0	115.3	T57 R58 L94	P54-T57 PolarHBondContact O-N 3.46Å; P54-R58 VanDerWaalsContact O-CG 3.31Å; P54-R58 WeakPolarHBondContact O-CG 3.47Å; P54-R58 PolarHBondContact O-N 2.71Å; P54-L94 WeakPolarHBondContact CA-O 3.46Å
55	V	95.1	Very high	92.8	Very high	73 Å²	73	42.7 Å²	42.7	44%	0.442	25%	0.248	S	C	.	.	H	α-helix	trans	-65.1	-54.9	-173.9	-180	0	0	0	0	110.8	G53 T57 R58 E59	G53-V55 PolarHBondContact O-N 3.43Å; V55-T57 VanDerWaalsContact C-N 3.27Å; V55-T57 PolarHBondContact O-N 3.14Å; V55-R58 PolarHBondContact O-N 3.01Å; V55-R58 VanDerWaalsContact O-N 3.14Å; V55-E59 PolarHBondContact O-N 3.42Å
56	D	92.7	Very high	93	Very high	44 Å²	44	44.7 Å²	44.7	24%	0.235	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-30.9	179.2	-86	-3.8	0	0	0	112.2	L52 R58 K60 L61	L52-D56 HydrophobicContact CB-CB 3.98Å; L52-D56 HydrophobicContact CD2-CB 3.74Å; L52-D56 HydrophobicContact CG-CB 4.36Å; D56-R58 VanDerWaalsContact C-N 3.34Å; D56-K60 HydrophobicContact CB-CD 4.28Å; D56-K60 WeakPolarHBondContact O-CA 3.34Å; D56-K60 VanDerWaalsContact O-CB 3.32Å; D56-K60 WeakPolarHBondContact O-CB 2.98Å; D56-K60 PolarHBondContact O-N 3.24Å; D56-K60 WeakPolarHBondContact OD1-CE 3.11Å; D56-K60 IonicContact OD1-NZ 3.33Å; D56-K60 PolarHBondContact OD1-NZ 2.82Å; D56-K60 IonicContact OD2-NZ 3.53Å; D56-K60 PolarHBondContact OD2-NZ 3.41Å; D56-L61 PolarHBondContact O-N 3.13Å
57	T	95	Very high	93	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-60	-46.3	172.7	-64.1	0	0	0	0	110.5	A49 G53 P54 V55 L61 I62 F91 V95	A49-T57 WeakPolarHBondContact CA-OG1 3.12Å; A49-T57 HydrophobicContact CB-CG2 3.84Å; A49-T57 PolarHBondContact O-OG1 2.83Å; A49-T57 VanDerWaalsContact O-OG1 3.11Å; G53-T57 VanDerWaalsContact O-CB 3.25Å; G53-T57 WeakPolarHBondContact O-CB 3.3Å; G53-T57 PolarHBondContact O-N 3.43Å; G53-T57 PolarHBondContact O-OG1 3.36Å; P54-T57 PolarHBondContact O-N 3.46Å; V55-T57 VanDerWaalsContact C-N 3.27Å; V55-T57 PolarHBondContact O-N 3.14Å; T57-L61 HydrophobicContact CG2-CD2 4.39Å; T57-L61 WeakPolarHBondContact O-CB 3.32Å; T57-L61 PolarHBondContact O-N 3.26Å; T57-I62 HydrophobicContact CG2-CG1 4.39Å; T57-I62 WeakPolarHBondContact O-CG1 3.42Å; T57-I62 PolarHBondContact O-N 2.91Å; T57-F91 HydrophobicContact CG2-CD1 4.42Å; T57-F91 HydrophobicContact CG2-CE1 4.37Å; T57-V95 HydrophobicContact CG2-CG1 4.01Å
58	R	96.1	Very high	93	Very high	56 Å²	56	43 Å²	43	21%	0.211	25%	0.248	C	C	.	.	I	π-helix	trans	-68.4	-45.7	178.6	-68.1	-177.1	-57.7	-124.8	20.8	113.3	P54 V55 D56 P63 V95 H100 L103	P54-R58 VanDerWaalsContact O-CG 3.31Å; P54-R58 WeakPolarHBondContact O-CG 3.47Å; P54-R58 PolarHBondContact O-N 2.71Å; V55-R58 PolarHBondContact O-N 3.01Å; V55-R58 VanDerWaalsContact O-N 3.14Å; D56-R58 VanDerWaalsContact C-N 3.34Å; R58-P63 VanDerWaalsContact O-CD 3.27Å; R58-P63 WeakPolarHBondContact O-CD 3.41Å; R58-V95 VanDerWaalsContact CD-O 3.28Å; R58-V95 WeakPolarHBondContact CD-O 3.36Å; R58-V95 HydrophobicContact CG-CB 4.15Å; R58-V95 PolarHBondContact NH1-O 3.41Å; R58-H100 HydrophobicContact CG-CB 4.49Å; R58-H100 VanDerWaalsContact CZ-NE2 3.29Å; R58-H100 PolarHBondContact NH1-CD2 3.13Å; R58-H100 PolarHBondContact NH1-NE2 2.93Å; R58-L103 HydrophobicContact CB-CD1 4.18Å; R58-L103 HydrophobicContact CG-CD1 3.9Å
59	E	94.1	Very high	93.3	Very high	131 Å²	131	42.2 Å²	42.2	61%	0.612	24%	0.244	S	C	*	.	I	π-helix	trans	-84.2	-26.7	-169.6	-67.4	-179.3	-178.1	0	0	113.4	V55	V55-E59 PolarHBondContact O-N 3.42Å
60	K	91.2	Very high	93.4	Very high	89 Å²	89	44.1 Å²	44.1	39%	0.387	26%	0.258	S	S	.	.	I	π-helix	trans	-117.9	-52.4	-174.6	-58.9	169.9	-178.2	155	0	112.2	L8 D56 T64	L8-K60 HydrophobicContact CD1-CB 4.29Å; D56-K60 HydrophobicContact CB-CD 4.28Å; D56-K60 WeakPolarHBondContact O-CA 3.34Å; D56-K60 VanDerWaalsContact O-CB 3.32Å; D56-K60 WeakPolarHBondContact O-CB 2.98Å; D56-K60 PolarHBondContact O-N 3.24Å; D56-K60 WeakPolarHBondContact OD1-CE 3.11Å; D56-K60 IonicContact OD1-NZ 3.33Å; D56-K60 PolarHBondContact OD1-NZ 2.82Å; D56-K60 IonicContact OD2-NZ 3.53Å; D56-K60 PolarHBondContact OD2-NZ 3.41Å; K60-T64 WeakPolarHBondContact O-CB 3.29Å; K60-T64 PolarHBondContact O-N 2.77Å; K60-T64 PolarHBondContact O-OG1 3.05Å
61	L	92.8	Very high	93.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.25	C	C	.	.	I	π-helix	trans	-74.5	-47.3	-170.9	-176.3	58.8	0	0	0	112.3	L8 L11 L45 L48 A49 L52 D56 T57 T64 I65 F91	L8-L61 HydrophobicContact CD2-CD1 4.03Å; L11-L61 HydrophobicContact CD1-CD1 4.19Å; L45-L61 HydrophobicContact CD2-CD1 4.17Å; L48-L61 HydrophobicContact CD2-CD1 3.71Å; L48-L61 HydrophobicContact CD2-CD2 4.17Å; L48-L61 HydrophobicContact CG-CD2 4.25Å; A49-L61 HydrophobicContact CB-CD2 3.77Å; L52-L61 HydrophobicContact CD1-CB 3.83Å; L52-L61 HydrophobicContact CD1-CD2 4Å; L52-L61 HydrophobicContact CD1-CG 4.42Å; D56-L61 PolarHBondContact O-N 3.13Å; T57-L61 HydrophobicContact CG2-CD2 4.39Å; T57-L61 WeakPolarHBondContact O-CB 3.32Å; T57-L61 PolarHBondContact O-N 3.26Å; L61-T64 CarbonylContact O-C 3.48Å; L61-T64 WeakPolarHBondContact O-CB 3.42Å; L61-T64 PolarHBondContact O-N 3.46Å; L61-T64 VanDerWaalsContact O-N 3.13Å; L61-I65 HydrophobicContact CD1-CD1 4.09Å; L61-I65 HydrophobicContact CD1-CG1 4.08Å; L61-I65 HydrophobicContact CD2-CD1 4.38Å; L61-I65 HydrophobicContact CG-CD1 3.78Å; L61-I65 HydrophobicContact CG-CG1 4.23Å; L61-I65 WeakPolarHBondContact O-CG1 3.27Å; L61-I65 PolarHBondContact O-N 3.47Å; L61-F91 HydrophobicContact CD2-CE1 4.25Å
62	I	95.4	Very high	93.3	Very high	12 Å²	12	39.5 Å²	39.5	6%	0.062	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-47.9	-179.8	-70.3	-67.3	0	0	0	112.1	T57 T64 I65 S66 F91 V95 L103 I104 I107	T57-I62 HydrophobicContact CG2-CG1 4.39Å; T57-I62 WeakPolarHBondContact O-CG1 3.42Å; T57-I62 PolarHBondContact O-N 2.91Å; I62-T64 VanDerWaalsContact C-N 3.33Å; I62-T64 PolarHBondContact O-N 2.9Å; I62-I65 PolarHBondContact O-N 2.93Å; I62-S66 PolarHBondContact O-N 3.29Å; I62-F91 HydrophobicContact CD1-CD1 4.12Å; I62-F91 HydrophobicContact CD1-CE1 4.48Å; I62-V95 HydrophobicContact CD1-CG1 4.13Å; I62-V95 HydrophobicContact CG1-CG1 4.17Å; I62-L103 HydrophobicContact CG2-CB 4.33Å; I62-I104 HydrophobicContact CD1-CG1 3.9Å; I62-I107 HydrophobicContact CG2-CD1 3.91Å
63	P	94.8	Very high	93.5	Very high	58 Å²	58	40 Å²	40	38%	0.377	22%	0.222	S	C	.	.	H	α-helix	trans	-58.9	-42.5	172.8	-27.2	35.6	0	0	0	112.8	R58 I65 S66 D67	R58-P63 VanDerWaalsContact O-CD 3.27Å; R58-P63 WeakPolarHBondContact O-CD 3.41Å; P63-I65 VanDerWaalsContact C-N 3.33Å; P63-I65 PolarHBondContact O-N 2.74Å; P63-S66 WeakPolarHBondContact O-CB 3.49Å; P63-S66 PolarHBondContact O-N 2.87Å; P63-S66 VanDerWaalsContact O-N 3.13Å; P63-D67 PolarHBondContact O-N 3.25Å
64	T	91.5	Very high	93.5	Very high	4 Å²	4	45.5 Å²	45.5	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-40.2	177.8	-55.7	0	0	0	0	111.6	L11 K12 K60 L61 I62 S66 D67 V68	L11-T64 HydrophobicContact CB-CG2 4.12Å; K12-T64 WeakPolarHBondContact CE-OG1 3.3Å; K12-T64 HydrophobicContact CG-CG2 3.91Å; K60-T64 WeakPolarHBondContact O-CB 3.29Å; K60-T64 PolarHBondContact O-N 2.77Å; K60-T64 PolarHBondContact O-OG1 3.05Å; L61-T64 CarbonylContact O-C 3.48Å; L61-T64 WeakPolarHBondContact O-CB 3.42Å; L61-T64 PolarHBondContact O-N 3.46Å; L61-T64 VanDerWaalsContact O-N 3.13Å; I62-T64 VanDerWaalsContact C-N 3.33Å; I62-T64 PolarHBondContact O-N 2.9Å; T64-S66 VanDerWaalsContact C-N 3.34Å; T64-D67 PolarHBondContact O-N 3.25Å; T64-V68 WeakPolarHBondContact O-CB 3.41Å; T64-V68 VanDerWaalsContact O-CG2 3.25Å; T64-V68 WeakPolarHBondContact O-CG2 3.28Å; T64-V68 PolarHBondContact O-N 2.98Å
65	I	93.8	Very high	93.2	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-41.8	174.5	-67.4	169.3	0	0	0	110.1	L45 L61 I62 P63 D67 V68 V69 I84 L88 F91 I107	L45-I65 HydrophobicContact CD1-CD1 4.29Å; L45-I65 HydrophobicContact CD2-CD1 4.05Å; L45-I65 HydrophobicContact CD2-CG1 4.18Å; L61-I65 HydrophobicContact CD1-CD1 4.09Å; L61-I65 HydrophobicContact CD1-CG1 4.08Å; L61-I65 HydrophobicContact CD2-CD1 4.38Å; L61-I65 HydrophobicContact CG-CD1 3.78Å; L61-I65 HydrophobicContact CG-CG1 4.23Å; L61-I65 WeakPolarHBondContact O-CG1 3.27Å; L61-I65 PolarHBondContact O-N 3.47Å; I62-I65 PolarHBondContact O-N 2.93Å; P63-I65 VanDerWaalsContact C-N 3.33Å; P63-I65 PolarHBondContact O-N 2.74Å; I65-D67 PolarHBondContact O-N 2.93Å; I65-V68 PolarHBondContact O-N 3.05Å; I65-V69 HydrophobicContact CG2-CG2 4.16Å; I65-V69 WeakPolarHBondContact O-CB 3.03Å; I65-V69 VanDerWaalsContact O-CG2 3.28Å; I65-V69 WeakPolarHBondContact O-CG2 3.44Å; I65-V69 PolarHBondContact O-N 2.77Å; I65-I84 HydrophobicContact CG2-CG2 3.82Å; I65-L88 HydrophobicContact CD1-CD2 4.16Å; I65-L88 HydrophobicContact CG2-CD1 4.28Å; I65-L88 HydrophobicContact CG2-CD2 4.41Å; I65-F91 HydrophobicContact CD1-CE1 4.04Å; I65-F91 HydrophobicContact CD1-CZ 4.29Å; I65-I107 HydrophobicContact CG2-CD1 4.31Å; I65-I107 HydrophobicContact CG2-CG2 4.25Å
66	S	95.3	Very high	92.9	Very high	43 Å²	43	43 Å²	43	30%	0.301	24%	0.242	S	C	.	.	H	α-helix	trans	-60.4	-43.8	177.5	-167	0	0	0	0	112.3	I62 P63 T64 V69 S70	I62-S66 PolarHBondContact O-N 3.29Å; P63-S66 WeakPolarHBondContact O-CB 3.49Å; P63-S66 PolarHBondContact O-N 2.87Å; P63-S66 VanDerWaalsContact O-N 3.13Å; T64-S66 VanDerWaalsContact C-N 3.34Å; S66-V69 PolarHBondContact O-N 2.93Å; S66-S70 PolarHBondContact O-N 2.99Å; S66-S70 PolarHBondContact O-OG 3.5Å
67	D	92.7	Very high	92.8	Very high	89 Å²	89	43 Å²	43	48%	0.476	24%	0.242	S	C	.	.	H	α-helix	trans	-63.6	-46	176.1	-66.2	-18.9	0	0	0	110.9	P63 T64 I65 V69 S70 N71	P63-D67 PolarHBondContact O-N 3.25Å; T64-D67 PolarHBondContact O-N 3.25Å; I65-D67 PolarHBondContact O-N 2.93Å; D67-V69 PolarHBondContact O-N 2.77Å; D67-S70 PolarHBondContact O-N 2.96Å; D67-N71 VanDerWaalsContact O-CG 3.29Å; D67-N71 PolarHBondContact O-N 3.2Å; D67-N71 PolarHBondContact O-ND2 2.88Å
68	V	91.1	Very high	92.7	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-42.8	177.8	165.8	0	0	0	0	111.8	F16 F42 T64 I65 S70 N71 A72 I84	F16-V68 HydrophobicContact CZ-CG1 3.82Å; F42-V68 HydrophobicContact CE1-CG1 3.68Å; F42-V68 HydrophobicContact CZ-CG1 3.74Å; T64-V68 WeakPolarHBondContact O-CB 3.41Å; T64-V68 VanDerWaalsContact O-CG2 3.25Å; T64-V68 WeakPolarHBondContact O-CG2 3.28Å; T64-V68 PolarHBondContact O-N 2.98Å; I65-V68 PolarHBondContact O-N 3.05Å; V68-S70 VanDerWaalsContact C-N 3.32Å; V68-S70 PolarHBondContact O-N 3.36Å; V68-N71 PolarHBondContact O-N 3Å; V68-A72 VanDerWaalsContact O-CB 3.27Å; V68-A72 WeakPolarHBondContact O-CB 3.49Å; V68-A72 PolarHBondContact O-N 2.89Å; V68-I84 HydrophobicContact CG1-CD1 3.79Å
69	V	94.5	Very high	92.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.1	-42.1	176.9	164.1	0	0	0	0	110.7	I65 S66 D67 A72 I73 L81 I84 I107 I111	I65-V69 HydrophobicContact CG2-CG2 4.16Å; I65-V69 WeakPolarHBondContact O-CB 3.03Å; I65-V69 VanDerWaalsContact O-CG2 3.28Å; I65-V69 WeakPolarHBondContact O-CG2 3.44Å; I65-V69 PolarHBondContact O-N 2.77Å; S66-V69 PolarHBondContact O-N 2.93Å; D67-V69 PolarHBondContact O-N 2.77Å; V69-A72 PolarHBondContact O-N 2.99Å; V69-I73 HydrophobicContact CG1-CD1 3.79Å; V69-I73 HydrophobicContact CG1-CG1 4.43Å; V69-I73 VanDerWaalsContact O-CG1 3.25Å; V69-I73 WeakPolarHBondContact O-CG1 3.39Å; V69-I73 PolarHBondContact O-N 3.4Å; V69-L81 HydrophobicContact CB-CD2 4.49Å; V69-L81 HydrophobicContact CG1-CD2 4.09Å; V69-I84 HydrophobicContact CG2-CD1 4.06Å; V69-I84 HydrophobicContact CG2-CG2 3.77Å; V69-I107 HydrophobicContact CB-CG2 4.2Å; V69-I107 HydrophobicContact CG1-CG2 4.25Å; V69-I107 HydrophobicContact CG2-CG2 3.79Å; V69-I111 HydrophobicContact CG1-CD1 4.03Å; V69-I111 HydrophobicContact CG1-CG1 3.54Å; V69-I111 HydrophobicContact CG2-CD1 4.18Å
70	S	94.7	Very high	92.3	Very high	41 Å²	41	42.5 Å²	42.5	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-62.7	-46.5	177.8	-52.8	0	0	0	0	111.1	S66 D67 V68 A72 I73 D74	S66-S70 PolarHBondContact O-N 2.99Å; S66-S70 PolarHBondContact O-OG 3.5Å; D67-S70 PolarHBondContact O-N 2.96Å; V68-S70 VanDerWaalsContact C-N 3.32Å; V68-S70 PolarHBondContact O-N 3.36Å; S70-A72 VanDerWaalsContact C-N 3.33Å; S70-A72 PolarHBondContact O-N 3.14Å; S70-I73 PolarHBondContact O-N 3.35Å; S70-D74 PolarHBondContact O-N 2.98Å
71	N	91.3	Very high	92.5	Very high	77 Å²	77	38.2 Å²	38.2	41%	0.412	23%	0.226	S	C	.	.	H	α-helix	trans	-63.6	-38.2	176.5	-64.2	-24.7	0	0	0	112.6	F16 D67 V68 D74 A75	F16-N71 HydrophobicContact CD2-CB 3.63Å; F16-N71 HydrophobicContact CE2-CB 3.95Å; F16-N71 HydrophobicContact CG-CB 4.13Å; D67-N71 VanDerWaalsContact O-CG 3.29Å; D67-N71 PolarHBondContact O-N 3.2Å; D67-N71 PolarHBondContact O-ND2 2.88Å; V68-N71 PolarHBondContact O-N 3Å; N71-D74 PolarHBondContact O-N 3.18Å; N71-A75 VanDerWaalsContact O-CB 3.3Å; N71-A75 WeakPolarHBondContact O-CB 3.32Å; N71-A75 PolarHBondContact O-N 2.87Å
72	A	91.4	Very high	92.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70.2	-33.8	178	0	0	0	0	0	112	F16 V68 V69 S70 G76 D77 I80 L81	F16-A72 HydrophobicContact CD1-CB 4.23Å; F16-A72 HydrophobicContact CE1-CB 3.96Å; V68-A72 VanDerWaalsContact O-CB 3.27Å; V68-A72 WeakPolarHBondContact O-CB 3.49Å; V68-A72 PolarHBondContact O-N 2.89Å; V69-A72 PolarHBondContact O-N 2.99Å; S70-A72 VanDerWaalsContact C-N 3.33Å; S70-A72 PolarHBondContact O-N 3.14Å; A72-G76 PolarHBondContact O-N 2.97Å; A72-D77 HydrophobicContact CB-CB 4.33Å; A72-D77 PolarHBondContact O-N 3.07Å; A72-I80 HydrophobicContact CB-CG2 4.22Å; A72-L81 HydrophobicContact CB-CD2 3.68Å; A72-L81 HydrophobicContact CB-CG 3.94Å
73	I	93.2	Very high	92.6	Very high	33 Å²	33	40.6 Å²	40.6	17%	0.169	24%	0.238	C	C	.	.	H	α-helix	trans	-63	-50.7	170.4	-71.7	164.3	0	0	0	109.9	V69 S70 A75 G76 L81	V69-I73 HydrophobicContact CG1-CD1 3.79Å; V69-I73 HydrophobicContact CG1-CG1 4.43Å; V69-I73 VanDerWaalsContact O-CG1 3.25Å; V69-I73 WeakPolarHBondContact O-CG1 3.39Å; V69-I73 PolarHBondContact O-N 3.4Å; S70-I73 PolarHBondContact O-N 3.35Å; I73-A75 PolarHBondContact O-N 3.32Å; I73-G76 PolarHBondContact O-N 3.15Å; I73-L81 HydrophobicContact CG1-CD1 3.93Å; I73-L81 HydrophobicContact CG1-CD2 3.97Å
74	D	91.6	Very high	92.7	Very high	138 Å²	138	37.9 Å²	37.9	74%	0.738	22%	0.22	S	C	*	.	H	α-helix	trans	-62	-31.2	-178.7	-70.2	-24.1	0	0	0	112.6	S70 N71	S70-D74 PolarHBondContact O-N 2.98Å; N71-D74 PolarHBondContact O-N 3.18Å
75	A	89.9	Confident	93	Very high	27 Å²	27	37.7 Å²	37.7	22%	0.223	22%	0.219	C	C	.	.	H	α-helix	trans	-86.2	-12.1	177.3	0	0	0	0	0	114.7	F16 N71 I73	F16-A75 HydrophobicContact CB-CB 3.66Å; F16-A75 VanDerWaalsContact O-CB 3.24Å; F16-A75 WeakPolarHBondContact O-CB 3.41Å; N71-A75 VanDerWaalsContact O-CB 3.3Å; N71-A75 WeakPolarHBondContact O-CB 3.32Å; N71-A75 PolarHBondContact O-N 2.87Å; I73-A75 PolarHBondContact O-N 3.32Å
76	G	88.2	Confident	93.2	Very high	49 Å²	49	42 Å²	42	51%	0.505	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	34.3	-174.2	0	0	0	0	0	114	A72 I73 D78	A72-G76 PolarHBondContact O-N 2.97Å; I73-G76 PolarHBondContact O-N 3.15Å; G76-D78 PolarHBondContact O-N 3.36Å; G76-D78 VanDerWaalsContact O-N 3.15Å
77	D	90.3	Very high	93.2	Very high	44 Å²	44	42.7 Å²	42.7	24%	0.235	24%	0.236	C	C	.	.			trans	-87.6	75.5	-178.1	-160.3	-38	0	0	0	111.7	A72 E79 I80 L81	A72-D77 HydrophobicContact CB-CB 4.33Å; A72-D77 PolarHBondContact O-N 3.07Å; D77-E79 VanDerWaalsContact C-N 3.29Å; D77-E79 PolarHBondContact O-N 3.17Å; D77-I80 HydrophobicContact CB-CB 4.34Å; D77-I80 HydrophobicContact CB-CD1 4.33Å; D77-I80 PolarHBondContact O-N 2.87Å; D77-I80 WeakPolarHBondContact OD1-CB 3.37Å; D77-I80 VanDerWaalsContact OD1-CG1 3.28Å; D77-I80 WeakPolarHBondContact OD1-CG1 3.49Å; D77-I80 PolarHBondContact OD1-N 3.14Å; D77-I80 WeakPolarHBondContact OD2-CD1 3.13Å; D77-L81 WeakPolarHBondContact O-CG 3.1Å; D77-L81 PolarHBondContact O-N 3.13Å
78	D	92.9	Very high	93.4	Very high	59 Å²	59	38.4 Å²	38.4	32%	0.316	21%	0.214	S	C	.	.	H	α-helix	trans	-58.7	-36.2	-175.4	-71.1	-22.7	0	0	0	113.3	G76 L81 M82 I115 V120	G76-D78 PolarHBondContact O-N 3.36Å; G76-D78 VanDerWaalsContact O-N 3.15Å; D78-L81 PolarHBondContact O-N 3.45Å; D78-M82 VanDerWaalsContact O-CB 3.29Å; D78-M82 WeakPolarHBondContact O-CB 3.47Å; D78-M82 PolarHBondContact O-N 3.23Å; D78-I115 WeakPolarHBondContact OD1-CD1 3.49Å; D78-V120 HydrophobicContact CB-CG2 3.87Å; D78-V120 WeakPolarHBondContact O-CG2 3.39Å
79	E	91.1	Very high	93.6	Very high	115 Å²	115	38.8 Å²	38.8	54%	0.537	22%	0.218	S	C	.	.	H	α-helix	trans	-66.5	-45.2	-179.5	-65.8	-167.7	167.2	0	0	111.3	L39 D77 M82 V83	L39-E79 HydrophobicContact CD2-CB 4.08Å; D77-E79 VanDerWaalsContact C-N 3.29Å; D77-E79 PolarHBondContact O-N 3.17Å; E79-M82 PolarHBondContact O-N 3.47Å; E79-V83 WeakPolarHBondContact O-CG2 3.47Å; E79-V83 PolarHBondContact O-N 3.31Å
80	I	90.9	Very high	93.7	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-47.2	175.2	-70.4	176.9	0	0	0	110.2	F16 K38 L39 F42 A72 D77 M82 V83 I84	F16-I80 HydrophobicContact CD1-CD1 4.36Å; F16-I80 HydrophobicContact CE1-CD1 3.73Å; F16-I80 HydrophobicContact CE1-CG2 4.5Å; K38-I80 HydrophobicContact CB-CD1 4.2Å; K38-I80 HydrophobicContact CD-CD1 4.05Å; L39-I80 HydrophobicContact CD2-CG1 4.23Å; F42-I80 HydrophobicContact CD2-CB 4.4Å; F42-I80 HydrophobicContact CD2-CD1 4.44Å; F42-I80 HydrophobicContact CD2-CG1 4.03Å; F42-I80 HydrophobicContact CD2-CG2 3.79Å; F42-I80 HydrophobicContact CE1-CG2 4.42Å; F42-I80 HydrophobicContact CE2-CB 4.26Å; F42-I80 HydrophobicContact CE2-CD1 3.74Å; F42-I80 HydrophobicContact CE2-CG1 3.82Å; F42-I80 HydrophobicContact CE2-CG2 3.48Å; F42-I80 VanDerWaalsContact CE2-CG2 3.48Å; F42-I80 HydrophobicContact CG-CG2 4.4Å; F42-I80 HydrophobicContact CZ-CG2 3.81Å; A72-I80 HydrophobicContact CB-CG2 4.22Å; D77-I80 HydrophobicContact CB-CB 4.34Å; D77-I80 HydrophobicContact CB-CD1 4.33Å; D77-I80 PolarHBondContact O-N 2.87Å; D77-I80 WeakPolarHBondContact OD1-CB 3.37Å; D77-I80 VanDerWaalsContact OD1-CG1 3.28Å; D77-I80 WeakPolarHBondContact OD1-CG1 3.49Å; D77-I80 PolarHBondContact OD1-N 3.14Å; D77-I80 WeakPolarHBondContact OD2-CD1 3.13Å; I80-M82 VanDerWaalsContact C-N 3.32Å; I80-M82 PolarHBondContact O-N 2.88Å; I80-V83 PolarHBondContact O-N 3.31Å; I80-I84 HydrophobicContact CG2-CD1 3.55Å; I80-I84 HydrophobicContact CG2-CG1 4.21Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.18Å; I80-I84 PolarHBondContact O-N 3.34Å
81	L	95.6	Very high	93.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.1	-43.8	179	-69.4	174.5	0	0	0	111.6	V69 A72 I73 D77 D78 I84 A85 I111 I115 V120	V69-L81 HydrophobicContact CB-CD2 4.49Å; V69-L81 HydrophobicContact CG1-CD2 4.09Å; A72-L81 HydrophobicContact CB-CD2 3.68Å; A72-L81 HydrophobicContact CB-CG 3.94Å; I73-L81 HydrophobicContact CG1-CD1 3.93Å; I73-L81 HydrophobicContact CG1-CD2 3.97Å; D77-L81 WeakPolarHBondContact O-CG 3.1Å; D77-L81 PolarHBondContact O-N 3.13Å; D78-L81 PolarHBondContact O-N 3.45Å; L81-I84 PolarHBondContact O-N 3.35Å; L81-A85 WeakPolarHBondContact O-CB 3.38Å; L81-A85 PolarHBondContact O-N 2.85Å; L81-I111 HydrophobicContact CD2-CG1 4.3Å; L81-I115 HydrophobicContact CD1-CD1 3.82Å; L81-V120 HydrophobicContact CB-CG1 3.76Å
82	M	95.9	Very high	93.9	Very high	54 Å²	54	36.1 Å²	36.1	27%	0.266	21%	0.206	S	C	.	.	H	α-helix	trans	-60.3	-47.8	176.6	-174.4	173.7	57.9	0	0	111.3	D78 E79 I80 A85 Q86 V119 V120 A123	D78-M82 VanDerWaalsContact O-CB 3.29Å; D78-M82 WeakPolarHBondContact O-CB 3.47Å; D78-M82 PolarHBondContact O-N 3.23Å; E79-M82 PolarHBondContact O-N 3.47Å; I80-M82 VanDerWaalsContact C-N 3.32Å; I80-M82 PolarHBondContact O-N 2.88Å; M82-A85 PolarHBondContact O-N 3.17Å; M82-Q86 WeakPolarHBondContact O-CB 3.16Å; M82-Q86 VanDerWaalsContact O-CG 3.24Å; M82-Q86 WeakPolarHBondContact O-CG 3.46Å; M82-Q86 PolarHBondContact O-N 3.2Å; M82-V119 HydrophobicContact SD-CB 4.27Å; M82-V119 HydrophobicContact SD-CG2 3.93Å; M82-V120 HydrophobicContact CB-CG2 4.16Å; M82-A123 HydrophobicContact CG-CB 4.12Å
83	V	94.8	Very high	94	Very high	8 Å²	8	41.3 Å²	41.3	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-64.4	-46.3	-179.7	172.3	0	0	0	0	111.2	L39 F42 H43 E79 I80 A85 Q86 K87	L39-V83 HydrophobicContact CD2-CB 4.46Å; L39-V83 HydrophobicContact CD2-CG2 3.85Å; F42-V83 HydrophobicContact CB-CB 4.48Å; F42-V83 HydrophobicContact CB-CG1 3.72Å; H43-V83 WeakPolarHBondContact ND1-CG1 3.34Å; E79-V83 WeakPolarHBondContact O-CG2 3.47Å; E79-V83 PolarHBondContact O-N 3.31Å; I80-V83 PolarHBondContact O-N 3.31Å; V83-A85 PolarHBondContact O-N 3.05Å; V83-Q86 PolarHBondContact O-N 2.59Å; V83-K87 HydrophobicContact CG1-CG 4.49Å; V83-K87 WeakPolarHBondContact O-CG 3.32Å; V83-K87 PolarHBondContact O-N 3.38Å
84	I	95.9	Very high	94.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-50.1	177.2	-67.7	172	0	0	0	109.8	F42 L45 I65 V68 V69 I80 L81 Q86 K87 L88	F42-I84 HydrophobicContact CB-CG1 4.36Å; F42-I84 HydrophobicContact CD1-CD1 3.87Å; F42-I84 HydrophobicContact CD1-CG1 3.74Å; F42-I84 HydrophobicContact CE1-CD1 3.86Å; F42-I84 HydrophobicContact CE1-CG1 4.25Å; F42-I84 HydrophobicContact CG-CD1 4.43Å; F42-I84 HydrophobicContact CG-CG1 4.07Å; F42-I84 HydrophobicContact CZ-CD1 4.4Å; L45-I84 HydrophobicContact CD1-CG1 4.2Å; I65-I84 HydrophobicContact CG2-CG2 3.82Å; V68-I84 HydrophobicContact CG1-CD1 3.79Å; V69-I84 HydrophobicContact CG2-CD1 4.06Å; V69-I84 HydrophobicContact CG2-CG2 3.77Å; I80-I84 HydrophobicContact CG2-CD1 3.55Å; I80-I84 HydrophobicContact CG2-CG1 4.21Å; I80-I84 VanDerWaalsContact O-CG1 3.31Å; I80-I84 WeakPolarHBondContact O-CG1 3.18Å; I80-I84 PolarHBondContact O-N 3.34Å; L81-I84 PolarHBondContact O-N 3.35Å; I84-Q86 VanDerWaalsContact C-N 3.33Å; I84-Q86 PolarHBondContact O-N 3.02Å; I84-K87 PolarHBondContact O-N 3.45Å; I84-K87 VanDerWaalsContact O-N 3.08Å; I84-L88 HydrophobicContact CG2-CD1 3.86Å; I84-L88 HydrophobicContact CG2-CG 4.18Å; I84-L88 WeakPolarHBondContact O-CG 3.5Å; I84-L88 PolarHBondContact O-N 3.47Å
85	A	97.9	Very high	94.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-54.4	-49	178.1	0	0	0	0	0	111.4	L81 M82 V83 K87 L88 L108 I111 A123 A124 S127	L81-A85 WeakPolarHBondContact O-CB 3.38Å; L81-A85 PolarHBondContact O-N 2.85Å; M82-A85 PolarHBondContact O-N 3.17Å; V83-A85 PolarHBondContact O-N 3.05Å; A85-K87 VanDerWaalsContact C-N 3.3Å; A85-K87 PolarHBondContact O-N 3.29Å; A85-L88 PolarHBondContact O-N 3.38Å; A85-L108 HydrophobicContact CB-CD2 4.22Å; A85-I111 HydrophobicContact CB-CD1 4.14Å; A85-A123 HydrophobicContact CB-CB 4.08Å; A85-A124 HydrophobicContact CB-CB 3.96Å; A85-S127 VanDerWaalsContact O-CB 3.25Å; A85-S127 WeakPolarHBondContact O-CB 3.49Å; A85-S127 PolarHBondContact O-OG 3.1Å
86	Q	97.1	Very high	94.6	Very high	94 Å²	94	34.9 Å²	34.9	44%	0.439	20%	0.203	S	C	.	.	H	α-helix	trans	-60.5	-35	178.3	-73.7	174	-1.5	0	0	113.3	M82 V83 I84 A123	M82-Q86 WeakPolarHBondContact O-CB 3.16Å; M82-Q86 VanDerWaalsContact O-CG 3.24Å; M82-Q86 WeakPolarHBondContact O-CG 3.46Å; M82-Q86 PolarHBondContact O-N 3.2Å; V83-Q86 PolarHBondContact O-N 2.59Å; I84-Q86 VanDerWaalsContact C-N 3.33Å; I84-Q86 PolarHBondContact O-N 3.02Å; Q86-A123 HydrophobicContact CG-CB 3.83Å
87	K	96.3	Very high	94.8	Very high	58 Å²	58	33.4 Å²	33.4	25%	0.252	19%	0.187	S	C	.	.	H	α-helix	trans	-78.9	-33.9	-179.4	-64	-41.5	178.4	-170.8	0	112.9	H43 L45 P46 V83 I84 A85 G89 S90 F91	H43-K87 WeakPolarHBondContact ND1-CE 3.49Å; L45-K87 HydrophobicContact CB-CB 4.43Å; P46-K87 HydrophobicContact CG-CB 4.08Å; P46-K87 HydrophobicContact CG-CD 4.11Å; P46-K87 HydrophobicContact CG-CG 4.27Å; V83-K87 HydrophobicContact CG1-CG 4.49Å; V83-K87 WeakPolarHBondContact O-CG 3.32Å; V83-K87 PolarHBondContact O-N 3.38Å; I84-K87 PolarHBondContact O-N 3.45Å; I84-K87 VanDerWaalsContact O-N 3.08Å; A85-K87 VanDerWaalsContact C-N 3.3Å; A85-K87 PolarHBondContact O-N 3.29Å; K87-G89 PolarHBondContact O-N 2.99Å; K87-S90 PolarHBondContact O-N 3.42Å; K87-S90 PolarHBondContact O-OG 3.44Å; K87-F91 VanDerWaalsContact O-CD2 3.24Å; K87-F91 WeakPolarHBondContact O-CD2 3.46Å
88	L	97.5	Very high	94.9	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.7	-22.5	-178.1	-74.3	178.7	0	0	0	113.8	I65 I84 A85 S90 F91 I104 I107 L108	I65-L88 HydrophobicContact CD1-CD2 4.16Å; I65-L88 HydrophobicContact CG2-CD1 4.28Å; I65-L88 HydrophobicContact CG2-CD2 4.41Å; I84-L88 HydrophobicContact CG2-CD1 3.86Å; I84-L88 HydrophobicContact CG2-CG 4.18Å; I84-L88 WeakPolarHBondContact O-CG 3.5Å; I84-L88 PolarHBondContact O-N 3.47Å; A85-L88 PolarHBondContact O-N 3.38Å; L88-S90 PolarHBondContact O-N 2.92Å; L88-F91 HydrophobicContact CD2-CD1 4.03Å; L88-F91 HydrophobicContact CD2-CD2 4.17Å; L88-F91 HydrophobicContact CD2-CE1 4.18Å; L88-F91 HydrophobicContact CD2-CE2 4.32Å; L88-F91 HydrophobicContact CD2-CG 4.03Å; L88-F91 HydrophobicContact CD2-CZ 4.33Å; L88-F91 WeakPolarHBondContact O-CB 3Å; L88-F91 PolarHBondContact O-N 3.32Å; L88-F91 VanDerWaalsContact O-N 3.11Å; L88-I104 HydrophobicContact CB-CG2 3.96Å; L88-I104 HydrophobicContact CD1-CG2 4.32Å; L88-I104 HydrophobicContact CD2-CG2 4.13Å; L88-I104 HydrophobicContact CG-CG2 4.36Å; L88-I107 HydrophobicContact CD1-CB 4.33Å; L88-I107 HydrophobicContact CD1-CG2 3.79Å; L88-L108 HydrophobicContact CB-CD1 4.26Å; L88-L108 HydrophobicContact CB-CD2 3.99Å; L88-L108 HydrophobicContact CB-CG 4.24Å; L88-L108 HydrophobicContact CD1-CD2 4.02Å; L88-L108 HydrophobicContact CD1-CG 4.14Å
89	G	95.7	Very high	94.9	Very high	13 Å²	13	37.2 Å²	37.2	13%	0.134	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27	174.9	0	0	0	0	0	114.2	K87 S127	K87-G89 PolarHBondContact O-N 2.99Å; G89-S127 PolarHBondContact N-OG 3.3Å
90	S	94.8	Very high	95.2	Very high	62 Å²	62	33.5 Å²	33.5	43%	0.434	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	1.6	177.7	65	0	0	0	0	114.1	K87 L88 G92	K87-S90 PolarHBondContact O-N 3.42Å; K87-S90 PolarHBondContact O-OG 3.44Å; L88-S90 PolarHBondContact O-N 2.92Å; S90-G92 VanDerWaalsContact C-N 3.29Å; S90-G92 PolarHBondContact O-N 2.94Å
91	F	96.9	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-8.5	-170.6	-90.6	-125	0	0	0	114.9	L45 P46 A49 T57 L61 I62 I65 K87 L88 D93 L94 V95 I104	L45-F91 HydrophobicContact CB-CE2 4.31Å; L45-F91 HydrophobicContact CB-CZ 3.99Å; P46-F91 HydrophobicContact CB-CE2 4.47Å; P46-F91 HydrophobicContact CG-CE2 4.16Å; A49-F91 HydrophobicContact CB-CD1 4.48Å; A49-F91 HydrophobicContact CB-CE1 3.8Å; A49-F91 HydrophobicContact CB-CZ 3.97Å; T57-F91 HydrophobicContact CG2-CD1 4.42Å; T57-F91 HydrophobicContact CG2-CE1 4.37Å; L61-F91 HydrophobicContact CD2-CE1 4.25Å; I62-F91 HydrophobicContact CD1-CD1 4.12Å; I62-F91 HydrophobicContact CD1-CE1 4.48Å; I65-F91 HydrophobicContact CD1-CE1 4.04Å; I65-F91 HydrophobicContact CD1-CZ 4.29Å; K87-F91 VanDerWaalsContact O-CD2 3.24Å; K87-F91 WeakPolarHBondContact O-CD2 3.46Å; L88-F91 HydrophobicContact CD2-CD1 4.03Å; L88-F91 HydrophobicContact CD2-CD2 4.17Å; L88-F91 HydrophobicContact CD2-CE1 4.18Å; L88-F91 HydrophobicContact CD2-CE2 4.32Å; L88-F91 HydrophobicContact CD2-CG 4.03Å; L88-F91 HydrophobicContact CD2-CZ 4.33Å; L88-F91 WeakPolarHBondContact O-CB 3Å; L88-F91 PolarHBondContact O-N 3.32Å; L88-F91 VanDerWaalsContact O-N 3.11Å; F91-D93 VanDerWaalsContact C-N 3.3Å; F91-D93 PolarHBondContact O-N 3.02Å; F91-D93 VanDerWaalsContact O-N 3.16Å; F91-L94 HydrophobicContact CD2-CD1 4.05Å; F91-L94 HydrophobicContact CE2-CD1 4.27Å; F91-L94 HydrophobicContact CG-CD1 4.3Å; F91-L94 WeakPolarHBondContact O-CA 3.28Å; F91-L94 WeakPolarHBondContact O-CB 3.34Å; F91-L94 PolarHBondContact O-N 2.87Å; F91-V95 HydrophobicContact CD1-CG1 4.43Å; F91-V95 WeakPolarHBondContact O-CG2 3.34Å; F91-V95 PolarHBondContact O-N 3.11Å; F91-I104 HydrophobicContact CB-CD1 3.47Å; F91-I104 VanDerWaalsContact CB-CD1 3.47Å; F91-I104 HydrophobicContact CB-CG1 4.33Å
92	G	93.6	Very high	95.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-41.7	-172.2	0	0	0	0	0	114.9	S90 V95 G97	S90-G92 VanDerWaalsContact C-N 3.29Å; S90-G92 PolarHBondContact O-N 2.94Å; G92-V95 WeakPolarHBondContact O-CG2 3.28Å; G92-G97 VanDerWaalsContact O-CA 3.23Å; G92-G97 WeakPolarHBondContact O-CA 3.15Å; G92-G97 PolarHBondContact O-N 3.35Å
93	D	94.7	Very high	95.4	Very high	110 Å²	110	36.5 Å²	36.5	59%	0.588	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-28	177.4	-51.6	-31.8	0	0	0	111.4	F91 V95 G96 K134	F91-D93 VanDerWaalsContact C-N 3.3Å; F91-D93 PolarHBondContact O-N 3.02Å; F91-D93 VanDerWaalsContact O-N 3.16Å; D93-V95 VanDerWaalsContact C-N 3.29Å; D93-V95 PolarHBondContact O-N 3.46Å; D93-G96 PolarHBondContact O-N 3.49Å; D93-K134 IonicContact OD1-NZ 2.92Å; D93-K134 PolarHBondContact OD1-NZ 2.94Å; D93-K134 IonicContact OD2-NZ 3.2Å; D93-K134 PolarHBondContact OD2-NZ 3.35Å
94	L	96.2	Very high	95.5	Very high	34 Å²	34	36.1 Å²	36.1	18%	0.178	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-27	-178.5	-59.3	175.2	0	0	0	112.5	P46 A49 P54 F91 G96	P46-L94 HydrophobicContact CB-CD1 4.05Å; A49-L94 HydrophobicContact CB-CB 3.99Å; A49-L94 HydrophobicContact CB-CD1 4.02Å; A49-L94 HydrophobicContact CB-CG 4.43Å; P54-L94 WeakPolarHBondContact CA-O 3.46Å; F91-L94 HydrophobicContact CD2-CD1 4.05Å; F91-L94 HydrophobicContact CE2-CD1 4.27Å; F91-L94 HydrophobicContact CG-CD1 4.3Å; F91-L94 WeakPolarHBondContact O-CA 3.28Å; F91-L94 WeakPolarHBondContact O-CB 3.34Å; F91-L94 PolarHBondContact O-N 2.87Å; L94-G96 VanDerWaalsContact C-N 3.32Å
95	V	96.7	Very high	95.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-2.7	172.2	-63.1	0	0	0	0	113.5	T57 R58 I62 F91 G92 D93 H100 I101 I104	T57-V95 HydrophobicContact CG2-CG1 4.01Å; R58-V95 VanDerWaalsContact CD-O 3.28Å; R58-V95 WeakPolarHBondContact CD-O 3.36Å; R58-V95 HydrophobicContact CG-CB 4.15Å; R58-V95 PolarHBondContact NH1-O 3.41Å; I62-V95 HydrophobicContact CD1-CG1 4.13Å; I62-V95 HydrophobicContact CG1-CG1 4.17Å; F91-V95 HydrophobicContact CD1-CG1 4.43Å; F91-V95 WeakPolarHBondContact O-CG2 3.34Å; F91-V95 PolarHBondContact O-N 3.11Å; G92-V95 WeakPolarHBondContact O-CG2 3.28Å; D93-V95 VanDerWaalsContact C-N 3.29Å; D93-V95 PolarHBondContact O-N 3.46Å; V95-H100 HydrophobicContact CB-CB 3.99Å; V95-H100 HydrophobicContact CG2-CB 3.77Å; V95-H100 WeakPolarHBondContact O-CB 3.04Å; V95-H100 PolarHBondContact O-CD2 2.81Å; V95-H100 VanDerWaalsContact O-CD2 3.26Å; V95-I101 HydrophobicContact CG2-CG1 4.44Å; V95-I104 HydrophobicContact CG1-CD1 3.81Å; V95-I104 HydrophobicContact CG1-CG1 4.11Å; V95-I104 HydrophobicContact CG2-CD1 3.95Å
96	G	93.5	Very high	95.6	Very high	29 Å²	29	39.9 Å²	39.9	30%	0.299	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.7	15.6	-179.7	0	0	0	0	0	115	D93 L94	D93-G96 PolarHBondContact O-N 3.49Å; L94-G96 VanDerWaalsContact C-N 3.32Å
97	G	92.7	Very high	95.6	Very high	17 Å²	17	35.7 Å²	35.7	18%	0.175	21%	0.212	C	C	.	.	S	Bend	trans	105.1	-170	172.6	0	0	0	0	0	114.7	G92 E99 H100 I101	G92-G97 VanDerWaalsContact O-CA 3.23Å; G92-G97 WeakPolarHBondContact O-CA 3.15Å; G92-G97 PolarHBondContact O-N 3.35Å; G97-E99 VanDerWaalsContact C-N 3.3Å; G97-E99 PolarHBondContact O-N 2.98Å; G97-H100 PolarHBondContact O-N 3.15Å; G97-I101 PolarHBondContact O-N 2.85Å
98	A	92.3	Very high	95.7	Very high	37 Å²	37	33 Å²	33	31%	0.306	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-52.4	-41.8	-167.3	0	0	0	0	0	114.7	H100 I101 P102 K134	A98-H100 PolarHBondContact O-N 3.37Å; A98-H100 VanDerWaalsContact O-N 3.13Å; A98-I101 PolarHBondContact O-N 3.3Å; A98-P102 WeakPolarHBondContact O-CD 3.3Å; A98-K134 WeakPolarHBondContact CB-O 3.48Å
99	E	93.6	Very high	95.7	Very high	147 Å²	147	33 Å²	33	69%	0.687	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-60.6	-21.8	-178.8	61.5	-179.2	169.7	0	0	113.5	G97	G97-E99 VanDerWaalsContact C-N 3.3Å; G97-E99 PolarHBondContact O-N 2.98Å
100	H	95.9	Very high	95.8	Very high	36 Å²	36	35 Å²	35	17%	0.167	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-111.8	-7.7	-176.2	-60.2	-52.8	0	0	0	114.1	R58 V95 G97 A98 P102 L103	R58-H100 HydrophobicContact CG-CB 4.49Å; R58-H100 VanDerWaalsContact CZ-NE2 3.29Å; R58-H100 PolarHBondContact NH1-CD2 3.13Å; R58-H100 PolarHBondContact NH1-NE2 2.93Å; V95-H100 HydrophobicContact CB-CB 3.99Å; V95-H100 HydrophobicContact CG2-CB 3.77Å; V95-H100 WeakPolarHBondContact O-CB 3.04Å; V95-H100 PolarHBondContact O-CD2 2.81Å; V95-H100 VanDerWaalsContact O-CD2 3.26Å; G97-H100 PolarHBondContact O-N 3.15Å; A98-H100 PolarHBondContact O-N 3.37Å; A98-H100 VanDerWaalsContact O-N 3.13Å; H100-P102 VanDerWaalsContact C-N 3.27Å; H100-L103 HydrophobicContact CB-CD1 4.25Å; H100-L103 VanDerWaalsContact O-CB 3.29Å; H100-L103 WeakPolarHBondContact O-CB 3.5Å; H100-L103 WeakPolarHBondContact O-CG 3.48Å; H100-L103 PolarHBondContact O-N 3.26Å
101	I	96.5	Very high	96	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-54.9	-36.8	172.8	-70.4	177.4	0	0	0	112.8	V95 G97 A98 L103 I104 V105 L131 K134 L135	V95-I101 HydrophobicContact CG2-CG1 4.44Å; G97-I101 PolarHBondContact O-N 2.85Å; A98-I101 PolarHBondContact O-N 3.3Å; I101-L103 PolarHBondContact O-N 2.86Å; I101-I104 WeakPolarHBondContact O-CB 3.5Å; I101-I104 PolarHBondContact O-N 3.46Å; I101-V105 HydrophobicContact CG2-CG2 4.33Å; I101-V105 PolarHBondContact O-N 3.47Å; I101-L131 HydrophobicContact CD1-CD2 4.31Å; I101-L131 HydrophobicContact CG1-CD2 4.47Å; I101-L131 HydrophobicContact CG2-CB 3.97Å; I101-L131 HydrophobicContact CG2-CD1 4.19Å; I101-L131 HydrophobicContact CG2-CD2 4.22Å; I101-L131 HydrophobicContact CG2-CG 4.35Å; I101-K134 HydrophobicContact CD1-CB 3.42Å; I101-K134 VanDerWaalsContact CD1-CB 3.42Å; I101-K134 HydrophobicContact CD1-CD 4.01Å; I101-K134 HydrophobicContact CD1-CG 4.34Å; I101-L135 HydrophobicContact CB-CD2 3.69Å; I101-L135 HydrophobicContact CB-CG 4.31Å; I101-L135 HydrophobicContact CD1-CD2 4.4Å; I101-L135 HydrophobicContact CD1-CG 4.43Å; I101-L135 HydrophobicContact CG2-CD1 3.89Å; I101-L135 HydrophobicContact CG2-CD2 3.7Å; I101-L135 HydrophobicContact CG2-CG 3.87Å
102	P	95.8	Very high	96	Very high	41 Å²	41	32 Å²	32	27%	0.266	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-58.2	-13.8	175.4	-28.1	37.4	0	0	0	115.1	A98 H100 I104 P106 L135 V139	A98-P102 WeakPolarHBondContact O-CD 3.3Å; H100-P102 VanDerWaalsContact C-N 3.27Å; P102-I104 VanDerWaalsContact C-N 3.34Å; P102-P106 WeakPolarHBondContact O-CD 3.29Å; P102-L135 HydrophobicContact CG-CD2 4.32Å; P102-V139 HydrophobicContact CG-CG1 3.89Å
103	L	95.8	Very high	96.1	Very high	80 Å²	80	34.4 Å²	34.4	42%	0.419	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-74.2	-24.5	172.1	-59.5	174	0	0	0	112.9	R58 I62 H100 I101	R58-L103 HydrophobicContact CB-CD1 4.18Å; R58-L103 HydrophobicContact CG-CD1 3.9Å; I62-L103 HydrophobicContact CG2-CB 4.33Å; H100-L103 HydrophobicContact CB-CD1 4.25Å; H100-L103 VanDerWaalsContact O-CB 3.29Å; H100-L103 WeakPolarHBondContact O-CB 3.5Å; H100-L103 WeakPolarHBondContact O-CG 3.48Å; H100-L103 PolarHBondContact O-N 3.26Å; I101-L103 PolarHBondContact O-N 2.86Å
104	I	96.6	Very high	96.1	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-34.5	-179	-57.2	157.2	0	0	0	110.7	I62 L88 F91 V95 I101 P102 I107 L108 L131	I62-I104 HydrophobicContact CD1-CG1 3.9Å; L88-I104 HydrophobicContact CB-CG2 3.96Å; L88-I104 HydrophobicContact CD1-CG2 4.32Å; L88-I104 HydrophobicContact CD2-CG2 4.13Å; L88-I104 HydrophobicContact CG-CG2 4.36Å; F91-I104 HydrophobicContact CB-CD1 3.47Å; F91-I104 VanDerWaalsContact CB-CD1 3.47Å; F91-I104 HydrophobicContact CB-CG1 4.33Å; V95-I104 HydrophobicContact CG1-CD1 3.81Å; V95-I104 HydrophobicContact CG1-CG1 4.11Å; V95-I104 HydrophobicContact CG2-CD1 3.95Å; I101-I104 WeakPolarHBondContact O-CB 3.5Å; I101-I104 PolarHBondContact O-N 3.46Å; P102-I104 VanDerWaalsContact C-N 3.34Å; I104-I107 WeakPolarHBondContact O-CB 3.45Å; I104-I107 PolarHBondContact O-N 3.13Å; I104-I107 VanDerWaalsContact O-N 3.08Å; I104-L108 HydrophobicContact CG2-CD1 3.97Å; I104-L108 HydrophobicContact CG2-CG 4.35Å; I104-L108 PolarHBondContact O-N 2.87Å; I104-L131 HydrophobicContact CB-CD1 4.46Å; I104-L131 HydrophobicContact CG2-CD1 4.08Å
105	V	97.7	Very high	95.9	Very high	2 Å²	2	30 Å²	30	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-55.3	-45.6	-174	173.6	0	0	0	0	112.8	I101 I107 L108 A109 L128 T143 F144 I147	I101-V105 HydrophobicContact CG2-CG2 4.33Å; I101-V105 PolarHBondContact O-N 3.47Å; V105-I107 VanDerWaalsContact C-N 3.29Å; V105-I107 PolarHBondContact O-N 2.86Å; V105-L108 PolarHBondContact O-N 3.2Å; V105-A109 VanDerWaalsContact O-CB 3.3Å; V105-A109 WeakPolarHBondContact O-CB 3.5Å; V105-A109 PolarHBondContact O-N 3.43Å; V105-L128 HydrophobicContact CB-CD2 4.25Å; V105-L128 HydrophobicContact CG1-CD2 3.92Å; V105-L128 HydrophobicContact CG2-CD2 4.13Å; V105-T143 HydrophobicContact CB-CG2 4.35Å; V105-T143 HydrophobicContact CG1-CG2 3.84Å; V105-F144 HydrophobicContact CG1-CZ 4.27Å; V105-F144 HydrophobicContact CG2-CE2 4.22Å; V105-F144 HydrophobicContact CG2-CZ 3.98Å; V105-I147 HydrophobicContact CG1-CD1 3.38Å
106	P	97.3	Very high	95.6	Very high	78 Å²	78	37 Å²	37	51%	0.506	21%	0.209	S	C	.	.	H	α-helix	trans	-60.7	-34.1	177.5	-26.2	35.2	0	0	0	113.9	P102 A109 N110	P102-P106 WeakPolarHBondContact O-CD 3.29Å; P106-A109 PolarHBondContact O-N 2.95Å; P106-N110 VanDerWaalsContact O-CB 3.29Å; P106-N110 WeakPolarHBondContact O-CB 3.33Å; P106-N110 PolarHBondContact O-N 3.29Å
107	I	98.2	Very high	95.7	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-66.5	-49.3	178.8	-58.3	176.9	0	0	0	109.6	I62 I65 V69 L88 I104 V105 A109 N110 I111	I62-I107 HydrophobicContact CG2-CD1 3.91Å; I65-I107 HydrophobicContact CG2-CD1 4.31Å; I65-I107 HydrophobicContact CG2-CG2 4.25Å; V69-I107 HydrophobicContact CB-CG2 4.2Å; V69-I107 HydrophobicContact CG1-CG2 4.25Å; V69-I107 HydrophobicContact CG2-CG2 3.79Å; L88-I107 HydrophobicContact CD1-CB 4.33Å; L88-I107 HydrophobicContact CD1-CG2 3.79Å; I104-I107 WeakPolarHBondContact O-CB 3.45Å; I104-I107 PolarHBondContact O-N 3.13Å; I104-I107 VanDerWaalsContact O-N 3.08Å; V105-I107 VanDerWaalsContact C-N 3.29Å; V105-I107 PolarHBondContact O-N 2.86Å; I107-A109 VanDerWaalsContact C-N 3.34Å; I107-A109 PolarHBondContact O-N 2.73Å; I107-N110 PolarHBondContact O-N 2.86Å; I107-I111 WeakPolarHBondContact O-CG1 3.44Å; I107-I111 PolarHBondContact O-N 2.7Å
108	L	98.4	Very high	95.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65	-39	177.5	-71.8	171.1	0	0	0	112	A85 L88 I104 V105 I111 I112 A124 L128 L131	A85-L108 HydrophobicContact CB-CD2 4.22Å; L88-L108 HydrophobicContact CB-CD1 4.26Å; L88-L108 HydrophobicContact CB-CD2 3.99Å; L88-L108 HydrophobicContact CB-CG 4.24Å; L88-L108 HydrophobicContact CD1-CD2 4.02Å; L88-L108 HydrophobicContact CD1-CG 4.14Å; I104-L108 HydrophobicContact CG2-CD1 3.97Å; I104-L108 HydrophobicContact CG2-CG 4.35Å; I104-L108 PolarHBondContact O-N 2.87Å; V105-L108 PolarHBondContact O-N 3.2Å; L108-I111 PolarHBondContact O-N 3.1Å; L108-I112 WeakPolarHBondContact O-CG1 3.4Å; L108-I112 PolarHBondContact O-N 3.06Å; L108-I112 VanDerWaalsContact O-N 3.11Å; L108-A124 HydrophobicContact CD2-CB 4.19Å; L108-L128 HydrophobicContact CB-CD1 4.4Å; L108-L128 HydrophobicContact CB-CD2 3.72Å; L108-L128 HydrophobicContact CB-CG 3.82Å; L108-L128 HydrophobicContact CD1-CD2 3.75Å; L108-L128 HydrophobicContact CD1-CG 4Å; L108-L128 HydrophobicContact CG-CD2 4.4Å; L108-L131 HydrophobicContact CD1-CD1 3.98Å
109	A	97.6	Very high	95.9	Very high	2 Å²	2	42.7 Å²	42.7	2%	0.017	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-42.8	175.6	0	0	0	0	0	111.3	V105 P106 I107 I111 I112 Y113 I147	V105-A109 VanDerWaalsContact O-CB 3.3Å; V105-A109 WeakPolarHBondContact O-CB 3.5Å; V105-A109 PolarHBondContact O-N 3.43Å; P106-A109 PolarHBondContact O-N 2.95Å; I107-A109 VanDerWaalsContact C-N 3.34Å; I107-A109 PolarHBondContact O-N 2.73Å; A109-I111 VanDerWaalsContact C-N 3.31Å; A109-I111 PolarHBondContact O-N 2.7Å; A109-I112 CarbonylContact O-C 3.6Å; A109-I112 WeakPolarHBondContact O-CB 3.33Å; A109-I112 PolarHBondContact O-N 2.89Å; A109-Y113 HydrophobicContact CB-CE1 4.26Å; A109-Y113 HydrophobicContact CB-CE2 3.91Å; A109-Y113 VanDerWaalsContact O-CD1 3.26Å; A109-Y113 WeakPolarHBondContact O-CD1 3.39Å; A109-Y113 VanDerWaalsContact O-CD2 3.31Å; A109-Y113 WeakPolarHBondContact O-CD2 3.09Å; A109-Y113 PolarHBondContact O-N 3.47Å; A109-I147 HydrophobicContact CB-CD1 4.17Å; A109-I147 HydrophobicContact CB-CG1 4.46Å; A109-I147 HydrophobicContact CB-CG2 4.35Å
110	N	97.3	Very high	96.1	Very high	53 Å²	53	35.7 Å²	35.7	28%	0.283	19%	0.193	S	C	.	.	H	α-helix	trans	-59.2	-40.6	176.7	-168.9	31.2	0	0	0	112.5	P106 I107 Y113 S114	P106-N110 VanDerWaalsContact O-CB 3.29Å; P106-N110 WeakPolarHBondContact O-CB 3.33Å; P106-N110 PolarHBondContact O-N 3.29Å; I107-N110 PolarHBondContact O-N 2.86Å; N110-Y113 PolarHBondContact O-N 2.85Å; N110-S114 WeakPolarHBondContact O-CB 3.18Å; N110-S114 PolarHBondContact O-N 3.08Å; N110-S114 PolarHBondContact O-OG 3.1Å
111	I	97.9	Very high	96.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-48.1	173.1	-63.1	172.3	0	0	0	110.1	V69 L81 A85 I107 L108 A109 Y113 S114 I115 V120 A124	V69-I111 HydrophobicContact CG1-CD1 4.03Å; V69-I111 HydrophobicContact CG1-CG1 3.54Å; V69-I111 HydrophobicContact CG2-CD1 4.18Å; L81-I111 HydrophobicContact CD2-CG1 4.3Å; A85-I111 HydrophobicContact CB-CD1 4.14Å; I107-I111 WeakPolarHBondContact O-CG1 3.44Å; I107-I111 PolarHBondContact O-N 2.7Å; L108-I111 PolarHBondContact O-N 3.1Å; A109-I111 VanDerWaalsContact C-N 3.31Å; A109-I111 PolarHBondContact O-N 2.7Å; I111-Y113 VanDerWaalsContact C-N 3.3Å; I111-Y113 PolarHBondContact O-N 3.46Å; I111-S114 PolarHBondContact O-N 2.96Å; I111-I115 WeakPolarHBondContact O-CB 3.22Å; I111-I115 VanDerWaalsContact O-CG2 3.28Å; I111-I115 WeakPolarHBondContact O-CG2 3.31Å; I111-I115 PolarHBondContact O-N 3.38Å; I111-V120 HydrophobicContact CG2-CG1 3.77Å; I111-A124 HydrophobicContact CB-CB 4.22Å; I111-A124 HydrophobicContact CG2-CB 3.94Å
112	I	97.6	Very high	96.2	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-38.8	179.4	-65.9	170.3	0	0	0	111.2	L108 A109 S114 A124 C125 L128 I151 S160 V163	L108-I112 WeakPolarHBondContact O-CG1 3.4Å; L108-I112 PolarHBondContact O-N 3.06Å; L108-I112 VanDerWaalsContact O-N 3.11Å; A109-I112 CarbonylContact O-C 3.6Å; A109-I112 WeakPolarHBondContact O-CB 3.33Å; A109-I112 PolarHBondContact O-N 2.89Å; I112-S114 VanDerWaalsContact C-N 3.27Å; I112-S114 PolarHBondContact O-N 3.04Å; I112-A124 HydrophobicContact CD1-CB 4.14Å; I112-A124 HydrophobicContact CG1-CB 3.65Å; I112-C125 HydrophobicContact CD1-CB 4.24Å; I112-L128 HydrophobicContact CD1-CD1 3.54Å; I112-I151 HydrophobicContact CG2-CD1 3.75Å; I112-I151 HydrophobicContact CG2-CG1 4.4Å; I112-S160 WeakPolarHBondContact O-CB 3.41Å; I112-S160 PolarHBondContact O-OG 3.31Å; I112-V163 HydrophobicContact CG2-CG2 4.07Å
113	Y	96.7	Very high	96.4	Very high	49 Å²	49	36 Å²	36	19%	0.192	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-31.2	-178.1	-58	-24.6	0	0	0	113.2	A109 N110 I111 I147 H150 I151 L156	A109-Y113 HydrophobicContact CB-CE1 4.26Å; A109-Y113 HydrophobicContact CB-CE2 3.91Å; A109-Y113 VanDerWaalsContact O-CD1 3.26Å; A109-Y113 WeakPolarHBondContact O-CD1 3.39Å; A109-Y113 VanDerWaalsContact O-CD2 3.31Å; A109-Y113 WeakPolarHBondContact O-CD2 3.09Å; A109-Y113 PolarHBondContact O-N 3.47Å; N110-Y113 PolarHBondContact O-N 2.85Å; I111-Y113 VanDerWaalsContact C-N 3.3Å; I111-Y113 PolarHBondContact O-N 3.46Å; Y113-I147 HydrophobicContact CE1-CG2 4.14Å; Y113-I147 WeakPolarHBondContact OH-CG1 3.35Å; Y113-I147 WeakPolarHBondContact OH-CG2 3.37Å; Y113-H150 AromaticContact CD1-CD2 3.91Å; Y113-H150 AromaticContact CE1-CD2 3.64Å; Y113-H150 AromaticContact CE2-CD2 3.86Å; Y113-H150 AromaticContact CZ-CD2 3.57Å; Y113-I151 HydrophobicContact CD1-CD1 4.35Å; Y113-I151 HydrophobicContact CD1-CG1 3.78Å; Y113-I151 HydrophobicContact CE1-CD1 3.92Å; Y113-I151 HydrophobicContact CE1-CG1 3.52Å; Y113-L156 HydrophobicContact CD1-CD1 4.12Å
114	S	94.4	Very high	96.5	Very high	40 Å²	40	32.2 Å²	32.2	28%	0.28	17%	0.172	S	C	.	.	H	α-helix	trans	-107.5	-7.6	-163.7	-49.6	0	0	0	0	114.2	N110 I111 I112 Y157	N110-S114 WeakPolarHBondContact O-CB 3.18Å; N110-S114 PolarHBondContact O-N 3.08Å; N110-S114 PolarHBondContact O-OG 3.1Å; I111-S114 PolarHBondContact O-N 2.96Å; I112-S114 VanDerWaalsContact C-N 3.27Å; I112-S114 PolarHBondContact O-N 3.04Å; S114-Y157 WeakPolarHBondContact O-CE2 3.45Å
115	I	90.5	Very high	96.6	Very high	12 Å²	12	32.2 Å²	32.2	6%	0.062	17%	0.172	C	C	.	.			trans	-107.2	135	-168.4	-150.7	63.3	0	0	0	114.4	D78 L81 I111 E117 V120 A121	D78-I115 WeakPolarHBondContact OD1-CD1 3.49Å; L81-I115 HydrophobicContact CD1-CD1 3.82Å; I111-I115 WeakPolarHBondContact O-CB 3.22Å; I111-I115 VanDerWaalsContact O-CG2 3.28Å; I111-I115 WeakPolarHBondContact O-CG2 3.31Å; I111-I115 PolarHBondContact O-N 3.38Å; I115-E117 HydrophobicContact CG1-CB 4.39Å; I115-V120 HydrophobicContact CG1-CB 3.89Å; I115-V120 HydrophobicContact CG1-CG1 3.89Å; I115-V120 HydrophobicContact CG1-CG2 4.31Å; I115-V120 HydrophobicContact CG2-CB 4.28Å; I115-V120 HydrophobicContact CG2-CG1 4.29Å; I115-A121 HydrophobicContact CG2-CB 3.8Å
116	E	91.8	Very high	96.6	Very high	147 Å²	147	35.4 Å²	35.4	69%	0.687	19%	0.189	S	C	*	.			trans	-86.9	-31.4	173.2	-173.4	176.7	-179.1	0	0	112.2	V118 Y157 A159	E116-V118 PolarHBondContact O-N 3.31Å; E116-Y157 HydrophobicContact CB-CD1 4.04Å; E116-Y157 HydrophobicContact CB-CE1 4.41Å; E116-Y157 HydrophobicContact CB-CG 4.3Å; E116-Y157 HydrophobicContact CG-CD1 4.27Å; E116-A159 WeakPolarHBondContact O-CB 3.27Å
117	E	94.3	Very high	96.7	Very high	81 Å²	81	32 Å²	32	38%	0.379	17%	0.167	S	C	.	.			trans	-71.7	122.5	-175.2	-177.2	48.3	-116.9	0	0	112	I115 V119 V120 A121	I115-E117 HydrophobicContact CG1-CB 4.39Å; E117-V119 HydrophobicContact CG-CG2 3.74Å; E117-V119 PolarHBondContact O-N 3.27Å; E117-V119 PolarHBondContact OE1-N 2.97Å; E117-V120 HydrophobicContact CB-CB 4.45Å; E117-V120 HydrophobicContact CB-CG2 3.88Å; E117-V120 HydrophobicContact CG-CG2 3.85Å; E117-V120 PolarHBondContact O-N 3.28Å; E117-A121 PolarHBondContact O-N 3.09Å; E117-A121 VanDerWaalsContact O-N 3.14Å
118	V	94.1	Very high	96.7	Very high	47 Å²	47	31.7 Å²	31.7	29%	0.285	17%	0.166	S	C	.	.	H	α-helix	trans	-65.2	-40.2	-170.4	175.3	0	0	0	0	111.2	E116 V120 A121 E122 A159 K162	E116-V118 PolarHBondContact O-N 3.31Å; V118-V120 VanDerWaalsContact C-N 3.3Å; V118-V120 PolarHBondContact O-N 3.45Å; V118-A121 PolarHBondContact O-N 2.73Å; V118-E122 HydrophobicContact CG1-CG 4.22Å; V118-E122 WeakPolarHBondContact CG1-OE1 3.49Å; V118-E122 WeakPolarHBondContact O-CB 3.34Å; V118-E122 VanDerWaalsContact O-CG 3.29Å; V118-E122 WeakPolarHBondContact O-CG 3.42Å; V118-E122 PolarHBondContact O-N 3.11Å; V118-A159 HydrophobicContact CG2-CB 4.08Å; V118-K162 HydrophobicContact CG1-CD 4.29Å; V118-K162 VanDerWaalsContact CG1-NZ 3.34Å
119	V	96.5	Very high	96.7	Very high	74 Å²	74	33.7 Å²	33.7	45%	0.448	18%	0.176	S	C	.	.	H	α-helix	trans	-68.1	-31.7	-178.1	-61.9	0	0	0	0	112.3	M82 E117 A123	M82-V119 HydrophobicContact SD-CB 4.27Å; M82-V119 HydrophobicContact SD-CG2 3.93Å; E117-V119 HydrophobicContact CG-CG2 3.74Å; E117-V119 PolarHBondContact O-N 3.27Å; E117-V119 PolarHBondContact OE1-N 2.97Å; V119-A123 WeakPolarHBondContact O-CB 3.43Å; V119-A123 PolarHBondContact O-N 3Å
120	V	97.3	Very high	96.7	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-70.3	-48.8	176.2	-174.6	0	0	0	0	110.1	D78 L81 M82 I111 I115 E117 V118 E122 A123 A124	D78-V120 HydrophobicContact CB-CG2 3.87Å; D78-V120 WeakPolarHBondContact O-CG2 3.39Å; L81-V120 HydrophobicContact CB-CG1 3.76Å; M82-V120 HydrophobicContact CB-CG2 4.16Å; I111-V120 HydrophobicContact CG2-CG1 3.77Å; I115-V120 HydrophobicContact CG1-CB 3.89Å; I115-V120 HydrophobicContact CG1-CG1 3.89Å; I115-V120 HydrophobicContact CG1-CG2 4.31Å; I115-V120 HydrophobicContact CG2-CB 4.28Å; I115-V120 HydrophobicContact CG2-CG1 4.29Å; E117-V120 HydrophobicContact CB-CB 4.45Å; E117-V120 HydrophobicContact CB-CG2 3.88Å; E117-V120 HydrophobicContact CG-CG2 3.85Å; E117-V120 PolarHBondContact O-N 3.28Å; V118-V120 VanDerWaalsContact C-N 3.3Å; V118-V120 PolarHBondContact O-N 3.45Å; V120-E122 VanDerWaalsContact C-N 3.3Å; V120-E122 PolarHBondContact O-N 3.05Å; V120-A123 WeakPolarHBondContact O-CB 3.44Å; V120-A123 PolarHBondContact O-N 3.43Å; V120-A124 PolarHBondContact O-N 2.85Å
121	A	97.6	Very high	96.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-41.4	175.9	0	0	0	0	0	111.7	I115 E117 V118 A124 C125 A159 V163	I115-A121 HydrophobicContact CG2-CB 3.8Å; E117-A121 PolarHBondContact O-N 3.09Å; E117-A121 VanDerWaalsContact O-N 3.14Å; V118-A121 PolarHBondContact O-N 2.73Å; A121-A124 PolarHBondContact O-N 2.92Å; A121-C125 VanDerWaalsContact O-CB 3.27Å; A121-C125 WeakPolarHBondContact O-CB 3.39Å; A121-C125 PolarHBondContact O-N 3.03Å; A121-A159 HydrophobicContact CB-CB 3.88Å; A121-V163 HydrophobicContact CB-CG1 4Å; A121-V163 HydrophobicContact CB-CG2 4.15Å
122	E	97.8	Very high	96.6	Very high	75 Å²	75	33.8 Å²	33.8	35%	0.35	18%	0.184	S	C	.	.	H	α-helix	trans	-64.4	-42.1	176.7	-78.2	-179.3	-174.8	0	0	111.5	V118 V120 C125 N126 K162 V163	V118-E122 HydrophobicContact CG1-CG 4.22Å; V118-E122 WeakPolarHBondContact CG1-OE1 3.49Å; V118-E122 WeakPolarHBondContact O-CB 3.34Å; V118-E122 VanDerWaalsContact O-CG 3.29Å; V118-E122 WeakPolarHBondContact O-CG 3.42Å; V118-E122 PolarHBondContact O-N 3.11Å; V120-E122 VanDerWaalsContact C-N 3.3Å; V120-E122 PolarHBondContact O-N 3.05Å; E122-C125 PolarHBondContact O-N 3.13Å; E122-N126 VanDerWaalsContact O-CB 3.24Å; E122-N126 WeakPolarHBondContact O-CB 3.47Å; E122-N126 PolarHBondContact O-N 3.2Å; E122-N126 PolarHBondContact O-ND2 3.26Å; E122-K162 IonicContact OE1-NZ 2.87Å; E122-K162 PolarHBondContact OE1-NZ 3.46Å; E122-V163 HydrophobicContact CB-CG1 4.43Å; E122-V163 HydrophobicContact CG-CG1 3.67Å
123	A	98.2	Very high	96.5	Very high	8 Å²	8	38.9 Å²	38.9	7%	0.066	22%	0.217	C	C	.	.	H	α-helix	trans	-59.7	-47.8	174.3	0	0	0	0	0	112	M82 A85 Q86 V119 V120 N126 S127	M82-A123 HydrophobicContact CG-CB 4.12Å; A85-A123 HydrophobicContact CB-CB 4.08Å; Q86-A123 HydrophobicContact CG-CB 3.83Å; V119-A123 WeakPolarHBondContact O-CB 3.43Å; V119-A123 PolarHBondContact O-N 3Å; V120-A123 WeakPolarHBondContact O-CB 3.44Å; V120-A123 PolarHBondContact O-N 3.43Å; A123-N126 PolarHBondContact O-N 3.41Å; A123-S127 PolarHBondContact O-N 2.92Å; A123-S127 PolarHBondContact O-OG 3.26Å
124	A	98.5	Very high	96.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-44.5	179.3	0	0	0	0	0	112.1	A85 L108 I111 I112 V120 A121 N126 S127 L128	A85-A124 HydrophobicContact CB-CB 3.96Å; L108-A124 HydrophobicContact CD2-CB 4.19Å; I111-A124 HydrophobicContact CB-CB 4.22Å; I111-A124 HydrophobicContact CG2-CB 3.94Å; I112-A124 HydrophobicContact CD1-CB 4.14Å; I112-A124 HydrophobicContact CG1-CB 3.65Å; V120-A124 PolarHBondContact O-N 2.85Å; A121-A124 PolarHBondContact O-N 2.92Å; A124-N126 PolarHBondContact O-N 2.75Å; A124-S127 PolarHBondContact O-N 3.19Å; A124-L128 PolarHBondContact O-N 3.05Å
125	C	98.3	Very high	96.5	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-42.7	175.6	-177.9	0	0	0	0	111.9	I112 A121 E122 S127 L128 I129 V163	I112-C125 HydrophobicContact CD1-CB 4.24Å; A121-C125 VanDerWaalsContact O-CB 3.27Å; A121-C125 WeakPolarHBondContact O-CB 3.39Å; A121-C125 PolarHBondContact O-N 3.03Å; E122-C125 PolarHBondContact O-N 3.13Å; C125-S127 VanDerWaalsContact C-N 3.3Å; C125-S127 PolarHBondContact O-N 3.2Å; C125-L128 WeakPolarHBondContact O-CB 3.47Å; C125-L128 PolarHBondContact O-N 2.94Å; C125-I129 VanDerWaalsContact O-CG1 3.29Å; C125-I129 WeakPolarHBondContact O-CG1 3.34Å; C125-I129 PolarHBondContact O-N 3.42Å; C125-V163 HydrophobicContact CB-CB 3.77Å; C125-V163 HydrophobicContact CB-CG1 4.42Å; C125-V163 HydrophobicContact CB-CG2 3.96Å
126	N	98.6	Very high	96.8	Very high	68 Å²	68	40.9 Å²	40.9	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-63.5	-38	177.8	-72.1	-28.7	0	0	0	111.5	E122 A123 A124 I129 A130 K166	E122-N126 VanDerWaalsContact O-CB 3.24Å; E122-N126 WeakPolarHBondContact O-CB 3.47Å; E122-N126 PolarHBondContact O-N 3.2Å; E122-N126 PolarHBondContact O-ND2 3.26Å; A123-N126 PolarHBondContact O-N 3.41Å; A124-N126 PolarHBondContact O-N 2.75Å; N126-I129 PolarHBondContact O-N 3.22Å; N126-A130 WeakPolarHBondContact O-CB 3.38Å; N126-A130 PolarHBondContact O-N 3.23Å; N126-K166 PolarHBondContact OD1-NZ 3.12Å
127	S	98.5	Very high	97	Very high	7 Å²	7	38.1 Å²	38.1	5%	0.049	22%	0.217	C	C	.	.	H	α-helix	trans	-67.2	-40	175.1	-74.7	0	0	0	0	112.8	A85 G89 A123 A124 C125 I129 A130 L131	A85-S127 VanDerWaalsContact O-CB 3.25Å; A85-S127 WeakPolarHBondContact O-CB 3.49Å; A85-S127 PolarHBondContact O-OG 3.1Å; G89-S127 PolarHBondContact N-OG 3.3Å; A123-S127 PolarHBondContact O-N 2.92Å; A123-S127 PolarHBondContact O-OG 3.26Å; A124-S127 PolarHBondContact O-N 3.19Å; C125-S127 VanDerWaalsContact C-N 3.3Å; C125-S127 PolarHBondContact O-N 3.2Å; S127-I129 VanDerWaalsContact C-N 3.34Å; S127-I129 PolarHBondContact O-N 2.92Å; S127-A130 PolarHBondContact O-N 2.67Å; S127-L131 WeakPolarHBondContact O-CG 3.18Å; S127-L131 PolarHBondContact O-N 2.96Å
128	L	98.4	Very high	97.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.1	-47.2	170.4	-78.9	-178.8	0	0	0	111.3	V105 L108 I112 A124 C125 A130 L131 L132 F144 L167	V105-L128 HydrophobicContact CB-CD2 4.25Å; V105-L128 HydrophobicContact CG1-CD2 3.92Å; V105-L128 HydrophobicContact CG2-CD2 4.13Å; L108-L128 HydrophobicContact CB-CD1 4.4Å; L108-L128 HydrophobicContact CB-CD2 3.72Å; L108-L128 HydrophobicContact CB-CG 3.82Å; L108-L128 HydrophobicContact CD1-CD2 3.75Å; L108-L128 HydrophobicContact CD1-CG 4Å; L108-L128 HydrophobicContact CG-CD2 4.4Å; I112-L128 HydrophobicContact CD1-CD1 3.54Å; A124-L128 PolarHBondContact O-N 3.05Å; C125-L128 WeakPolarHBondContact O-CB 3.47Å; C125-L128 PolarHBondContact O-N 2.94Å; L128-A130 VanDerWaalsContact C-N 3.32Å; L128-A130 PolarHBondContact O-N 2.86Å; L128-L131 PolarHBondContact O-N 3.45Å; L128-L131 VanDerWaalsContact O-N 3.14Å; L128-L132 PolarHBondContact O-N 2.99Å; L128-F144 HydrophobicContact CB-CE1 4.11Å; L128-F144 HydrophobicContact CD1-CE1 4.43Å; L128-F144 HydrophobicContact CD2-CE1 3.98Å; L128-F144 HydrophobicContact CD2-CZ 4.19Å; L128-F144 HydrophobicContact CG-CE1 4.41Å; L128-L167 HydrophobicContact CB-CD1 4.31Å; L128-L167 HydrophobicContact CD1-CD2 4.27Å
129	I	98.3	Very high	97.1	Very high	42 Å²	42	39 Å²	39	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-39.8	178.3	-68.3	169.5	0	0	0	111.4	C125 N126 S127 L131 L132 P133 K166 L167 A170	C125-I129 VanDerWaalsContact O-CG1 3.29Å; C125-I129 WeakPolarHBondContact O-CG1 3.34Å; C125-I129 PolarHBondContact O-N 3.42Å; N126-I129 PolarHBondContact O-N 3.22Å; S127-I129 VanDerWaalsContact C-N 3.34Å; S127-I129 PolarHBondContact O-N 2.92Å; I129-L131 PolarHBondContact O-N 3.41Å; I129-L132 HydrophobicContact CG1-CD1 4.47Å; I129-L132 WeakPolarHBondContact O-CB 3.47Å; I129-L132 PolarHBondContact O-N 2.81Å; I129-P133 WeakPolarHBondContact O-CD 3.45Å; I129-K166 HydrophobicContact CD1-CD 4.02Å; I129-K166 HydrophobicContact CD1-CG 3.92Å; I129-L167 HydrophobicContact CG1-CD1 3.98Å; I129-A170 HydrophobicContact CB-CB 4.46Å; I129-A170 HydrophobicContact CD1-CB 4Å; I129-A170 HydrophobicContact CG1-CB 3.71Å; I129-A170 HydrophobicContact CG2-CB 4.06Å
130	A	97.7	Very high	97.2	Very high	53 Å²	53	35.5 Å²	35.5	44%	0.438	20%	0.203	S	C	.	.	H	α-helix	trans	-64.3	-25.4	178	0	0	0	0	0	113.3	N126 S127 L128	N126-A130 WeakPolarHBondContact O-CB 3.38Å; N126-A130 PolarHBondContact O-N 3.23Å; S127-A130 PolarHBondContact O-N 2.67Å; L128-A130 VanDerWaalsContact C-N 3.32Å; L128-A130 PolarHBondContact O-N 2.86Å
131	L	97.1	Very high	97.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-83.5	-23.3	177.3	-66.5	168.6	0	0	0	112.9	I101 I104 L108 S127 L128 I129 K134	I101-L131 HydrophobicContact CD1-CD2 4.31Å; I101-L131 HydrophobicContact CG1-CD2 4.47Å; I101-L131 HydrophobicContact CG2-CB 3.97Å; I101-L131 HydrophobicContact CG2-CD1 4.19Å; I101-L131 HydrophobicContact CG2-CD2 4.22Å; I101-L131 HydrophobicContact CG2-CG 4.35Å; I104-L131 HydrophobicContact CB-CD1 4.46Å; I104-L131 HydrophobicContact CG2-CD1 4.08Å; L108-L131 HydrophobicContact CD1-CD1 3.98Å; S127-L131 WeakPolarHBondContact O-CG 3.18Å; S127-L131 PolarHBondContact O-N 2.96Å; L128-L131 PolarHBondContact O-N 3.45Å; L128-L131 VanDerWaalsContact O-N 3.14Å; I129-L131 PolarHBondContact O-N 3.41Å; L131-K134 WeakPolarHBondContact O-CB 3.38Å; L131-K134 PolarHBondContact O-N 3.16Å; L131-K134 VanDerWaalsContact O-N 3.13Å
132	L	97.1	Very high	97.1	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-52.8	-49.7	-176.2	-69.3	175.4	0	0	0	113.6	L128 I129 K134 L135 V140 F144 A170 M174	L128-L132 PolarHBondContact O-N 2.99Å; I129-L132 HydrophobicContact CG1-CD1 4.47Å; I129-L132 WeakPolarHBondContact O-CB 3.47Å; I129-L132 PolarHBondContact O-N 2.81Å; L132-K134 PolarHBondContact O-N 3.48Å; L132-L135 PolarHBondContact O-N 3.39Å; L132-V140 HydrophobicContact CD2-CG1 3.81Å; L132-V140 HydrophobicContact CD2-CG2 4.06Å; L132-F144 HydrophobicContact CD2-CD1 4.05Å; L132-F144 HydrophobicContact CD2-CD2 4.06Å; L132-F144 HydrophobicContact CD2-CE1 3.72Å; L132-F144 HydrophobicContact CD2-CE2 3.76Å; L132-F144 HydrophobicContact CD2-CG 4.21Å; L132-F144 HydrophobicContact CD2-CZ 3.57Å; L132-A170 HydrophobicContact CD1-CB 3.67Å; L132-M174 HydrophobicContact CB-SD 3.93Å; L132-M174 WeakPolarHBondContact O-CE 3.34Å
133	P	95.6	Very high	97	Very high	108 Å²	108	38.8 Å²	38.8	70%	0.701	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-62.9	-13.8	-176.1	-22.5	34.9	0	0	0	114.7	I129	I129-P133 WeakPolarHBondContact O-CD 3.45Å
134	K	94.7	Very high	96.9	Very high	73 Å²	73	38.4 Å²	38.4	32%	0.317	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-91.7	-13	178.3	-61.1	-172.9	173.5	-159.8	0	112.8	D93 A98 I101 L131 L132	D93-K134 IonicContact OD1-NZ 2.92Å; D93-K134 PolarHBondContact OD1-NZ 2.94Å; D93-K134 IonicContact OD2-NZ 3.2Å; D93-K134 PolarHBondContact OD2-NZ 3.35Å; A98-K134 WeakPolarHBondContact CB-O 3.48Å; I101-K134 HydrophobicContact CD1-CB 3.42Å; I101-K134 VanDerWaalsContact CD1-CB 3.42Å; I101-K134 HydrophobicContact CD1-CD 4.01Å; I101-K134 HydrophobicContact CD1-CG 4.34Å; L131-K134 WeakPolarHBondContact O-CB 3.38Å; L131-K134 PolarHBondContact O-N 3.16Å; L131-K134 VanDerWaalsContact O-N 3.13Å; L132-K134 PolarHBondContact O-N 3.48Å
135	L	96.4	Very high	96.8	Very high	10 Å²	10	38.4 Å²	38.4	5%	0.052	23%	0.227	C	C	.	.	S	Bend	trans	-94.4	141.7	-176.7	-73.3	170	0	0	0	111.3	I101 P102 L132 V139 V140 F144	I101-L135 HydrophobicContact CB-CD2 3.69Å; I101-L135 HydrophobicContact CB-CG 4.31Å; I101-L135 HydrophobicContact CD1-CD2 4.4Å; I101-L135 HydrophobicContact CD1-CG 4.43Å; I101-L135 HydrophobicContact CG2-CD1 3.89Å; I101-L135 HydrophobicContact CG2-CD2 3.7Å; I101-L135 HydrophobicContact CG2-CG 3.87Å; P102-L135 HydrophobicContact CG-CD2 4.32Å; L132-L135 PolarHBondContact O-N 3.39Å; L135-V139 HydrophobicContact CD2-CG1 3.9Å; L135-V140 HydrophobicContact CB-CG2 3.56Å; L135-V140 HydrophobicContact CD1-CG2 4.18Å; L135-F144 HydrophobicContact CD1-CE2 3.62Å; L135-F144 HydrophobicContact CD1-CZ 4.18Å
136	P	95.6	Very high	96.7	Very high	59 Å²	59	41.6 Å²	41.6	38%	0.383	25%	0.248	S	C	.	.			trans	-59.5	145.2	165.4	-21.8	33.5	0	0	0	111.4	D138 V139 V140	P136-D138 VanDerWaalsContact C-N 3.29Å; P136-D138 WeakPolarHBondContact CB-OD1 3.43Å; P136-D138 PolarHBondContact O-N 3.15Å; P136-V139 HydrophobicContact CB-CB 4.45Å; P136-V139 HydrophobicContact CB-CG2 4.05Å; P136-V139 HydrophobicContact CG-CG2 4.07Å; P136-V139 WeakPolarHBondContact O-CA 3.42Å; P136-V139 WeakPolarHBondContact O-CB 3.49Å; P136-V139 PolarHBondContact O-N 2.89Å; P136-V140 PolarHBondContact O-N 2.93Å
137	N	96.8	Very high	96.7	Very high	90 Å²	90	39 Å²	39	48%	0.481	23%	0.234	S	C	.	.	H	α-helix	trans	-58.1	-38.4	-176.9	-75	7.8	0	0	0	113.2	V139 V140 D141 M174	N137-V139 VanDerWaalsContact C-N 3.3Å; N137-V139 PolarHBondContact O-N 3.03Å; N137-V140 PolarHBondContact O-N 3.39Å; N137-D141 WeakPolarHBondContact O-CB 3.5Å; N137-D141 PolarHBondContact O-N 3.13Å; N137-M174 CarbonylContact C-O 3.6Å; N137-M174 WeakPolarHBondContact CA-O 3.46Å; N137-M174 VanDerWaalsContact CB-O 3.26Å; N137-M174 WeakPolarHBondContact CB-O 3.16Å; N137-M174 VanDerWaalsContact O-O 3.13Å; N137-M174 WeakPolarHBondContact OD1-CE 3.24Å
138	D	95.4	Very high	96.6	Very high	113 Å²	113	38.7 Å²	38.7	60%	0.604	23%	0.231	S	C	*	.	H	α-helix	trans	-64.5	-34	175.8	58.7	-64.9	0	0	0	112.6	P136 S142	P136-D138 VanDerWaalsContact C-N 3.29Å; P136-D138 WeakPolarHBondContact CB-OD1 3.43Å; P136-D138 PolarHBondContact O-N 3.15Å; D138-S142 WeakPolarHBondContact O-CB 3.25Å; D138-S142 PolarHBondContact O-N 3.05Å; D138-S142 PolarHBondContact O-OG 2.91Å
139	V	95.9	Very high	96.5	Very high	33 Å²	33	41.5 Å²	41.5	20%	0.2	24%	0.242	C	C	.	.	H	α-helix	trans	-72.4	-40.6	174.1	-178.9	0	0	0	0	110.5	P102 L135 P136 N137 S142 T143	P102-V139 HydrophobicContact CG-CG1 3.89Å; L135-V139 HydrophobicContact CD2-CG1 3.9Å; P136-V139 HydrophobicContact CB-CB 4.45Å; P136-V139 HydrophobicContact CB-CG2 4.05Å; P136-V139 HydrophobicContact CG-CG2 4.07Å; P136-V139 WeakPolarHBondContact O-CA 3.42Å; P136-V139 WeakPolarHBondContact O-CB 3.49Å; P136-V139 PolarHBondContact O-N 2.89Å; N137-V139 VanDerWaalsContact C-N 3.3Å; N137-V139 PolarHBondContact O-N 3.03Å; V139-S142 PolarHBondContact O-OG 3.17Å; V139-T143 WeakPolarHBondContact O-CB 3.46Å; V139-T143 PolarHBondContact O-N 3.19Å; V139-T143 PolarHBondContact O-OG1 3.08Å
140	V	96.8	Very high	96.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-48.1	174	177.9	0	0	0	0	110.5	L132 L135 P136 N137 S142 T143 F144 C171 M174 V175	L132-V140 HydrophobicContact CD2-CG1 3.81Å; L132-V140 HydrophobicContact CD2-CG2 4.06Å; L135-V140 HydrophobicContact CB-CG2 3.56Å; L135-V140 HydrophobicContact CD1-CG2 4.18Å; P136-V140 PolarHBondContact O-N 2.93Å; N137-V140 PolarHBondContact O-N 3.39Å; V140-S142 PolarHBondContact O-N 3.45Å; V140-T143 PolarHBondContact O-N 3.3Å; V140-F144 HydrophobicContact CB-CD2 4.48Å; V140-F144 HydrophobicContact CG1-CB 4.44Å; V140-F144 HydrophobicContact CG1-CD2 4.09Å; V140-F144 HydrophobicContact CG1-CG 4.39Å; V140-F144 WeakPolarHBondContact O-CB 3.31Å; V140-F144 PolarHBondContact O-N 3.4Å; V140-C171 HydrophobicContact CG1-CB 4.34Å; V140-M174 HydrophobicContact CB-CB 4.16Å; V140-M174 HydrophobicContact CG1-CB 3.9Å; V140-M174 HydrophobicContact CG2-CB 4.45Å; V140-M174 HydrophobicContact CG2-CE 3.86Å; V140-M174 HydrophobicContact CG2-SD 4.24Å; V140-V175 HydrophobicContact CG1-CG1 4.24Å
141	D	97.1	Very high	96.3	Very high	36 Å²	36	40.3 Å²	40.3	19%	0.193	23%	0.226	C	C	.	.	H	α-helix	trans	-55.7	-51.9	178.2	-172	-81.5	0	0	0	112.2	N137 A145 V175 S176 N179	N137-D141 WeakPolarHBondContact O-CB 3.5Å; N137-D141 PolarHBondContact O-N 3.13Å; D141-A145 WeakPolarHBondContact O-CB 3.43Å; D141-A145 PolarHBondContact O-N 2.94Å; D141-V175 HydrophobicContact CB-CB 4.4Å; D141-V175 HydrophobicContact CB-CG1 4.44Å; D141-V175 WeakPolarHBondContact OD2-CB 3.46Å; D141-S176 WeakPolarHBondContact OD2-CB 3.27Å; D141-S176 PolarHBondContact OD2-N 3.32Å; D141-S176 PolarHBondContact OD2-OG 3.2Å; D141-N179 PolarHBondContact OD1-ND2 3.45Å; D141-N179 PolarHBondContact OD2-ND2 3.36Å
142	S	96	Very high	96.1	Very high	74 Å²	74	41.1 Å²	41.1	52%	0.517	23%	0.23	S	C	.	.	H	α-helix	trans	-74	-30.7	-176.6	54.8	0	0	0	0	114	D138 V139 V140 P146	D138-S142 WeakPolarHBondContact O-CB 3.25Å; D138-S142 PolarHBondContact O-N 3.05Å; D138-S142 PolarHBondContact O-OG 2.91Å; V139-S142 PolarHBondContact O-OG 3.17Å; V140-S142 PolarHBondContact O-N 3.45Å; S142-P146 WeakPolarHBondContact O-CD 3.21Å; S142-P146 VanDerWaalsContact O-CG 3.3Å; S142-P146 WeakPolarHBondContact O-CG 3.15Å
143	T	96.1	Very high	95.9	Very high	36 Å²	36	46.5 Å²	46.5	22%	0.221	26%	0.255	C	S	.	.	H	α-helix	trans	-90.5	-44.2	-175.1	-52.1	0	0	0	0	112.5	V105 V139 V140 I147	V105-T143 HydrophobicContact CB-CG2 4.35Å; V105-T143 HydrophobicContact CG1-CG2 3.84Å; V139-T143 WeakPolarHBondContact O-CB 3.46Å; V139-T143 PolarHBondContact O-N 3.19Å; V139-T143 PolarHBondContact O-OG1 3.08Å; V140-T143 PolarHBondContact O-N 3.3Å; T143-I147 HydrophobicContact CG2-CD1 4.46Å; T143-I147 WeakPolarHBondContact O-CD1 3.15Å; T143-I147 WeakPolarHBondContact O-CG1 3.44Å
144	F	97.2	Very high	95.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-88.7	-28.5	-171.8	-73.6	-103.5	0	0	0	113.1	V105 L128 L132 L135 V140 I147 I148 L167	V105-F144 HydrophobicContact CG1-CZ 4.27Å; V105-F144 HydrophobicContact CG2-CE2 4.22Å; V105-F144 HydrophobicContact CG2-CZ 3.98Å; L128-F144 HydrophobicContact CB-CE1 4.11Å; L128-F144 HydrophobicContact CD1-CE1 4.43Å; L128-F144 HydrophobicContact CD2-CE1 3.98Å; L128-F144 HydrophobicContact CD2-CZ 4.19Å; L128-F144 HydrophobicContact CG-CE1 4.41Å; L132-F144 HydrophobicContact CD2-CD1 4.05Å; L132-F144 HydrophobicContact CD2-CD2 4.06Å; L132-F144 HydrophobicContact CD2-CE1 3.72Å; L132-F144 HydrophobicContact CD2-CE2 3.76Å; L132-F144 HydrophobicContact CD2-CG 4.21Å; L132-F144 HydrophobicContact CD2-CZ 3.57Å; L135-F144 HydrophobicContact CD1-CE2 3.62Å; L135-F144 HydrophobicContact CD1-CZ 4.18Å; V140-F144 HydrophobicContact CB-CD2 4.48Å; V140-F144 HydrophobicContact CG1-CB 4.44Å; V140-F144 HydrophobicContact CG1-CD2 4.09Å; V140-F144 HydrophobicContact CG1-CG 4.39Å; V140-F144 WeakPolarHBondContact O-CB 3.31Å; V140-F144 PolarHBondContact O-N 3.4Å; F144-I147 PolarHBondContact O-N 2.83Å; F144-I148 WeakPolarHBondContact O-CG1 3.3Å; F144-I148 PolarHBondContact O-N 2.84Å; F144-L167 HydrophobicContact CD1-CD1 4.1Å; F144-L167 HydrophobicContact CD1-CD2 4.39Å; F144-L167 HydrophobicContact CE1-CD1 4.23Å
145	A	96.4	Very high	95	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-43.6	178.5	0	0	0	0	0	112.8	D141 I147 I148 R149 F183	D141-A145 WeakPolarHBondContact O-CB 3.43Å; D141-A145 PolarHBondContact O-N 2.94Å; A145-I147 VanDerWaalsContact C-N 3.34Å; A145-I147 PolarHBondContact O-N 2.75Å; A145-I148 PolarHBondContact O-N 3.43Å; A145-R149 VanDerWaalsContact O-CG 3.29Å; A145-R149 WeakPolarHBondContact O-CG 3.48Å; A145-R149 PolarHBondContact O-N 3.27Å; A145-F183 HydrophobicContact CB-CE1 4.11Å; A145-F183 HydrophobicContact CB-CZ 3.91Å
146	P	96.3	Very high	94.7	Very high	68 Å²	68	51.4 Å²	51.4	44%	0.442	28%	0.276	S	S	.	.	H	α-helix	trans	-60.3	-40.1	171.8	-24.3	35.4	0	0	0	113.5	S142 R149 H150	S142-P146 WeakPolarHBondContact O-CD 3.21Å; S142-P146 VanDerWaalsContact O-CG 3.3Å; S142-P146 WeakPolarHBondContact O-CG 3.15Å; P146-R149 PolarHBondContact O-N 3.44Å; P146-H150 WeakPolarHBondContact O-CB 3.29Å; P146-H150 PolarHBondContact O-N 2.88Å
147	I	97	Very high	94.6	Very high	14 Å²	14	54 Å²	54	7%	0.072	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-48.4	179	-65.8	170	0	0	0	110.8	V105 A109 Y113 T143 F144 A145 R149 H150 I151	V105-I147 HydrophobicContact CG1-CD1 3.38Å; A109-I147 HydrophobicContact CB-CD1 4.17Å; A109-I147 HydrophobicContact CB-CG1 4.46Å; A109-I147 HydrophobicContact CB-CG2 4.35Å; Y113-I147 HydrophobicContact CE1-CG2 4.14Å; Y113-I147 WeakPolarHBondContact OH-CG1 3.35Å; Y113-I147 WeakPolarHBondContact OH-CG2 3.37Å; T143-I147 HydrophobicContact CG2-CD1 4.46Å; T143-I147 WeakPolarHBondContact O-CD1 3.15Å; T143-I147 WeakPolarHBondContact O-CG1 3.44Å; F144-I147 PolarHBondContact O-N 2.83Å; A145-I147 VanDerWaalsContact C-N 3.34Å; A145-I147 PolarHBondContact O-N 2.75Å; I147-R149 VanDerWaalsContact C-N 3.33Å; I147-R149 PolarHBondContact O-N 3.43Å; I147-H150 PolarHBondContact O-N 3.4Å; I147-I151 HydrophobicContact CG2-CD1 3.9Å; I147-I151 WeakPolarHBondContact O-CG1 3.41Å; I147-I151 PolarHBondContact O-N 3.14Å
148	I	97.1	Very high	94.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-43.4	178.6	-72.9	165.5	0	0	0	110.6	F144 A145 I151 I152 V164 L167 I168 C171 F183	F144-I148 WeakPolarHBondContact O-CG1 3.3Å; F144-I148 PolarHBondContact O-N 2.84Å; A145-I148 PolarHBondContact O-N 3.43Å; I148-I151 PolarHBondContact O-N 2.97Å; I148-I152 HydrophobicContact CG2-CD1 3.78Å; I148-I152 WeakPolarHBondContact O-CD1 3.33Å; I148-I152 VanDerWaalsContact O-CG1 3.27Å; I148-I152 WeakPolarHBondContact O-CG1 3.32Å; I148-I152 PolarHBondContact O-N 3.33Å; I148-V164 HydrophobicContact CB-CG2 4.25Å; I148-V164 HydrophobicContact CG1-CG2 4.02Å; I148-V164 HydrophobicContact CG2-CG2 4.14Å; I148-L167 HydrophobicContact CD1-CG 4.26Å; I148-L167 HydrophobicContact CG1-CD2 4.03Å; I148-L167 HydrophobicContact CG1-CG 4.25Å; I148-I168 HydrophobicContact CD1-CG1 4.35Å; I148-I168 HydrophobicContact CG2-CD1 4.25Å; I148-I168 HydrophobicContact CG2-CG1 3.72Å; I148-C171 HydrophobicContact CD1-CB 4.31Å; I148-F183 HydrophobicContact CB-CE1 4.19Å; I148-F183 HydrophobicContact CB-CZ 4.34Å; I148-F183 HydrophobicContact CD1-CD2 4.38Å; I148-F183 HydrophobicContact CD1-CE1 4.01Å; I148-F183 HydrophobicContact CD1-CE2 3.58Å; I148-F183 HydrophobicContact CD1-CZ 3.37Å; I148-F183 HydrophobicContact CG1-CZ 4.43Å; I148-F183 HydrophobicContact CG2-CD1 4.22Å; I148-F183 HydrophobicContact CG2-CE1 3.9Å; I148-F183 HydrophobicContact CG2-CZ 4.39Å
149	R	95.9	Very high	94.5	Very high	58 Å²	58	46.4 Å²	46.4	22%	0.219	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-49.2	176.7	-71.5	-177.4	-163.6	103.5	8.4	111.6	A145 P146 I147 I151 I152 E153 N179 D182	A145-R149 VanDerWaalsContact O-CG 3.29Å; A145-R149 WeakPolarHBondContact O-CG 3.48Å; A145-R149 PolarHBondContact O-N 3.27Å; P146-R149 PolarHBondContact O-N 3.44Å; I147-R149 VanDerWaalsContact C-N 3.33Å; I147-R149 PolarHBondContact O-N 3.43Å; R149-I151 VanDerWaalsContact C-N 3.31Å; R149-I151 PolarHBondContact O-N 3.08Å; R149-I152 PolarHBondContact O-N 2.71Å; R149-I152 VanDerWaalsContact O-N 3.09Å; R149-E153 VanDerWaalsContact O-CB 3.27Å; R149-E153 WeakPolarHBondContact O-CB 3.39Å; R149-E153 VanDerWaalsContact O-CG 3.32Å; R149-E153 WeakPolarHBondContact O-CG 3.49Å; R149-E153 PolarHBondContact O-N 3.22Å; R149-N179 PolarHBondContact NH2-OD1 3.36Å; R149-D182 IonicContact CZ-OD2 3.84Å; R149-D182 IonicContact NE-OD2 3.91Å; R149-D182 PolarHBondContact NE-OD2 3.28Å; R149-D182 IonicContact NH2-OD2 3.76Å; R149-D182 PolarHBondContact NH2-OD2 3.44Å
150	H	96.3	Very high	94.5	Very high	71 Å²	71	44.8 Å²	44.8	33%	0.329	23%	0.231	S	C	.	.	H	α-helix	trans	-55.9	-45.7	179.1	-174.9	66.1	0	0	0	111.5	Y113 P146 I147 I152 E154	Y113-H150 AromaticContact CD1-CD2 3.91Å; Y113-H150 AromaticContact CE1-CD2 3.64Å; Y113-H150 AromaticContact CE2-CD2 3.86Å; Y113-H150 AromaticContact CZ-CD2 3.57Å; P146-H150 WeakPolarHBondContact O-CB 3.29Å; P146-H150 PolarHBondContact O-N 2.88Å; I147-H150 PolarHBondContact O-N 3.4Å; H150-I152 VanDerWaalsContact C-N 3.26Å; H150-I152 PolarHBondContact O-N 3.43Å; H150-E154 VanDerWaalsContact CE1-CG 3.4Å; H150-E154 WeakPolarHBondContact CE1-CG 3.34Å; H150-E154 VanDerWaalsContact ND1-CG 3.33Å; H150-E154 WeakPolarHBondContact ND1-CG 3.44Å; H150-E154 IonicContact ND1-OE1 3.64Å; H150-E154 VanDerWaalsContact O-CB 3.24Å; H150-E154 WeakPolarHBondContact O-CB 3.48Å; H150-E154 VanDerWaalsContact O-CG 3.26Å; H150-E154 WeakPolarHBondContact O-CG 3.46Å; H150-E154 PolarHBondContact O-N 3.44Å
151	I	95.6	Very high	94.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-33.2	-180	-63.7	162.1	0	0	0	112.9	I112 Y113 I147 I148 R149 L156 S160 R161 V164	I112-I151 HydrophobicContact CG2-CD1 3.75Å; I112-I151 HydrophobicContact CG2-CG1 4.4Å; Y113-I151 HydrophobicContact CD1-CD1 4.35Å; Y113-I151 HydrophobicContact CD1-CG1 3.78Å; Y113-I151 HydrophobicContact CE1-CD1 3.92Å; Y113-I151 HydrophobicContact CE1-CG1 3.52Å; I147-I151 HydrophobicContact CG2-CD1 3.9Å; I147-I151 WeakPolarHBondContact O-CG1 3.41Å; I147-I151 PolarHBondContact O-N 3.14Å; I148-I151 PolarHBondContact O-N 2.97Å; R149-I151 VanDerWaalsContact C-N 3.31Å; R149-I151 PolarHBondContact O-N 3.08Å; I151-L156 HydrophobicContact CB-CD1 4.2Å; I151-L156 HydrophobicContact CG1-CD1 4.12Å; I151-L156 HydrophobicContact CG2-CD1 4.22Å; I151-S160 WeakPolarHBondContact CG2-O 3.39Å; I151-R161 HydrophobicContact CG2-CG 4.45Å; I151-R161 PolarHBondContact O-NH1 3.03Å; I151-R161 VanDerWaalsContact O-NH1 3.15Å; I151-V164 HydrophobicContact CB-CB 4.26Å; I151-V164 HydrophobicContact CB-CG2 3.98Å; I151-V164 HydrophobicContact CD1-CB 4.29Å; I151-V164 HydrophobicContact CD1-CG2 3.85Å; I151-V164 HydrophobicContact CG2-CB 3.73Å; I151-V164 HydrophobicContact CG2-CG1 3.97Å; I151-V164 HydrophobicContact CG2-CG2 4.03Å
152	I	92.9	Very high	94.4	Very high	17 Å²	17	47.3 Å²	47.3	9%	0.087	24%	0.24	C	C	.	.	H	α-helix	trans	-87.4	-36.5	-175.2	-65.2	171	0	0	0	111.7	I148 R149 H150 R161 V164 I168 R186 L190	I148-I152 HydrophobicContact CG2-CD1 3.78Å; I148-I152 WeakPolarHBondContact O-CD1 3.33Å; I148-I152 VanDerWaalsContact O-CG1 3.27Å; I148-I152 WeakPolarHBondContact O-CG1 3.32Å; I148-I152 PolarHBondContact O-N 3.33Å; R149-I152 PolarHBondContact O-N 2.71Å; R149-I152 VanDerWaalsContact O-N 3.09Å; H150-I152 VanDerWaalsContact C-N 3.26Å; H150-I152 PolarHBondContact O-N 3.43Å; I152-R161 PolarHBondContact O-NH1 2.89Å; I152-R161 PolarHBondContact O-NH2 3.43Å; I152-V164 HydrophobicContact CD1-CG1 4.13Å; I152-V164 HydrophobicContact CD1-CG2 4.48Å; I152-V164 HydrophobicContact CG1-CG1 3.8Å; I152-V164 HydrophobicContact CG1-CG2 4.45Å; I152-I168 HydrophobicContact CD1-CD1 3.9Å; I152-R186 HydrophobicContact CD1-CB 4.01Å; I152-R186 HydrophobicContact CD1-CG 4.46Å; I152-L190 HydrophobicContact CD1-CD1 4.09Å; I152-L190 HydrophobicContact CG1-CD1 4.18Å; I152-L190 HydrophobicContact CG2-CD2 4.37Å
153	E	92.9	Very high	94.5	Very high	117 Å²	117	44.2 Å²	44.2	55%	0.547	22%	0.218	S	C	.	.	H	α-helix	trans	-82.8	-32	-176.4	-69.6	170	-176.8	0	0	112.3	R149 R186	R149-E153 VanDerWaalsContact O-CB 3.27Å; R149-E153 WeakPolarHBondContact O-CB 3.39Å; R149-E153 VanDerWaalsContact O-CG 3.32Å; R149-E153 WeakPolarHBondContact O-CG 3.49Å; R149-E153 PolarHBondContact O-N 3.22Å; E153-R186 IonicContact OE1-CZ 3.13Å; E153-R186 IonicContact OE1-NH1 3.14Å; E153-R186 PolarHBondContact OE1-NH1 3.43Å; E153-R186 IonicContact OE1-NH2 2.84Å; E153-R186 PolarHBondContact OE1-NH2 3.36Å
154	E	90.2	Very high	94.5	Very high	96 Å²	96	42.5 Å²	42.5	45%	0.449	21%	0.207	S	C	.	.	S	Bend	trans	-83.7	148.1	173.5	-58.4	-61	154.7	0	0	111.2	H150 L156 R161	H150-E154 VanDerWaalsContact CE1-CG 3.4Å; H150-E154 WeakPolarHBondContact CE1-CG 3.34Å; H150-E154 VanDerWaalsContact ND1-CG 3.33Å; H150-E154 WeakPolarHBondContact ND1-CG 3.44Å; H150-E154 IonicContact ND1-OE1 3.64Å; H150-E154 VanDerWaalsContact O-CB 3.24Å; H150-E154 WeakPolarHBondContact O-CB 3.48Å; H150-E154 VanDerWaalsContact O-CG 3.26Å; H150-E154 WeakPolarHBondContact O-CG 3.46Å; H150-E154 PolarHBondContact O-N 3.44Å; E154-L156 HydrophobicContact CB-CD2 3.93Å; E154-L156 HydrophobicContact CB-CG 3.88Å; E154-L156 PolarHBondContact O-N 3.14Å; E154-R161 PolarHBondContact O-NH1 3.4Å
155	D	81.6	Confident	94.6	Very high	161 Å²	161	42.6 Å²	42.6	86%	0.861	21%	0.208	S	C	*	.			trans	-78.4	68	176.1	-167.3	21.9	0	0	0	110.7
156	L	90.2	Very high	94.6	Very high	37 Å²	37	46.9 Å²	46.9	19%	0.194	23%	0.227	C	C	.	.			trans	-87.1	172	179.7	-57.5	-172.5	0	0	0	112.6	Y113 I151 E154 R161	Y113-L156 HydrophobicContact CD1-CD1 4.12Å; I151-L156 HydrophobicContact CB-CD1 4.2Å; I151-L156 HydrophobicContact CG1-CD1 4.12Å; I151-L156 HydrophobicContact CG2-CD1 4.22Å; E154-L156 HydrophobicContact CB-CD2 3.93Å; E154-L156 HydrophobicContact CB-CG 3.88Å; E154-L156 PolarHBondContact O-N 3.14Å; L156-R161 HydrophobicContact CB-CG 4.48Å; L156-R161 WeakPolarHBondContact O-CD 3.48Å
157	Y	93.4	Very high	94.7	Very high	114 Å²	114	43.7 Å²	43.7	45%	0.447	21%	0.206	S	C	.	.			trans	-58.4	151.5	178	-59.1	-74.2	0	0	0	113.7	S114 E116 A159 S160 R161	S114-Y157 WeakPolarHBondContact O-CE2 3.45Å; E116-Y157 HydrophobicContact CB-CD1 4.04Å; E116-Y157 HydrophobicContact CB-CE1 4.41Å; E116-Y157 HydrophobicContact CB-CG 4.3Å; E116-Y157 HydrophobicContact CG-CD1 4.27Å; Y157-A159 PolarHBondContact O-N 3.2Å; Y157-A159 VanDerWaalsContact O-N 3.17Å; Y157-S160 WeakPolarHBondContact O-CB 3.38Å; Y157-S160 PolarHBondContact O-N 2.76Å; Y157-S160 VanDerWaalsContact O-N 3.14Å; Y157-R161 PolarHBondContact O-N 2.88Å; Y157-R161 VanDerWaalsContact O-N 3.13Å
158	C	94.5	Very high	94.8	Very high	41 Å²	41	43 Å²	43	28%	0.277	20%	0.202	S	C	.	.	H	α-helix	trans	-53.2	-37.9	175.9	178.5	0	0	0	0	112.2	K162 V197	C158-K162 WeakPolarHBondContact O-CB 3.4Å; C158-K162 PolarHBondContact O-N 2.96Å; C158-V197 HydrophobicContact CB-CG1 4.38Å
159	A	95.4	Very high	94.8	Very high	1 Å²	1	44 Å²	44	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-48.7	178.8	0	0	0	0	0	112.1	E116 V118 A121 Y157 R161 K162 V163	E116-A159 WeakPolarHBondContact O-CB 3.27Å; V118-A159 HydrophobicContact CG2-CB 4.08Å; A121-A159 HydrophobicContact CB-CB 3.88Å; Y157-A159 PolarHBondContact O-N 3.2Å; Y157-A159 VanDerWaalsContact O-N 3.17Å; A159-R161 PolarHBondContact O-N 2.9Å; A159-K162 WeakPolarHBondContact O-CB 3.29Å; A159-K162 PolarHBondContact O-N 3.42Å; A159-V163 WeakPolarHBondContact O-CG1 3.49Å; A159-V163 WeakPolarHBondContact O-CG2 3.29Å; A159-V163 PolarHBondContact O-N 2.91Å
160	S	96.2	Very high	94.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-56.4	-50.8	177.3	-39.5	0	0	0	0	111.4	I112 I151 Y157 K162 V163 V164	I112-S160 WeakPolarHBondContact O-CB 3.41Å; I112-S160 PolarHBondContact O-OG 3.31Å; I151-S160 WeakPolarHBondContact CG2-O 3.39Å; Y157-S160 WeakPolarHBondContact O-CB 3.38Å; Y157-S160 PolarHBondContact O-N 2.76Å; Y157-S160 VanDerWaalsContact O-N 3.14Å; S160-K162 VanDerWaalsContact C-N 3.33Å; S160-K162 PolarHBondContact O-N 2.87Å; S160-V163 VanDerWaalsContact O-CG2 3.3Å; S160-V163 WeakPolarHBondContact O-CG2 3.33Å; S160-V163 PolarHBondContact O-N 3.39Å; S160-V164 PolarHBondContact O-N 3.37Å; S160-V164 VanDerWaalsContact O-N 3.1Å
161	R	95.7	Very high	95	Very high	27 Å²	27	39.2 Å²	39.2	10%	0.102	19%	0.192	C	C	.	.	H	α-helix	trans	-68.6	-30.4	-179.7	-60.3	-178.9	71.7	81.2	1.1	112.4	I151 I152 E154 L156 Y157 A159 V164 E196 V200	I151-R161 HydrophobicContact CG2-CG 4.45Å; I151-R161 PolarHBondContact O-NH1 3.03Å; I151-R161 VanDerWaalsContact O-NH1 3.15Å; I152-R161 PolarHBondContact O-NH1 2.89Å; I152-R161 PolarHBondContact O-NH2 3.43Å; E154-R161 PolarHBondContact O-NH1 3.4Å; L156-R161 HydrophobicContact CB-CG 4.48Å; L156-R161 WeakPolarHBondContact O-CD 3.48Å; Y157-R161 PolarHBondContact O-N 2.88Å; Y157-R161 VanDerWaalsContact O-N 3.13Å; A159-R161 PolarHBondContact O-N 2.9Å; R161-V164 VanDerWaalsContact O-CG1 3.29Å; R161-V164 WeakPolarHBondContact O-CG1 3.41Å; R161-E196 IonicContact CZ-OE2 3.89Å; R161-E196 IonicContact NE-OE1 3.69Å; R161-E196 PolarHBondContact NE-OE1 3.44Å; R161-E196 IonicContact NE-OE2 2.72Å; R161-E196 PolarHBondContact NE-OE2 3.23Å; R161-E196 IonicContact NH2-OE2 3.2Å; R161-E196 PolarHBondContact NH2-OE2 2.92Å; R161-V200 HydrophobicContact CB-CB 4.48Å; R161-V200 HydrophobicContact CB-CG1 3.85Å; R161-V200 HydrophobicContact CB-CG2 3.76Å
162	K	96.2	Very high	95.1	Very high	62 Å²	62	40.1 Å²	40.1	27%	0.27	20%	0.196	S	C	.	.	H	α-helix	trans	-67	-50	173.8	-176.8	-163.9	172.4	-156.5	0	110.8	V118 E122 C158 A159 S160 V164 T165 V200 A203	V118-K162 HydrophobicContact CG1-CD 4.29Å; V118-K162 VanDerWaalsContact CG1-NZ 3.34Å; E122-K162 IonicContact OE1-NZ 2.87Å; E122-K162 PolarHBondContact OE1-NZ 3.46Å; C158-K162 WeakPolarHBondContact O-CB 3.4Å; C158-K162 PolarHBondContact O-N 2.96Å; A159-K162 WeakPolarHBondContact O-CB 3.29Å; A159-K162 PolarHBondContact O-N 3.42Å; S160-K162 VanDerWaalsContact C-N 3.33Å; S160-K162 PolarHBondContact O-N 2.87Å; K162-V164 VanDerWaalsContact C-N 3.33Å; K162-V164 PolarHBondContact O-N 3.49Å; K162-T165 PolarHBondContact O-N 2.98Å; K162-T165 PolarHBondContact O-OG1 3.02Å; K162-V200 HydrophobicContact CB-CG2 4.49Å; K162-A203 HydrophobicContact CG-CB 3.63Å
163	V	97.2	Very high	95.3	Very high	8 Å²	8	42.8 Å²	42.8	5%	0.048	22%	0.215	C	C	.	.	H	α-helix	trans	-71.8	-27.3	-174.7	-59.4	0	0	0	0	113	I112 A121 E122 C125 A159 S160 T165 K166 L167	I112-V163 HydrophobicContact CG2-CG2 4.07Å; A121-V163 HydrophobicContact CB-CG1 4Å; A121-V163 HydrophobicContact CB-CG2 4.15Å; E122-V163 HydrophobicContact CB-CG1 4.43Å; E122-V163 HydrophobicContact CG-CG1 3.67Å; C125-V163 HydrophobicContact CB-CB 3.77Å; C125-V163 HydrophobicContact CB-CG1 4.42Å; C125-V163 HydrophobicContact CB-CG2 3.96Å; A159-V163 WeakPolarHBondContact O-CG1 3.49Å; A159-V163 WeakPolarHBondContact O-CG2 3.29Å; A159-V163 PolarHBondContact O-N 2.91Å; S160-V163 VanDerWaalsContact O-CG2 3.3Å; S160-V163 WeakPolarHBondContact O-CG2 3.33Å; S160-V163 PolarHBondContact O-N 3.39Å; V163-T165 PolarHBondContact O-N 3.34Å; V163-K166 WeakPolarHBondContact O-CB 3.42Å; V163-K166 PolarHBondContact O-N 3.37Å; V163-K166 VanDerWaalsContact O-N 3.08Å; V163-L167 PolarHBondContact O-N 2.89Å; V163-L167 VanDerWaalsContact O-N 3.14Å
164	V	97	Very high	95.4	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-30.1	176.6	85.7	0	0	0	0	112.4	I148 I151 I152 S160 R161 K162 K166 L167 I168 L190	I148-V164 HydrophobicContact CB-CG2 4.25Å; I148-V164 HydrophobicContact CG1-CG2 4.02Å; I148-V164 HydrophobicContact CG2-CG2 4.14Å; I151-V164 HydrophobicContact CB-CB 4.26Å; I151-V164 HydrophobicContact CB-CG2 3.98Å; I151-V164 HydrophobicContact CD1-CB 4.29Å; I151-V164 HydrophobicContact CD1-CG2 3.85Å; I151-V164 HydrophobicContact CG2-CB 3.73Å; I151-V164 HydrophobicContact CG2-CG1 3.97Å; I151-V164 HydrophobicContact CG2-CG2 4.03Å; I152-V164 HydrophobicContact CD1-CG1 4.13Å; I152-V164 HydrophobicContact CD1-CG2 4.48Å; I152-V164 HydrophobicContact CG1-CG1 3.8Å; I152-V164 HydrophobicContact CG1-CG2 4.45Å; S160-V164 PolarHBondContact O-N 3.37Å; S160-V164 VanDerWaalsContact O-N 3.1Å; R161-V164 VanDerWaalsContact O-CG1 3.29Å; R161-V164 WeakPolarHBondContact O-CG1 3.41Å; K162-V164 VanDerWaalsContact C-N 3.33Å; K162-V164 PolarHBondContact O-N 3.49Å; V164-K166 VanDerWaalsContact C-N 3.26Å; V164-K166 PolarHBondContact O-N 3.22Å; V164-L167 PolarHBondContact O-N 3.12Å; V164-L167 VanDerWaalsContact O-N 3.12Å; V164-I168 WeakPolarHBondContact O-CG1 3.33Å; V164-I168 PolarHBondContact O-N 3.4Å; V164-L190 HydrophobicContact CG1-CD1 4.37Å
165	T	97.9	Very high	95.8	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-41.6	176.6	68.1	0	0	0	0	110.8	K162 V163 L187 L190 A203 A204	K162-T165 PolarHBondContact O-N 2.98Å; K162-T165 PolarHBondContact O-OG1 3.02Å; V163-T165 PolarHBondContact O-N 3.34Å; T165-L187 HydrophobicContact CG2-CD1 4.19Å; T165-L190 HydrophobicContact CG2-CD1 4.08Å; T165-A203 HydrophobicContact CG2-CB 4.48Å; T165-A204 HydrophobicContact CG2-CB 3.84Å
166	K	98	Very high	96.6	Very high	91 Å²	91	29.4 Å²	29.4	40%	0.396	15%	0.153	S	C	.	.	H	α-helix	trans	-70.3	-39.3	175.9	-172.9	-175.3	-179.2	-179.3	0	111.6	N126 I129 V163 V164 I168 I169 A170	N126-K166 PolarHBondContact OD1-NZ 3.12Å; I129-K166 HydrophobicContact CD1-CD 4.02Å; I129-K166 HydrophobicContact CD1-CG 3.92Å; V163-K166 WeakPolarHBondContact O-CB 3.42Å; V163-K166 PolarHBondContact O-N 3.37Å; V163-K166 VanDerWaalsContact O-N 3.08Å; V164-K166 VanDerWaalsContact C-N 3.26Å; V164-K166 PolarHBondContact O-N 3.22Å; K166-I168 VanDerWaalsContact C-N 3.34Å; K166-I169 PolarHBondContact O-N 2.85Å; K166-A170 PolarHBondContact O-N 3.49Å; K166-A170 VanDerWaalsContact O-N 3.12Å
167	L	98.1	Very high	96.8	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-40.1	177.2	-172.2	61.3	0	0	0	111.8	L128 I129 F144 I148 V163 V164 I169 A170 C171	L128-L167 HydrophobicContact CB-CD1 4.31Å; L128-L167 HydrophobicContact CD1-CD2 4.27Å; I129-L167 HydrophobicContact CG1-CD1 3.98Å; F144-L167 HydrophobicContact CD1-CD1 4.1Å; F144-L167 HydrophobicContact CD1-CD2 4.39Å; F144-L167 HydrophobicContact CE1-CD1 4.23Å; I148-L167 HydrophobicContact CD1-CG 4.26Å; I148-L167 HydrophobicContact CG1-CD2 4.03Å; I148-L167 HydrophobicContact CG1-CG 4.25Å; V163-L167 PolarHBondContact O-N 2.89Å; V163-L167 VanDerWaalsContact O-N 3.14Å; V164-L167 PolarHBondContact O-N 3.12Å; V164-L167 VanDerWaalsContact O-N 3.12Å; L167-I169 VanDerWaalsContact C-N 3.33Å; L167-I169 PolarHBondContact O-N 2.82Å; L167-A170 PolarHBondContact O-N 3.32Å; L167-C171 PolarHBondContact O-N 2.85Å; L167-C171 PolarHBondContact O-SG 3.07Å
168	I	98.3	Very high	97	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-51.8	-52.8	173.2	-75.2	169.3	0	0	0	110.5	I148 I152 V164 K166 A170 C171 Y172 F183 L187	I148-I168 HydrophobicContact CD1-CG1 4.35Å; I148-I168 HydrophobicContact CG2-CD1 4.25Å; I148-I168 HydrophobicContact CG2-CG1 3.72Å; I152-I168 HydrophobicContact CD1-CD1 3.9Å; V164-I168 WeakPolarHBondContact O-CG1 3.33Å; V164-I168 PolarHBondContact O-N 3.4Å; K166-I168 VanDerWaalsContact C-N 3.34Å; I168-A170 VanDerWaalsContact C-N 3.33Å; I168-A170 PolarHBondContact O-N 3.4Å; I168-C171 PolarHBondContact O-N 2.87Å; I168-Y172 WeakPolarHBondContact O-CB 3.41Å; I168-Y172 PolarHBondContact O-N 3.37Å; I168-F183 HydrophobicContact CG2-CB 3.84Å; I168-F183 HydrophobicContact CG2-CD2 4.31Å; I168-F183 HydrophobicContact CG2-CG 4.26Å; I168-L187 HydrophobicContact CD1-CB 4.37Å; I168-L187 HydrophobicContact CD1-CD1 4.46Å; I168-L187 HydrophobicContact CG2-CB 4.48Å; I168-L187 HydrophobicContact CG2-CD2 4.48Å
169	I	98	Very high	97.2	Very high	21 Å²	21	34 Å²	34	11%	0.108	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-42.1	-178.5	-65.5	-57.4	0	0	0	111.5	K166 L167 Y172 L187 Q207 P210 L211	K166-I169 PolarHBondContact O-N 2.85Å; L167-I169 VanDerWaalsContact C-N 3.33Å; L167-I169 PolarHBondContact O-N 2.82Å; I169-Y172 WeakPolarHBondContact O-CB 3.41Å; I169-Y172 PolarHBondContact O-N 3.08Å; I169-L187 HydrophobicContact CD1-CD2 3.75Å; I169-L187 HydrophobicContact CG1-CD2 4.41Å; I169-Q207 HydrophobicContact CD1-CB 4.15Å; I169-Q207 HydrophobicContact CG1-CB 3.7Å; I169-Q207 HydrophobicContact CG1-CG 4.07Å; I169-P210 HydrophobicContact CD1-CG 4.48Å; I169-P210 HydrophobicContact CG1-CG 4.23Å; I169-P210 HydrophobicContact CG2-CB 3.78Å; I169-P210 HydrophobicContact CG2-CG 3.93Å; I169-L211 HydrophobicContact CD1-CB 3.78Å; I169-L211 HydrophobicContact CD1-CD1 3.87Å; I169-L211 HydrophobicContact CD1-CG 4.42Å
170	A	97.9	Very high	97.3	Very high	28 Å²	28	36.5 Å²	36.5	23%	0.231	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-39.6	-179.4	0	0	0	0	0	112.5	I129 L132 K166 L167 I168	I129-A170 HydrophobicContact CB-CB 4.46Å; I129-A170 HydrophobicContact CD1-CB 4Å; I129-A170 HydrophobicContact CG1-CB 3.71Å; I129-A170 HydrophobicContact CG2-CB 4.06Å; L132-A170 HydrophobicContact CD1-CB 3.67Å; K166-A170 PolarHBondContact O-N 3.49Å; K166-A170 VanDerWaalsContact O-N 3.12Å; L167-A170 PolarHBondContact O-N 3.32Å; I168-A170 VanDerWaalsContact C-N 3.33Å; I168-A170 PolarHBondContact O-N 3.4Å
171	C	98.1	Very high	97.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-76.8	-25.6	178	-66.3	0	0	0	0	113	V140 I148 L167 I168 P173 M174 V175 F183	V140-C171 HydrophobicContact CG1-CB 4.34Å; I148-C171 HydrophobicContact CD1-CB 4.31Å; L167-C171 PolarHBondContact O-N 2.85Å; L167-C171 PolarHBondContact O-SG 3.07Å; I168-C171 PolarHBondContact O-N 2.87Å; C171-P173 VanDerWaalsContact C-CD 3.47Å; C171-M174 WeakPolarHBondContact O-CB 3.31Å; C171-M174 PolarHBondContact O-N 3.09Å; C171-V175 HydrophobicContact CB-CG1 4.25Å; C171-V175 PolarHBondContact O-N 3.35Å; C171-F183 HydrophobicContact CB-CE2 3.92Å
172	Y	97.7	Very high	97.3	Very high	18 Å²	18	41.4 Å²	41.4	7%	0.071	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-47.9	-47.2	-170.3	-169.7	-81.6	0	0	0	115.1	I168 I169 M174 Q180 F183 L211 L214 F215	I168-Y172 WeakPolarHBondContact O-CB 3.41Å; I168-Y172 PolarHBondContact O-N 3.37Å; I169-Y172 WeakPolarHBondContact O-CB 3.41Å; I169-Y172 PolarHBondContact O-N 3.08Å; Y172-M174 PolarHBondContact O-N 3.19Å; Y172-Q180 HydrophobicContact CD1-CG 4.26Å; Y172-Q180 HydrophobicContact CD2-CG 4.4Å; Y172-Q180 HydrophobicContact CE1-CB 4.3Å; Y172-Q180 HydrophobicContact CE1-CG 3.9Å; Y172-Q180 HydrophobicContact CE2-CB 3.83Å; Y172-Q180 HydrophobicContact CE2-CG 4.06Å; Y172-Q180 VanDerWaalsContact CE2-O 3.31Å; Y172-Q180 WeakPolarHBondContact CE2-O 3.15Å; Y172-Q180 HydrophobicContact CG-CG 4.47Å; Y172-Q180 WeakPolarHBondContact O-CG 3.44Å; Y172-Q180 PolarHBondContact O-NE2 3.36Å; Y172-Q180 WeakPolarHBondContact OH-CB 2.8Å; Y172-F183 HydrophobicContact CD2-CB 4.28Å; Y172-L211 HydrophobicContact CD2-CD1 4.19Å; Y172-L211 HydrophobicContact CE2-CD1 4.17Å; Y172-L214 HydrophobicContact CD1-CD1 3.76Å; Y172-L214 HydrophobicContact CG-CD1 4.13Å; Y172-F215 HydrophobicContact CE1-CE2 4.06Å; Y172-F215 HydrophobicContact CE1-CZ 4.46Å; Y172-F215 HydrophobicContact CE2-CE2 4.05Å; Y172-F215 HydrophobicContact CE2-CZ 4.29Å; Y172-F215 AromaticContact CZ-CE2 3.49Å; Y172-F215 VanDerWaalsContact CZ-CE2 3.49Å; Y172-F215 AromaticContact CZ-CZ 3.64Å; Y172-F215 WeakPolarHBondContact OH-CE2 3.42Å; Y172-F215 WeakPolarHBondContact OH-CZ 3.33Å
173	P	96.4	Very high	97.4	Very high	74 Å²	74	38.4 Å²	38.4	48%	0.481	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-71.4	-12.8	-178.6	-16.7	33	0	0	0	114.1	C171 L214	C171-P173 VanDerWaalsContact C-CD 3.47Å; P173-L214 HydrophobicContact CG-CD1 4.44Å; P173-L214 HydrophobicContact CG-CD2 4.03Å
174	M	96.7	Very high	97.4	Very high	33 Å²	33	39.7 Å²	39.7	16%	0.163	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-106.5	-10.7	-170.9	-52.9	-173.5	75.1	0	0	112.9	L132 N137 V140 C171 Y172	L132-M174 HydrophobicContact CB-SD 3.93Å; L132-M174 WeakPolarHBondContact O-CE 3.34Å; N137-M174 CarbonylContact C-O 3.6Å; N137-M174 WeakPolarHBondContact CA-O 3.46Å; N137-M174 VanDerWaalsContact CB-O 3.26Å; N137-M174 WeakPolarHBondContact CB-O 3.16Å; N137-M174 VanDerWaalsContact O-O 3.13Å; N137-M174 WeakPolarHBondContact OD1-CE 3.24Å; V140-M174 HydrophobicContact CB-CB 4.16Å; V140-M174 HydrophobicContact CG1-CB 3.9Å; V140-M174 HydrophobicContact CG2-CB 4.45Å; V140-M174 HydrophobicContact CG2-CE 3.86Å; V140-M174 HydrophobicContact CG2-SD 4.24Å; C171-M174 WeakPolarHBondContact O-CB 3.31Å; C171-M174 PolarHBondContact O-N 3.09Å; Y172-M174 PolarHBondContact O-N 3.19Å
175	V	97.7	Very high	97.4	Very high	10 Å²	10	46.9 Å²	46.9	6%	0.061	24%	0.24	C	C	.	.	S	Bend	trans	-97.1	160.8	179.9	-56	0	0	0	0	111.7	V140 D141 C171 N179 Q180 F183	V140-V175 HydrophobicContact CG1-CG1 4.24Å; D141-V175 HydrophobicContact CB-CB 4.4Å; D141-V175 HydrophobicContact CB-CG1 4.44Å; D141-V175 WeakPolarHBondContact OD2-CB 3.46Å; C171-V175 HydrophobicContact CB-CG1 4.25Å; C171-V175 PolarHBondContact O-N 3.35Å; V175-N179 HydrophobicContact CB-CB 3.81Å; V175-N179 HydrophobicContact CG2-CB 3.71Å; V175-Q180 HydrophobicContact CG2-CG 3.77Å; V175-Q180 PolarHBondContact O-NE2 3.06Å; V175-F183 HydrophobicContact CG1-CE2 3.9Å; V175-F183 HydrophobicContact CG1-CZ 4.37Å; V175-F183 HydrophobicContact CG2-CD2 4.09Å; V175-F183 HydrophobicContact CG2-CE2 3.95Å
176	S	97.2	Very high	97.3	Very high	49 Å²	49	48.5 Å²	48.5	34%	0.343	25%	0.246	S	C	.	.			trans	-58.7	155.4	175.2	62.5	0	0	0	0	112.2	D141 R178 N179 Q180	D141-S176 WeakPolarHBondContact OD2-CB 3.27Å; D141-S176 PolarHBondContact OD2-N 3.32Å; D141-S176 PolarHBondContact OD2-OG 3.2Å; S176-R178 PolarHBondContact O-N 3.49Å; S176-R178 VanDerWaalsContact O-N 3.1Å; S176-N179 PolarHBondContact O-N 3.32Å; S176-N179 PolarHBondContact OG-N 3.08Å; S176-Q180 WeakPolarHBondContact O-CG 3.01Å; S176-Q180 PolarHBondContact O-N 2.56Å
177	A	96.5	Very high	97.3	Very high	72 Å²	72	44.2 Å²	44.2	60%	0.595	23%	0.228	S	C	*	.	H	α-helix	trans	-54	-33.3	176.5	0	0	0	0	0	113	Q180 V181	A177-Q180 PolarHBondContact O-N 3Å; A177-V181 WeakPolarHBondContact O-CG2 3.35Å; A177-V181 PolarHBondContact O-N 3.32Å; A177-V181 VanDerWaalsContact O-N 3.13Å
178	R	97	Very high	97.3	Very high	210 Å²	210	45.5 Å²	45.5	79%	0.792	23%	0.233	S	C	*	.	H	α-helix	trans	-61.1	-49.6	174	178.8	-176.7	175.5	-178.3	-0.6	111.5	S176 Q180 V181 D182	S176-R178 PolarHBondContact O-N 3.49Å; S176-R178 VanDerWaalsContact O-N 3.1Å; R178-Q180 VanDerWaalsContact C-N 3.35Å; R178-V181 PolarHBondContact O-N 3.19Å; R178-D182 PolarHBondContact O-N 3.3Å; R178-D182 VanDerWaalsContact O-N 3.15Å
179	N	97.7	Very high	97.2	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.043	25%	0.253	C	S	.	.	H	α-helix	trans	-73.2	-28.7	-179.8	-74.3	-18.9	0	0	0	112.1	D141 R149 V175 S176 D182 F183	D141-N179 PolarHBondContact OD1-ND2 3.45Å; D141-N179 PolarHBondContact OD2-ND2 3.36Å; R149-N179 PolarHBondContact NH2-OD1 3.36Å; V175-N179 HydrophobicContact CB-CB 3.81Å; V175-N179 HydrophobicContact CG2-CB 3.71Å; S176-N179 PolarHBondContact O-N 3.32Å; S176-N179 PolarHBondContact OG-N 3.08Å; N179-D182 PolarHBondContact O-N 3.24Å; N179-F183 WeakPolarHBondContact O-CB 3.38Å; N179-F183 WeakPolarHBondContact O-CD1 3.35Å; N179-F183 WeakPolarHBondContact O-CG 3.28Å; N179-F183 PolarHBondContact O-N 2.97Å
180	Q	97.4	Very high	97.2	Very high	52 Å²	52	48.9 Å²	48.9	24%	0.243	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-46.6	170.8	-77.5	-178	-11.6	0	0	111.8	Y172 V175 S176 A177 R178 F183 K184	Y172-Q180 HydrophobicContact CD1-CG 4.26Å; Y172-Q180 HydrophobicContact CD2-CG 4.4Å; Y172-Q180 HydrophobicContact CE1-CB 4.3Å; Y172-Q180 HydrophobicContact CE1-CG 3.9Å; Y172-Q180 HydrophobicContact CE2-CB 3.83Å; Y172-Q180 HydrophobicContact CE2-CG 4.06Å; Y172-Q180 VanDerWaalsContact CE2-O 3.31Å; Y172-Q180 WeakPolarHBondContact CE2-O 3.15Å; Y172-Q180 HydrophobicContact CG-CG 4.47Å; Y172-Q180 WeakPolarHBondContact O-CG 3.44Å; Y172-Q180 PolarHBondContact O-NE2 3.36Å; Y172-Q180 WeakPolarHBondContact OH-CB 2.8Å; V175-Q180 HydrophobicContact CG2-CG 3.77Å; V175-Q180 PolarHBondContact O-NE2 3.06Å; S176-Q180 WeakPolarHBondContact O-CG 3.01Å; S176-Q180 PolarHBondContact O-N 2.56Å; A177-Q180 PolarHBondContact O-N 3Å; R178-Q180 VanDerWaalsContact C-N 3.35Å; Q180-F183 PolarHBondContact O-N 2.97Å; Q180-K184 WeakPolarHBondContact O-CB 3.39Å; Q180-K184 PolarHBondContact O-N 3.3Å
181	V	96.3	Very high	97.2	Very high	97 Å²	97	47.6 Å²	47.6	59%	0.588	24%	0.238	S	C	*	.	H	α-helix	trans	-62.5	-45.4	175.2	174.1	0	0	0	0	111.3	A177 R178 F183 K184 Y185	A177-V181 WeakPolarHBondContact O-CG2 3.35Å; A177-V181 PolarHBondContact O-N 3.32Å; A177-V181 VanDerWaalsContact O-N 3.13Å; R178-V181 PolarHBondContact O-N 3.19Å; V181-F183 PolarHBondContact O-N 3.33Å; V181-K184 PolarHBondContact O-N 3.42Å; V181-Y185 WeakPolarHBondContact O-CB 3.41Å; V181-Y185 PolarHBondContact O-N 2.95Å
182	D	97	Very high	97.2	Very high	33 Å²	33	51.6 Å²	51.6	18%	0.176	26%	0.259	C	S	.	.	H	α-helix	trans	-57.4	-47.3	176.3	-176.3	36.2	0	0	0	111.7	R149 R178 N179 Y185 R186	R149-D182 IonicContact CZ-OD2 3.84Å; R149-D182 IonicContact NE-OD2 3.91Å; R149-D182 PolarHBondContact NE-OD2 3.28Å; R149-D182 IonicContact NH2-OD2 3.76Å; R149-D182 PolarHBondContact NH2-OD2 3.44Å; R178-D182 PolarHBondContact O-N 3.3Å; R178-D182 VanDerWaalsContact O-N 3.15Å; N179-D182 PolarHBondContact O-N 3.24Å; D182-Y185 PolarHBondContact O-N 3.49Å; D182-R186 WeakPolarHBondContact O-CB 3.35Å; D182-R186 VanDerWaalsContact O-CG 3.3Å; D182-R186 WeakPolarHBondContact O-CG 3.29Å; D182-R186 PolarHBondContact O-N 3.41Å; D182-R186 IonicContact OD1-CZ 2.65Å; D182-R186 IonicContact OD1-NE 3.47Å; D182-R186 PolarHBondContact OD1-NE 3.36Å; D182-R186 IonicContact OD1-NH2 2.84Å; D182-R186 PolarHBondContact OD1-NH2 2.96Å; D182-R186 IonicContact OD2-NE 2.81Å
183	F	97.7	Very high	97.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68	-42.3	-179.1	-77.4	10.2	0	0	0	112.8	A145 I148 I168 C171 Y172 V175 N179 Q180 V181 Y185 R186 L187	A145-F183 HydrophobicContact CB-CE1 4.11Å; A145-F183 HydrophobicContact CB-CZ 3.91Å; I148-F183 HydrophobicContact CB-CE1 4.19Å; I148-F183 HydrophobicContact CB-CZ 4.34Å; I148-F183 HydrophobicContact CD1-CD2 4.38Å; I148-F183 HydrophobicContact CD1-CE1 4.01Å; I148-F183 HydrophobicContact CD1-CE2 3.58Å; I148-F183 HydrophobicContact CD1-CZ 3.37Å; I148-F183 HydrophobicContact CG1-CZ 4.43Å; I148-F183 HydrophobicContact CG2-CD1 4.22Å; I148-F183 HydrophobicContact CG2-CE1 3.9Å; I148-F183 HydrophobicContact CG2-CZ 4.39Å; I168-F183 HydrophobicContact CG2-CB 3.84Å; I168-F183 HydrophobicContact CG2-CD2 4.31Å; I168-F183 HydrophobicContact CG2-CG 4.26Å; C171-F183 HydrophobicContact CB-CE2 3.92Å; Y172-F183 HydrophobicContact CD2-CB 4.28Å; V175-F183 HydrophobicContact CG1-CE2 3.9Å; V175-F183 HydrophobicContact CG1-CZ 4.37Å; V175-F183 HydrophobicContact CG2-CD2 4.09Å; V175-F183 HydrophobicContact CG2-CE2 3.95Å; N179-F183 WeakPolarHBondContact O-CB 3.38Å; N179-F183 WeakPolarHBondContact O-CD1 3.35Å; N179-F183 WeakPolarHBondContact O-CG 3.28Å; N179-F183 PolarHBondContact O-N 2.97Å; Q180-F183 PolarHBondContact O-N 2.97Å; V181-F183 PolarHBondContact O-N 3.33Å; F183-Y185 VanDerWaalsContact C-N 3.34Å; F183-R186 PolarHBondContact O-N 2.9Å; F183-L187 WeakPolarHBondContact O-CB 3.48Å; F183-L187 PolarHBondContact O-N 3.22Å
184	K	97.3	Very high	96.9	Very high	35 Å²	35	55.7 Å²	55.7	15%	0.152	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-51.4	172.3	180	-179.3	68	156.8	0	109.9	Q180 V181 R186 L187 F188 L211 F215 L219 E222	Q180-K184 WeakPolarHBondContact O-CB 3.39Å; Q180-K184 PolarHBondContact O-N 3.3Å; V181-K184 PolarHBondContact O-N 3.42Å; K184-R186 PolarHBondContact O-N 3.3Å; K184-L187 PolarHBondContact O-N 2.66Å; K184-F188 HydrophobicContact CD-CE2 4.45Å; K184-F188 HydrophobicContact CG-CD2 3.96Å; K184-F188 HydrophobicContact CG-CE2 3.98Å; K184-F188 WeakPolarHBondContact O-CD2 3.25Å; K184-F188 PolarHBondContact O-N 3.22Å; K184-L211 HydrophobicContact CG-CD2 4.35Å; K184-F215 HydrophobicContact CB-CZ 4.48Å; K184-F215 HydrophobicContact CD-CE1 4.25Å; K184-F215 HydrophobicContact CD-CE2 4.22Å; K184-F215 HydrophobicContact CD-CZ 3.66Å; K184-F215 HydrophobicContact CG-CZ 4.4Å; K184-L219 HydrophobicContact CD-CD1 3.99Å; K184-E222 IonicContact NZ-OE1 3.84Å; K184-E222 PolarHBondContact NZ-OE1 3.3Å; K184-E222 IonicContact NZ-OE2 3.86Å; K184-E222 PolarHBondContact NZ-OE2 3.1Å
185	Y	97.1	Very high	96.7	Very high	151 Å²	151	62 Å²	62	59%	0.592	31%	0.31	S	S	*	.	H	α-helix	trans	-57.3	-48	-179.3	172.9	-100.4	0	0	0	111.9	V181 D182 F183 L187 F188 H189	V181-Y185 WeakPolarHBondContact O-CB 3.41Å; V181-Y185 PolarHBondContact O-N 2.95Å; D182-Y185 PolarHBondContact O-N 3.49Å; F183-Y185 VanDerWaalsContact C-N 3.34Å; Y185-L187 PolarHBondContact O-N 3.01Å; Y185-F188 PolarHBondContact O-N 2.95Å; Y185-H189 WeakPolarHBondContact O-CB 3.41Å; Y185-H189 PolarHBondContact O-N 3.01Å
186	R	96.3	Very high	96.5	Very high	36 Å²	36	62.6 Å²	62.6	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-63.5	-40.1	179.5	-72.6	174.3	-171.4	-90.1	-2.2	112.9	I152 E153 D182 F183 K184 H189 L190	I152-R186 HydrophobicContact CD1-CB 4.01Å; I152-R186 HydrophobicContact CD1-CG 4.46Å; E153-R186 IonicContact OE1-CZ 3.13Å; E153-R186 IonicContact OE1-NH1 3.14Å; E153-R186 PolarHBondContact OE1-NH1 3.43Å; E153-R186 IonicContact OE1-NH2 2.84Å; E153-R186 PolarHBondContact OE1-NH2 3.36Å; D182-R186 WeakPolarHBondContact O-CB 3.35Å; D182-R186 VanDerWaalsContact O-CG 3.3Å; D182-R186 WeakPolarHBondContact O-CG 3.29Å; D182-R186 PolarHBondContact O-N 3.41Å; D182-R186 IonicContact OD1-CZ 2.65Å; D182-R186 IonicContact OD1-NE 3.47Å; D182-R186 PolarHBondContact OD1-NE 3.36Å; D182-R186 IonicContact OD1-NH2 2.84Å; D182-R186 PolarHBondContact OD1-NH2 2.96Å; D182-R186 IonicContact OD2-NE 2.81Å; F183-R186 PolarHBondContact O-N 2.9Å; K184-R186 PolarHBondContact O-N 3.3Å; R186-H189 PolarHBondContact O-N 3.19Å; R186-L190 WeakPolarHBondContact O-CB 3.4Å; R186-L190 WeakPolarHBondContact O-CG 3.5Å; R186-L190 PolarHBondContact O-N 3.22Å
187	L	97.7	Very high	96.5	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.8	-41.9	177.8	-173.2	63.2	0	0	0	111.7	T165 I168 I169 F183 K184 Y185 L190 A191 A204 Q207 L211	T165-L187 HydrophobicContact CG2-CD1 4.19Å; I168-L187 HydrophobicContact CD1-CB 4.37Å; I168-L187 HydrophobicContact CD1-CD1 4.46Å; I168-L187 HydrophobicContact CG2-CB 4.48Å; I168-L187 HydrophobicContact CG2-CD2 4.48Å; I169-L187 HydrophobicContact CD1-CD2 3.75Å; I169-L187 HydrophobicContact CG1-CD2 4.41Å; F183-L187 WeakPolarHBondContact O-CB 3.48Å; F183-L187 PolarHBondContact O-N 3.22Å; K184-L187 PolarHBondContact O-N 2.66Å; Y185-L187 PolarHBondContact O-N 3.01Å; L187-L190 PolarHBondContact O-N 3.32Å; L187-A191 PolarHBondContact O-N 3.21Å; L187-A191 VanDerWaalsContact O-N 3.13Å; L187-A204 HydrophobicContact CD1-CB 3.84Å; L187-Q207 HydrophobicContact CD1-CB 4.06Å; L187-Q207 HydrophobicContact CD2-CB 3.88Å; L187-L211 HydrophobicContact CD2-CD2 4.17Å
188	F	98.1	Very high	96.5	Very high	28 Å²	28	61.5 Å²	61.5	12%	0.123	30%	0.296	C	S	.	.	H	α-helix	trans	-63.3	-43.6	173.4	-89.1	-113.5	0	0	0	111.6	K184 Y185 A191 D192 L208 L211 L219 E222 L226	K184-F188 HydrophobicContact CD-CE2 4.45Å; K184-F188 HydrophobicContact CG-CD2 3.96Å; K184-F188 HydrophobicContact CG-CE2 3.98Å; K184-F188 WeakPolarHBondContact O-CD2 3.25Å; K184-F188 PolarHBondContact O-N 3.22Å; Y185-F188 PolarHBondContact O-N 2.95Å; F188-A191 WeakPolarHBondContact O-CB 3.49Å; F188-A191 PolarHBondContact O-N 3.11Å; F188-A191 VanDerWaalsContact O-N 3.17Å; F188-D192 WeakPolarHBondContact O-CB 3.49Å; F188-D192 PolarHBondContact O-N 3.14Å; F188-L208 HydrophobicContact CD2-CD2 4.16Å; F188-L208 HydrophobicContact CE2-CD2 3.83Å; F188-L208 HydrophobicContact CZ-CD2 4.27Å; F188-L211 HydrophobicContact CD2-CD2 4.34Å; F188-L211 HydrophobicContact CE2-CD2 3.69Å; F188-L219 HydrophobicContact CE2-CD1 4.19Å; F188-L219 HydrophobicContact CZ-CD1 3.96Å; F188-L219 HydrophobicContact CZ-CG 4.41Å; F188-E222 HydrophobicContact CE1-CB 4.05Å; F188-E222 HydrophobicContact CZ-CB 4.27Å; F188-L226 HydrophobicContact CD1-CB 4.38Å; F188-L226 HydrophobicContact CD1-CD2 3.58Å; F188-L226 HydrophobicContact CD1-CG 4.44Å; F188-L226 HydrophobicContact CE1-CB 4.13Å; F188-L226 HydrophobicContact CE1-CD2 3.7Å; F188-L226 HydrophobicContact CG-CD2 4.19Å; F188-L226 HydrophobicContact CZ-CD2 4.4Å
189	H	96.5	Very high	96.5	Very high	92 Å²	92	56.3 Å²	56.3	43%	0.426	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-44.7	176.7	-179.3	-86.2	0	0	0	112.1	Y185 R186 A191 D192 S193	Y185-H189 WeakPolarHBondContact O-CB 3.41Å; Y185-H189 PolarHBondContact O-N 3.01Å; R186-H189 PolarHBondContact O-N 3.19Å; H189-A191 PolarHBondContact O-N 3.19Å; H189-D192 PolarHBondContact O-N 3.29Å; H189-S193 WeakPolarHBondContact O-CB 3.24Å; H189-S193 PolarHBondContact O-N 2.97Å
190	L	97.2	Very high	96.5	Very high	1 Å²	1	56 Å²	56	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-32	175.3	-73.5	173.7	0	0	0	112.5	I152 V164 T165 R186 L187 E196 V200 R201 A204	I152-L190 HydrophobicContact CD1-CD1 4.09Å; I152-L190 HydrophobicContact CG1-CD1 4.18Å; I152-L190 HydrophobicContact CG2-CD2 4.37Å; V164-L190 HydrophobicContact CG1-CD1 4.37Å; T165-L190 HydrophobicContact CG2-CD1 4.08Å; R186-L190 WeakPolarHBondContact O-CB 3.4Å; R186-L190 WeakPolarHBondContact O-CG 3.5Å; R186-L190 PolarHBondContact O-N 3.22Å; L187-L190 PolarHBondContact O-N 3.32Å; L190-E196 HydrophobicContact CD2-CG 4.39Å; L190-E196 VanDerWaalsContact CD2-OE2 3.32Å; L190-E196 WeakPolarHBondContact CD2-OE2 3.45Å; L190-V200 HydrophobicContact CD2-CG1 4.24Å; L190-R201 WeakPolarHBondContact O-CA 3.5Å; L190-R201 WeakPolarHBondContact O-CG 3.46Å; L190-A204 HydrophobicContact CB-CB 3.83Å
191	A	98.2	Very high	96.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-73.2	-43.4	176.2	0	0	0	0	0	112.2	L187 F188 H189 R201 A204 V205 L226 L230	L187-A191 PolarHBondContact O-N 3.21Å; L187-A191 VanDerWaalsContact O-N 3.13Å; F188-A191 WeakPolarHBondContact O-CB 3.49Å; F188-A191 PolarHBondContact O-N 3.11Å; F188-A191 VanDerWaalsContact O-N 3.17Å; H189-A191 PolarHBondContact O-N 3.19Å; A191-R201 PolarHBondContact O-NE 3.02Å; A191-R201 PolarHBondContact O-NH2 3.4Å; A191-A204 HydrophobicContact CB-CB 4.07Å; A191-V205 HydrophobicContact CB-CG2 3.78Å; A191-L226 HydrophobicContact CB-CD2 4.27Å; A191-L230 HydrophobicContact CB-CD1 4.34Å
192	D	97.4	Very high	96.6	Very high	84 Å²	84	49.6 Å²	49.6	45%	0.449	25%	0.247	S	C	.	.	H	α-helix	trans	-87.1	-24.4	-171.6	-160.2	48	0	0	0	114.2	F188 H189 E194 L226	F188-D192 WeakPolarHBondContact O-CB 3.49Å; F188-D192 PolarHBondContact O-N 3.14Å; H189-D192 PolarHBondContact O-N 3.29Å; D192-E194 PolarHBondContact O-N 3.07Å; D192-L226 HydrophobicContact CB-CD1 3.82Å
193	S	95.3	Very high	96.7	Very high	27 Å²	27	48.4 Å²	48.4	19%	0.189	24%	0.242	C	C	.	.			trans	-64.1	115.4	-175.8	180	0	0	0	0	112.3	H189 D195 E196 R201	H189-S193 WeakPolarHBondContact O-CB 3.24Å; H189-S193 PolarHBondContact O-N 2.97Å; S193-D195 VanDerWaalsContact C-N 3.3Å; S193-D195 PolarHBondContact O-N 3.31Å; S193-E196 WeakPolarHBondContact O-CB 3.4Å; S193-E196 PolarHBondContact O-N 2.97Å; S193-R201 WeakPolarHBondContact O-CD 3.47Å; S193-R201 PolarHBondContact O-NE 2.69Å
194	E	92.9	Very high	96.7	Very high	152 Å²	152	48.4 Å²	48.4	71%	0.71	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-25.6	178.4	-66.1	-168.3	166.1	0	0	113.6	D192 E196	D192-E194 PolarHBondContact O-N 3.07Å; E194-E196 VanDerWaalsContact C-N 3.27Å; E194-E196 PolarHBondContact O-N 3.39Å
195	D	91.9	Very high	96.8	Very high	166 Å²	166	46.8 Å²	46.8	89%	0.888	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.9	177.8	-64.9	-40.3	0	0	0	112.5	S193	S193-D195 VanDerWaalsContact C-N 3.3Å; S193-D195 PolarHBondContact O-N 3.31Å
196	E	95	Very high	96.9	Very high	21 Å²	21	44.8 Å²	44.8	10%	0.098	23%	0.231	C	C	.	.	S	Bend	trans	-77.6	149.7	-179.6	-179	60.2	-96.6	0	0	112.5	R161 L190 S193 E194 V200 R201	R161-E196 IonicContact CZ-OE2 3.89Å; R161-E196 IonicContact NE-OE1 3.69Å; R161-E196 PolarHBondContact NE-OE1 3.44Å; R161-E196 IonicContact NE-OE2 2.72Å; R161-E196 PolarHBondContact NE-OE2 3.23Å; R161-E196 IonicContact NH2-OE2 3.2Å; R161-E196 PolarHBondContact NH2-OE2 2.92Å; L190-E196 HydrophobicContact CD2-CG 4.39Å; L190-E196 VanDerWaalsContact CD2-OE2 3.32Å; L190-E196 WeakPolarHBondContact CD2-OE2 3.45Å; S193-E196 WeakPolarHBondContact O-CB 3.4Å; S193-E196 PolarHBondContact O-N 2.97Å; E194-E196 VanDerWaalsContact C-N 3.27Å; E194-E196 PolarHBondContact O-N 3.39Å; E196-V200 HydrophobicContact CG-CB 3.93Å; E196-V200 HydrophobicContact CG-CG1 3.87Å; E196-R201 HydrophobicContact CB-CG 3.74Å; E196-R201 HydrophobicContact CG-CG 3.72Å; E196-R201 VanDerWaalsContact O-CD 3.32Å; E196-R201 WeakPolarHBondContact O-CD 3Å
197	V	95.5	Very high	97	Very high	62 Å²	62	44.7 Å²	44.7	38%	0.376	23%	0.232	S	C	.	.			trans	-58.5	127.7	178.6	-179.6	0	0	0	0	110.2	C158 L199 V200 R201	C158-V197 HydrophobicContact CB-CG1 4.38Å; V197-L199 HydrophobicContact CG1-CB 4.45Å; V197-L199 PolarHBondContact O-N 2.99Å; V197-V200 HydrophobicContact CB-CB 4.45Å; V197-V200 HydrophobicContact CB-CG2 4.04Å; V197-V200 WeakPolarHBondContact O-CA 3.26Å; V197-V200 WeakPolarHBondContact O-CB 3.49Å; V197-V200 PolarHBondContact O-N 2.94Å; V197-R201 PolarHBondContact O-N 3.16Å
198	P	97.6	Very high	97	Very high	36 Å²	36	44.7 Å²	44.7	23%	0.234	23%	0.232	C	C	.	.	H	α-helix	trans	-55.7	-29.5	-173.8	-29.4	35.2	0	0	0	115.4	A202 Q235 V237	P198-A202 VanDerWaalsContact O-CB 3.29Å; P198-A202 WeakPolarHBondContact O-CB 3.46Å; P198-A202 PolarHBondContact O-N 3.33Å; P198-Q235 HydrophobicContact CB-CB 4.04Å; P198-Q235 HydrophobicContact CB-CG 3.91Å; P198-Q235 HydrophobicContact CG-CB 4.37Å; P198-Q235 HydrophobicContact CG-CG 3.7Å; P198-V237 HydrophobicContact CB-CG2 3.75Å
199	L	96.4	Very high	97	Very high	102 Å²	102	44.5 Å²	44.5	53%	0.534	23%	0.233	S	C	.	.	H	α-helix	trans	-71.6	-36.1	176.4	-66.3	177.8	0	0	0	112.6	V197 A203	V197-L199 HydrophobicContact CG1-CB 4.45Å; V197-L199 PolarHBondContact O-N 2.99Å; L199-A203 WeakPolarHBondContact O-CB 3.49Å; L199-A203 PolarHBondContact O-N 3.13Å
200	V	97.5	Very high	97.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.9	-46.8	173.8	177.3	0	0	0	0	109.4	R161 K162 L190 E196 V197 A202 A203 A204	R161-V200 HydrophobicContact CB-CB 4.48Å; R161-V200 HydrophobicContact CB-CG1 3.85Å; R161-V200 HydrophobicContact CB-CG2 3.76Å; K162-V200 HydrophobicContact CB-CG2 4.49Å; L190-V200 HydrophobicContact CD2-CG1 4.24Å; E196-V200 HydrophobicContact CG-CB 3.93Å; E196-V200 HydrophobicContact CG-CG1 3.87Å; V197-V200 HydrophobicContact CB-CB 4.45Å; V197-V200 HydrophobicContact CB-CG2 4.04Å; V197-V200 WeakPolarHBondContact O-CA 3.26Å; V197-V200 WeakPolarHBondContact O-CB 3.49Å; V197-V200 PolarHBondContact O-N 2.94Å; V200-A202 PolarHBondContact O-N 2.99Å; V200-A203 WeakPolarHBondContact O-CB 3.36Å; V200-A203 PolarHBondContact O-N 2.96Å; V200-A203 VanDerWaalsContact O-N 3.15Å; V200-A204 PolarHBondContact O-N 2.95Å
201	R	98.5	Very high	97.1	Very high	6 Å²	6	42.1 Å²	42.1	2%	0.023	23%	0.226	C	C	.	.	H	α-helix	trans	-55	-49.9	174.6	-58.8	179.9	64.9	-149.9	-5.7	111.6	L190 A191 S193 E196 V197 A203 A204 V205 D233 V238	L190-R201 WeakPolarHBondContact O-CA 3.5Å; L190-R201 WeakPolarHBondContact O-CG 3.46Å; A191-R201 PolarHBondContact O-NE 3.02Å; A191-R201 PolarHBondContact O-NH2 3.4Å; S193-R201 WeakPolarHBondContact O-CD 3.47Å; S193-R201 PolarHBondContact O-NE 2.69Å; E196-R201 HydrophobicContact CB-CG 3.74Å; E196-R201 HydrophobicContact CG-CG 3.72Å; E196-R201 VanDerWaalsContact O-CD 3.32Å; E196-R201 WeakPolarHBondContact O-CD 3Å; V197-R201 PolarHBondContact O-N 3.16Å; R201-A203 VanDerWaalsContact C-N 3.33Å; R201-A203 PolarHBondContact O-N 3.29Å; R201-A204 WeakPolarHBondContact O-CB 3.23Å; R201-A204 PolarHBondContact O-N 3.13Å; R201-A204 VanDerWaalsContact O-N 3.17Å; R201-V205 WeakPolarHBondContact O-CG2 3.44Å; R201-V205 PolarHBondContact O-N 3.35Å; R201-D233 IonicContact CZ-OD2 2.98Å; R201-D233 VanDerWaalsContact CZ-OD2 3.23Å; R201-D233 IonicContact NH1-OD1 2.66Å; R201-D233 PolarHBondContact NH1-OD1 3.09Å; R201-D233 IonicContact NH1-OD2 2.77Å; R201-D233 PolarHBondContact NH1-OD2 3.04Å; R201-D233 IonicContact NH2-OD2 2.67Å; R201-D233 PolarHBondContact NH2-OD2 3.24Å; R201-V238 HydrophobicContact CB-CG2 3.81Å
202	A	98.6	Very high	97	Very high	10 Å²	10	42.1 Å²	42.1	8%	0.083	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-39.9	177.9	0	0	0	0	0	112.5	P198 V200 V205 Q206 V237 A241	P198-A202 VanDerWaalsContact O-CB 3.29Å; P198-A202 WeakPolarHBondContact O-CB 3.46Å; P198-A202 PolarHBondContact O-N 3.33Å; V200-A202 PolarHBondContact O-N 2.99Å; A202-V205 PolarHBondContact O-N 2.78Å; A202-Q206 WeakPolarHBondContact O-CG 3.47Å; A202-Q206 PolarHBondContact O-N 3.06Å; A202-V237 HydrophobicContact CB-CB 4.43Å; A202-V237 HydrophobicContact CB-CG2 4.44Å; A202-A241 HydrophobicContact CB-CB 3.98Å
203	A	98.2	Very high	97	Very high	8 Å²	8	44.6 Å²	44.6	7%	0.066	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-42.4	174.5	0	0	0	0	0	111.9	K162 T165 L199 V200 R201 V205 Q206 Q207	K162-A203 HydrophobicContact CG-CB 3.63Å; T165-A203 HydrophobicContact CG2-CB 4.48Å; L199-A203 WeakPolarHBondContact O-CB 3.49Å; L199-A203 PolarHBondContact O-N 3.13Å; V200-A203 WeakPolarHBondContact O-CB 3.36Å; V200-A203 PolarHBondContact O-N 2.96Å; V200-A203 VanDerWaalsContact O-N 3.15Å; R201-A203 VanDerWaalsContact C-N 3.33Å; R201-A203 PolarHBondContact O-N 3.29Å; A203-V205 PolarHBondContact O-N 2.68Å; A203-Q206 PolarHBondContact O-N 3.12Å; A203-Q207 WeakPolarHBondContact O-CG 3.42Å; A203-Q207 PolarHBondContact O-N 2.99Å
204	A	98.7	Very high	97	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-44.8	175.2	0	0	0	0	0	111.8	T165 L187 L190 A191 V200 R201 Q206 Q207	T165-A204 HydrophobicContact CG2-CB 3.84Å; L187-A204 HydrophobicContact CD1-CB 3.84Å; L190-A204 HydrophobicContact CB-CB 3.83Å; A191-A204 HydrophobicContact CB-CB 4.07Å; V200-A204 PolarHBondContact O-N 2.95Å; R201-A204 WeakPolarHBondContact O-CB 3.23Å; R201-A204 PolarHBondContact O-N 3.13Å; R201-A204 VanDerWaalsContact O-N 3.17Å; A204-Q206 VanDerWaalsContact C-N 3.32Å; A204-Q206 PolarHBondContact O-N 3.05Å; A204-Q207 WeakPolarHBondContact O-CB 3.44Å; A204-Q207 PolarHBondContact O-N 3.12Å; A204-Q207 VanDerWaalsContact O-N 3.11Å
205	V	98.9	Very high	97	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-42	175.5	175.2	0	0	0	0	111.5	A191 R201 A202 A203 Q207 L208 L230 V238 A241 P245	A191-V205 HydrophobicContact CB-CG2 3.78Å; R201-V205 WeakPolarHBondContact O-CG2 3.44Å; R201-V205 PolarHBondContact O-N 3.35Å; A202-V205 PolarHBondContact O-N 2.78Å; A203-V205 PolarHBondContact O-N 2.68Å; V205-Q207 PolarHBondContact O-N 2.7Å; V205-L208 HydrophobicContact CG1-CD1 4.35Å; V205-L208 VanDerWaalsContact O-CB 3.24Å; V205-L208 WeakPolarHBondContact O-CB 3.43Å; V205-L208 WeakPolarHBondContact O-CG 3.11Å; V205-L208 PolarHBondContact O-N 3.15Å; V205-L230 HydrophobicContact CG2-CD1 3.61Å; V205-V238 HydrophobicContact CG2-CG1 4.48Å; V205-A241 HydrophobicContact CB-CB 3.96Å; V205-A241 HydrophobicContact CG1-CB 3.84Å; V205-A241 WeakPolarHBondContact CG1-O 3.47Å; V205-P245 HydrophobicContact CG1-CG 4.02Å; V205-P245 WeakPolarHBondContact O-CG 3.28Å
206	Q	97.9	Very high	96.9	Very high	110 Å²	110	35.3 Å²	35.3	51%	0.514	19%	0.188	S	C	.	.	H	α-helix	trans	-62.8	-30.9	177.5	-73.2	179.2	-1.7	0	0	113.1	A202 A203 A204 L208 A241	A202-Q206 WeakPolarHBondContact O-CG 3.47Å; A202-Q206 PolarHBondContact O-N 3.06Å; A203-Q206 PolarHBondContact O-N 3.12Å; A204-Q206 VanDerWaalsContact C-N 3.32Å; A204-Q206 PolarHBondContact O-N 3.05Å; Q206-L208 PolarHBondContact O-N 2.98Å; Q206-A241 HydrophobicContact CG-CB 4.16Å
207	Q	98.3	Very high	96.6	Very high	33 Å²	33	38.7 Å²	38.7	15%	0.154	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.4	175.8	-62.4	-46.6	-47.9	0	0	113.7	I169 L187 A203 A204 V205 V209 P210 L211	I169-Q207 HydrophobicContact CD1-CB 4.15Å; I169-Q207 HydrophobicContact CG1-CB 3.7Å; I169-Q207 HydrophobicContact CG1-CG 4.07Å; L187-Q207 HydrophobicContact CD1-CB 4.06Å; L187-Q207 HydrophobicContact CD2-CB 3.88Å; A203-Q207 WeakPolarHBondContact O-CG 3.42Å; A203-Q207 PolarHBondContact O-N 2.99Å; A204-Q207 WeakPolarHBondContact O-CB 3.44Å; A204-Q207 PolarHBondContact O-N 3.12Å; A204-Q207 VanDerWaalsContact O-N 3.11Å; V205-Q207 PolarHBondContact O-N 2.7Å; Q207-V209 PolarHBondContact O-N 3.03Å; Q207-P210 WeakPolarHBondContact O-CD 3.39Å; Q207-P210 VanDerWaalsContact O-CG 3.25Å; Q207-P210 WeakPolarHBondContact O-CG 3.4Å; Q207-L211 WeakPolarHBondContact O-CB 3.41Å; Q207-L211 PolarHBondContact O-N 3.12Å; Q207-L211 VanDerWaalsContact O-N 3.11Å
208	L	98.6	Very high	96.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-67	-25.3	175.7	-60.5	175.2	0	0	0	112.5	F188 V205 Q206 L211 A212 L223 L226 P245	F188-L208 HydrophobicContact CD2-CD2 4.16Å; F188-L208 HydrophobicContact CE2-CD2 3.83Å; F188-L208 HydrophobicContact CZ-CD2 4.27Å; V205-L208 HydrophobicContact CG1-CD1 4.35Å; V205-L208 VanDerWaalsContact O-CB 3.24Å; V205-L208 WeakPolarHBondContact O-CB 3.43Å; V205-L208 WeakPolarHBondContact O-CG 3.11Å; V205-L208 PolarHBondContact O-N 3.15Å; Q206-L208 PolarHBondContact O-N 2.98Å; L208-L211 HydrophobicContact CD2-CD2 4.22Å; L208-A212 WeakPolarHBondContact O-CB 3.47Å; L208-A212 PolarHBondContact O-N 3.12Å; L208-L223 HydrophobicContact CB-CD1 4.08Å; L208-L223 HydrophobicContact CD1-CD1 3.92Å; L208-L223 HydrophobicContact CG-CD1 4.48Å; L208-L226 HydrophobicContact CD1-CD2 3.66Å; L208-L226 HydrophobicContact CD2-CD2 4.4Å; L208-P245 HydrophobicContact CB-CB 4.13Å; L208-P245 HydrophobicContact CB-CG 4.08Å
209	V	98.3	Very high	96.4	Very high	25 Å²	25	41.4 Å²	41.4	15%	0.152	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-57.4	174.6	178.6	0	0	0	0	112	Q207 L211 A212 K213 P244 P245 E248	Q207-V209 PolarHBondContact O-N 3.03Å; V209-L211 VanDerWaalsContact C-N 3.27Å; V209-L211 PolarHBondContact O-N 3.21Å; V209-A212 WeakPolarHBondContact O-CB 3.38Å; V209-A212 PolarHBondContact O-N 3.28Å; V209-K213 WeakPolarHBondContact O-CG 3.44Å; V209-K213 PolarHBondContact O-N 3.02Å; V209-K213 VanDerWaalsContact O-N 3.12Å; V209-P244 VanDerWaalsContact CG2-C 3.45Å; V209-P244 HydrophobicContact CG2-CB 3.85Å; V209-P245 HydrophobicContact CG2-CB 4.35Å; V209-P245 HydrophobicContact CG2-CG 3.96Å; V209-E248 HydrophobicContact CG1-CG 4.5Å
210	P	98	Very high	96.3	Very high	42 Å²	42	38.7 Å²	38.7	27%	0.273	20%	0.201	S	C	.	.	H	α-helix	trans	-63.9	-32.9	176.8	24.4	-33.8	0	0	0	112.4	I169 Q207 K213 L214	I169-P210 HydrophobicContact CD1-CG 4.48Å; I169-P210 HydrophobicContact CG1-CG 4.23Å; I169-P210 HydrophobicContact CG2-CB 3.78Å; I169-P210 HydrophobicContact CG2-CG 3.93Å; Q207-P210 WeakPolarHBondContact O-CD 3.39Å; Q207-P210 VanDerWaalsContact O-CG 3.25Å; Q207-P210 WeakPolarHBondContact O-CG 3.4Å; P210-K213 PolarHBondContact O-N 2.91Å; P210-L214 WeakPolarHBondContact O-CG 3.44Å; P210-L214 PolarHBondContact O-N 3.22Å
211	L	97.7	Very high	96.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-48.8	172.5	-168.9	75.1	0	0	0	111.7	I169 Y172 K184 L187 F188 Q207 L208 V209 K213 L214 F215 L219	I169-L211 HydrophobicContact CD1-CB 3.78Å; I169-L211 HydrophobicContact CD1-CD1 3.87Å; I169-L211 HydrophobicContact CD1-CG 4.42Å; Y172-L211 HydrophobicContact CD2-CD1 4.19Å; Y172-L211 HydrophobicContact CE2-CD1 4.17Å; K184-L211 HydrophobicContact CG-CD2 4.35Å; L187-L211 HydrophobicContact CD2-CD2 4.17Å; F188-L211 HydrophobicContact CD2-CD2 4.34Å; F188-L211 HydrophobicContact CE2-CD2 3.69Å; Q207-L211 WeakPolarHBondContact O-CB 3.41Å; Q207-L211 PolarHBondContact O-N 3.12Å; Q207-L211 VanDerWaalsContact O-N 3.11Å; L208-L211 HydrophobicContact CD2-CD2 4.22Å; V209-L211 VanDerWaalsContact C-N 3.27Å; V209-L211 PolarHBondContact O-N 3.21Å; L211-K213 PolarHBondContact O-N 3.04Å; L211-L214 WeakPolarHBondContact O-CB 3.42Å; L211-L214 PolarHBondContact O-N 3.23Å; L211-F215 HydrophobicContact CD1-CD2 4.2Å; L211-F215 HydrophobicContact CD1-CE2 3.76Å; L211-F215 HydrophobicContact CG-CD2 4.06Å; L211-F215 HydrophobicContact CG-CE2 3.99Å; L211-F215 WeakPolarHBondContact O-CD2 3.35Å; L211-F215 PolarHBondContact O-N 3.08Å; L211-L219 HydrophobicContact CD2-CD2 3.99Å; L211-L219 HydrophobicContact CG-CD2 4.16Å
212	A	97	Very high	96.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.7	-36.1	177.3	0	0	0	0	0	111.8	L208 V209 L214 F215 G216 L219 L223 E248 M252	L208-A212 WeakPolarHBondContact O-CB 3.47Å; L208-A212 PolarHBondContact O-N 3.12Å; V209-A212 WeakPolarHBondContact O-CB 3.38Å; V209-A212 PolarHBondContact O-N 3.28Å; A212-L214 PolarHBondContact O-N 3.31Å; A212-F215 PolarHBondContact O-N 3.41Å; A212-G216 WeakPolarHBondContact O-CA 3.19Å; A212-G216 PolarHBondContact O-N 2.79Å; A212-L219 HydrophobicContact CB-CD2 4.06Å; A212-L223 HydrophobicContact CB-CD2 4.25Å; A212-E248 HydrophobicContact CB-CG 3.86Å; A212-M252 HydrophobicContact CB-CE 3.57Å; A212-M252 VanDerWaalsContact O-CE 3.27Å; A212-M252 WeakPolarHBondContact O-CE 3.35Å
213	K	96.3	Very high	96	Very high	136 Å²	136	46 Å²	46	59%	0.591	24%	0.243	S	C	*	.	H	α-helix	trans	-68.8	-28.6	174.2	-68.7	176.1	-179.2	179	0	114.2	V209 P210 L211	V209-K213 WeakPolarHBondContact O-CG 3.44Å; V209-K213 PolarHBondContact O-N 3.02Å; V209-K213 VanDerWaalsContact O-N 3.12Å; P210-K213 PolarHBondContact O-N 2.91Å; L211-K213 PolarHBondContact O-N 3.04Å
214	L	94.9	Very high	96	Very high	82 Å²	82	46.5 Å²	46.5	43%	0.429	25%	0.25	S	C	.	.	H	α-helix	trans	-75.2	-35.3	176.8	-68.7	169.3	0	0	0	112.2	Y172 P173 P210 L211 A212	Y172-L214 HydrophobicContact CD1-CD1 3.76Å; Y172-L214 HydrophobicContact CG-CD1 4.13Å; P173-L214 HydrophobicContact CG-CD1 4.44Å; P173-L214 HydrophobicContact CG-CD2 4.03Å; P210-L214 WeakPolarHBondContact O-CG 3.44Å; P210-L214 PolarHBondContact O-N 3.22Å; L211-L214 WeakPolarHBondContact O-CB 3.42Å; L211-L214 PolarHBondContact O-N 3.23Å; A212-L214 PolarHBondContact O-N 3.31Å
215	F	93.1	Very high	95.9	Very high	46 Å²	46	53 Å²	53	20%	0.202	28%	0.284	C	S	.	.	H	α-helix	trans	-89.9	-30.1	179.5	-80.2	-94.7	0	0	0	113.9	Y172 K184 L211 A212 L219	Y172-F215 HydrophobicContact CE1-CE2 4.06Å; Y172-F215 HydrophobicContact CE1-CZ 4.46Å; Y172-F215 HydrophobicContact CE2-CE2 4.05Å; Y172-F215 HydrophobicContact CE2-CZ 4.29Å; Y172-F215 AromaticContact CZ-CE2 3.49Å; Y172-F215 VanDerWaalsContact CZ-CE2 3.49Å; Y172-F215 AromaticContact CZ-CZ 3.64Å; Y172-F215 WeakPolarHBondContact OH-CE2 3.42Å; Y172-F215 WeakPolarHBondContact OH-CZ 3.33Å; K184-F215 HydrophobicContact CB-CZ 4.48Å; K184-F215 HydrophobicContact CD-CE1 4.25Å; K184-F215 HydrophobicContact CD-CE2 4.22Å; K184-F215 HydrophobicContact CD-CZ 3.66Å; K184-F215 HydrophobicContact CG-CZ 4.4Å; L211-F215 HydrophobicContact CD1-CD2 4.2Å; L211-F215 HydrophobicContact CD1-CE2 3.76Å; L211-F215 HydrophobicContact CG-CD2 4.06Å; L211-F215 HydrophobicContact CG-CE2 3.99Å; L211-F215 WeakPolarHBondContact O-CD2 3.35Å; L211-F215 PolarHBondContact O-N 3.08Å; A212-F215 PolarHBondContact O-N 3.41Å; F215-L219 HydrophobicContact CB-CB 3.88Å; F215-L219 HydrophobicContact CG-CB 4.37Å; F215-L219 HydrophobicContact CG-CD1 4.44Å
216	G	89.6	Confident	95.9	Very high	22 Å²	22	53.5 Å²	53.5	23%	0.227	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	65.6	-145.4	-168.1	0	0	0	0	0	112.2	A212 E218 L219 M252	A212-G216 WeakPolarHBondContact O-CA 3.19Å; A212-G216 PolarHBondContact O-N 2.79Å; G216-E218 PolarHBondContact O-N 3.4Å; G216-E218 VanDerWaalsContact O-N 3.09Å; G216-L219 PolarHBondContact O-N 3.24Å; G216-M252 WeakPolarHBondContact O-CE 3.19Å
217	P	90.1	Very high	95.9	Very high	92 Å²	92	48.3 Å²	48.3	60%	0.597	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-67.1	-12.8	-170.3	28.3	-35.6	0	0	0	114.4	L219 K220	P217-L219 PolarHBondContact O-N 3.04Å; P217-K220 WeakPolarHBondContact O-CB 3.33Å; P217-K220 PolarHBondContact O-N 3.49Å
218	E	92.8	Very high	95.8	Very high	155 Å²	155	49.2 Å²	49.2	72%	0.724	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-64	-28.5	178.3	-63.1	-179	-179.4	0	0	112.6	G216 K220	G216-E218 PolarHBondContact O-N 3.4Å; G216-E218 VanDerWaalsContact O-N 3.09Å; E218-K220 VanDerWaalsContact C-N 3.29Å; E218-K220 PolarHBondContact O-N 3.41Å
219	L	95.3	Very high	95.7	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-79.8	-10.3	178.7	-161.2	67.2	0	0	0	113.1	K184 F188 L211 A212 F215 G216 P217 S221 E222 L223	K184-L219 HydrophobicContact CD-CD1 3.99Å; F188-L219 HydrophobicContact CE2-CD1 4.19Å; F188-L219 HydrophobicContact CZ-CD1 3.96Å; F188-L219 HydrophobicContact CZ-CG 4.41Å; L211-L219 HydrophobicContact CD2-CD2 3.99Å; L211-L219 HydrophobicContact CG-CD2 4.16Å; A212-L219 HydrophobicContact CB-CD2 4.06Å; F215-L219 HydrophobicContact CB-CB 3.88Å; F215-L219 HydrophobicContact CG-CB 4.37Å; F215-L219 HydrophobicContact CG-CD1 4.44Å; G216-L219 PolarHBondContact O-N 3.24Å; P217-L219 PolarHBondContact O-N 3.04Å; L219-S221 PolarHBondContact O-N 3.11Å; L219-E222 PolarHBondContact O-N 3.22Å; L219-L223 HydrophobicContact CG-CB 4.3Å; L219-L223 VanDerWaalsContact O-CB 3.28Å; L219-L223 WeakPolarHBondContact O-CB 3.24Å; L219-L223 PolarHBondContact O-N 3.45Å
220	K	95	Very high	95.7	Very high	44 Å²	44	50.7 Å²	50.7	19%	0.191	29%	0.287	C	S	.	.	H	α-helix	trans	-50.9	-49.9	-169	-177.8	-178.1	65.2	160.7	0	113.2	P217 E218 G224 L249 M252 I253 E258	P217-K220 WeakPolarHBondContact O-CB 3.33Å; P217-K220 PolarHBondContact O-N 3.49Å; E218-K220 VanDerWaalsContact C-N 3.29Å; E218-K220 PolarHBondContact O-N 3.41Å; K220-G224 PolarHBondContact O-N 2.87Å; K220-L249 HydrophobicContact CB-CD1 4.48Å; K220-L249 HydrophobicContact CG-CD1 3.8Å; K220-L249 WeakPolarHBondContact O-CD1 3.4Å; K220-M252 HydrophobicContact CD-CB 4.49Å; K220-M252 HydrophobicContact CG-CB 4.46Å; K220-I253 HydrophobicContact CD-CG1 3.78Å; K220-I253 HydrophobicContact CG-CG1 4.31Å; K220-E258 WeakPolarHBondContact CE-OE1 3.14Å; K220-E258 IonicContact NZ-OE1 3Å; K220-E258 PolarHBondContact NZ-OE1 2.8Å; K220-E258 IonicContact NZ-OE2 3.98Å; K220-E258 PolarHBondContact NZ-OE2 3.48Å
221	S	94.8	Very high	95.7	Very high	85 Å²	85	48.9 Å²	48.9	59%	0.594	28%	0.275	S	S	*	.	H	α-helix	trans	-68	-45.5	-175.7	-55.9	0	0	0	0	112.5	L219 G224 L225	L219-S221 PolarHBondContact O-N 3.11Å; S221-G224 PolarHBondContact O-N 2.89Å; S221-L225 WeakPolarHBondContact O-CG 3.31Å; S221-L225 PolarHBondContact O-N 2.84Å; S221-L225 VanDerWaalsContact O-N 3.1Å
222	E	95.9	Very high	95.6	Very high	84 Å²	84	51.7 Å²	51.7	39%	0.393	29%	0.294	S	S	.	.	H	α-helix	trans	-65.7	-43.2	178.4	-66.6	178.8	-140.3	0	0	110.9	K184 F188 L219 L225 L226	K184-E222 IonicContact NZ-OE1 3.84Å; K184-E222 PolarHBondContact NZ-OE1 3.3Å; K184-E222 IonicContact NZ-OE2 3.86Å; K184-E222 PolarHBondContact NZ-OE2 3.1Å; F188-E222 HydrophobicContact CE1-CB 4.05Å; F188-E222 HydrophobicContact CZ-CB 4.27Å; L219-E222 PolarHBondContact O-N 3.22Å; E222-L225 PolarHBondContact O-N 3.04Å; E222-L226 WeakPolarHBondContact O-CB 3.06Å; E222-L226 PolarHBondContact O-N 3.11Å
223	L	97.7	Very high	95.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-41.6	177.3	-178	60.5	0	0	0	111.8	L208 A212 L219 L226 L227 P245 L249	L208-L223 HydrophobicContact CB-CD1 4.08Å; L208-L223 HydrophobicContact CD1-CD1 3.92Å; L208-L223 HydrophobicContact CG-CD1 4.48Å; A212-L223 HydrophobicContact CB-CD2 4.25Å; L219-L223 HydrophobicContact CG-CB 4.3Å; L219-L223 VanDerWaalsContact O-CB 3.28Å; L219-L223 WeakPolarHBondContact O-CB 3.24Å; L219-L223 PolarHBondContact O-N 3.45Å; L223-L226 PolarHBondContact O-N 3.27Å; L223-L227 HydrophobicContact CD1-CD1 3.86Å; L223-L227 HydrophobicContact CD1-CG 3.97Å; L223-L227 HydrophobicContact CG-CD1 3.91Å; L223-L227 HydrophobicContact CG-CG 4.37Å; L223-L227 WeakPolarHBondContact O-CB 3.38Å; L223-L227 VanDerWaalsContact O-CG 3.31Å; L223-L227 WeakPolarHBondContact O-CG 3.2Å; L223-L227 PolarHBondContact O-N 3.23Å; L223-P245 HydrophobicContact CD1-CB 4.42Å; L223-L249 HydrophobicContact CB-CD1 4.45Å; L223-L249 HydrophobicContact CD2-CB 3.97Å; L223-L249 HydrophobicContact CD2-CD1 4.31Å; L223-L249 HydrophobicContact CG-CB 4.39Å; L223-L249 HydrophobicContact CG-CD1 4.39Å
224	G	97	Very high	95.7	Very high	19 Å²	19	52.4 Å²	52.4	20%	0.196	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-44.7	176.8	0	0	0	0	0	112.8	K220 S221 A228	K220-G224 PolarHBondContact O-N 2.87Å; S221-G224 PolarHBondContact O-N 2.89Å; G224-A228 WeakPolarHBondContact O-CB 3.25Å; G224-A228 PolarHBondContact O-N 3.18Å
225	L	96.6	Very high	95.8	Very high	136 Å²	136	52.2 Å²	52.2	71%	0.712	30%	0.302	S	S	*	.	H	α-helix	trans	-64.5	-45.1	177.2	-71.3	173.3	0	0	0	112	S221 E222 A228 S229	S221-L225 WeakPolarHBondContact O-CG 3.31Å; S221-L225 PolarHBondContact O-N 2.84Å; S221-L225 VanDerWaalsContact O-N 3.1Å; E222-L225 PolarHBondContact O-N 3.04Å; L225-A228 PolarHBondContact O-N 3.35Å; L225-S229 PolarHBondContact O-N 3.34Å
226	L	98.3	Very high	96	Very high	12 Å²	12	56.1 Å²	56.1	6%	0.063	32%	0.315	C	S	.	.	H	α-helix	trans	-63.1	-46.4	177.9	179.8	64.4	0	0	0	111.4	F188 A191 D192 L208 E222 L223 A228 S229 L230	F188-L226 HydrophobicContact CD1-CB 4.38Å; F188-L226 HydrophobicContact CD1-CD2 3.58Å; F188-L226 HydrophobicContact CD1-CG 4.44Å; F188-L226 HydrophobicContact CE1-CB 4.13Å; F188-L226 HydrophobicContact CE1-CD2 3.7Å; F188-L226 HydrophobicContact CG-CD2 4.19Å; F188-L226 HydrophobicContact CZ-CD2 4.4Å; A191-L226 HydrophobicContact CB-CD2 4.27Å; D192-L226 HydrophobicContact CB-CD1 3.82Å; L208-L226 HydrophobicContact CD1-CD2 3.66Å; L208-L226 HydrophobicContact CD2-CD2 4.4Å; E222-L226 WeakPolarHBondContact O-CB 3.06Å; E222-L226 PolarHBondContact O-N 3.11Å; L223-L226 PolarHBondContact O-N 3.27Å; L226-A228 VanDerWaalsContact C-N 3.31Å; L226-A228 PolarHBondContact O-N 3.46Å; L226-S229 PolarHBondContact O-N 2.97Å; L226-S229 PolarHBondContact O-OG 3.24Å; L226-L230 HydrophobicContact CD1-CD1 3.77Å; L226-L230 HydrophobicContact CD1-CG 4.02Å; L226-L230 HydrophobicContact CD2-CD1 4.23Å; L226-L230 HydrophobicContact CG-CD1 3.69Å; L226-L230 HydrophobicContact CG-CG 4.26Å; L226-L230 VanDerWaalsContact O-CG 3.32Å; L226-L230 WeakPolarHBondContact O-CG 3.24Å; L226-L230 PolarHBondContact O-N 2.95Å; L226-L230 VanDerWaalsContact O-N 3.08Å
227	L	98.4	Very high	96.4	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-66.5	-35.2	-179.8	-69.1	176.4	0	0	0	112	L223 S229 L230 V231 C242 P245 L246 L249	L223-L227 HydrophobicContact CD1-CD1 3.86Å; L223-L227 HydrophobicContact CD1-CG 3.97Å; L223-L227 HydrophobicContact CG-CD1 3.91Å; L223-L227 HydrophobicContact CG-CG 4.37Å; L223-L227 WeakPolarHBondContact O-CB 3.38Å; L223-L227 VanDerWaalsContact O-CG 3.31Å; L223-L227 WeakPolarHBondContact O-CG 3.2Å; L223-L227 PolarHBondContact O-N 3.23Å; L227-S229 PolarHBondContact O-N 3.02Å; L227-L230 PolarHBondContact O-N 3.18Å; L227-V231 WeakPolarHBondContact O-CG1 3.42Å; L227-V231 WeakPolarHBondContact O-CG2 3.44Å; L227-V231 PolarHBondContact O-N 3.34Å; L227-C242 HydrophobicContact CD2-CB 4.14Å; L227-P245 HydrophobicContact CD1-CB 3.99Å; L227-P245 HydrophobicContact CD2-CB 3.99Å; L227-L246 HydrophobicContact CD1-CB 4.35Å; L227-L246 HydrophobicContact CD1-CD1 4.42Å; L227-L249 HydrophobicContact CD1-CB 4.31Å; L227-L249 HydrophobicContact CD1-CD2 4.01Å
228	A	96.6	Very high	96.8	Very high	51 Å²	51	52.3 Å²	52.3	42%	0.421	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-34	177.5	0	0	0	0	0	113	G224 L225 L226	G224-A228 WeakPolarHBondContact O-CB 3.25Å; G224-A228 PolarHBondContact O-N 3.18Å; L225-A228 PolarHBondContact O-N 3.35Å; L226-A228 VanDerWaalsContact C-N 3.31Å; L226-A228 PolarHBondContact O-N 3.46Å
229	S	95.9	Very high	97.1	Very high	55 Å²	55	46.6 Å²	46.6	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-75.7	-51.7	171.3	65.5	0	0	0	0	111.2	L225 L226 L227 V231 S232	L225-S229 PolarHBondContact O-N 3.34Å; L226-S229 PolarHBondContact O-N 2.97Å; L226-S229 PolarHBondContact O-OG 3.24Å; L227-S229 PolarHBondContact O-N 3.02Å; S229-V231 PolarHBondContact O-N 2.71Å; S229-S232 WeakPolarHBondContact O-CA 3.28Å; S229-S232 VanDerWaalsContact O-CB 3.3Å; S229-S232 WeakPolarHBondContact O-CB 3.4Å; S229-S232 PolarHBondContact O-N 3.28Å
230	L	98.4	Very high	97.3	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-27.3	-169.9	-65.6	-179.2	0	0	0	115	A191 V205 L226 L227 S232 D233 V238 C242	A191-L230 HydrophobicContact CB-CD1 4.34Å; V205-L230 HydrophobicContact CG2-CD1 3.61Å; L226-L230 HydrophobicContact CD1-CD1 3.77Å; L226-L230 HydrophobicContact CD1-CG 4.02Å; L226-L230 HydrophobicContact CD2-CD1 4.23Å; L226-L230 HydrophobicContact CG-CD1 3.69Å; L226-L230 HydrophobicContact CG-CG 4.26Å; L226-L230 VanDerWaalsContact O-CG 3.32Å; L226-L230 WeakPolarHBondContact O-CG 3.24Å; L226-L230 PolarHBondContact O-N 2.95Å; L226-L230 VanDerWaalsContact O-N 3.08Å; L227-L230 PolarHBondContact O-N 3.18Å; L230-S232 PolarHBondContact O-N 3.41Å; L230-S232 VanDerWaalsContact O-N 3.12Å; L230-D233 WeakPolarHBondContact O-CB 3.46Å; L230-D233 PolarHBondContact O-N 3.35Å; L230-V238 HydrophobicContact CB-CG1 4.49Å; L230-V238 HydrophobicContact CD2-CG1 4.04Å; L230-C242 VanDerWaalsContact CB-SG 3.51Å
231	V	98.1	Very high	97.5	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.024	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.4	172.3	-63.6	0	0	0	0	113	L227 S229 R239 C242 C266 K269 L270	L227-V231 WeakPolarHBondContact O-CG1 3.42Å; L227-V231 WeakPolarHBondContact O-CG2 3.44Å; L227-V231 PolarHBondContact O-N 3.34Å; S229-V231 PolarHBondContact O-N 2.71Å; V231-R239 WeakPolarHBondContact O-CD 3.34Å; V231-C242 HydrophobicContact CG1-CB 4.06Å; V231-C266 HydrophobicContact CG1-CB 3.98Å; V231-C266 HydrophobicContact CG2-CB 4.36Å; V231-K269 HydrophobicContact CG2-CD 4.22Å; V231-L270 HydrophobicContact CB-CD1 4.38Å; V231-L270 HydrophobicContact CB-CD2 4.21Å; V231-L270 HydrophobicContact CB-CG 4.2Å; V231-L270 HydrophobicContact CG1-CD1 3.69Å; V231-L270 HydrophobicContact CG1-CD2 4.32Å; V231-L270 HydrophobicContact CG1-CG 4.05Å
232	S	96.7	Very high	97.7	Very high	58 Å²	58	41.2 Å²	41.2	41%	0.406	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	3.7	176.8	-48.5	0	0	0	0	113.1	S229 L230 K269	S229-S232 WeakPolarHBondContact O-CA 3.28Å; S229-S232 VanDerWaalsContact O-CB 3.3Å; S229-S232 WeakPolarHBondContact O-CB 3.4Å; S229-S232 PolarHBondContact O-N 3.28Å; L230-S232 PolarHBondContact O-N 3.41Å; L230-S232 VanDerWaalsContact O-N 3.12Å; S232-K269 WeakPolarHBondContact OG-CE 3.36Å; S232-K269 PolarHBondContact OG-NZ 3.36Å
233	D	97.9	Very high	97.8	Very high	16 Å²	16	37.2 Å²	37.2	9%	0.086	21%	0.208	C	C	.	.			trans	-61.6	145.6	-171.8	-166.7	-86.5	0	0	0	112.6	R201 L230 Q235 V238 R239	R201-D233 IonicContact CZ-OD2 2.98Å; R201-D233 VanDerWaalsContact CZ-OD2 3.23Å; R201-D233 IonicContact NH1-OD1 2.66Å; R201-D233 PolarHBondContact NH1-OD1 3.09Å; R201-D233 IonicContact NH1-OD2 2.77Å; R201-D233 PolarHBondContact NH1-OD2 3.04Å; R201-D233 IonicContact NH2-OD2 2.67Å; R201-D233 PolarHBondContact NH2-OD2 3.24Å; L230-D233 WeakPolarHBondContact O-CB 3.46Å; L230-D233 PolarHBondContact O-N 3.35Å; D233-Q235 PolarHBondContact O-N 3.34Å; D233-Q235 WeakPolarHBondContact OD1-CA 3.37Å; D233-Q235 WeakPolarHBondContact OD1-CB 3.48Å; D233-Q235 PolarHBondContact OD1-N 2.89Å; D233-V238 HydrophobicContact CB-CB 4.27Å; D233-V238 HydrophobicContact CB-CG1 3.99Å; D233-R239 HydrophobicContact CB-CG 4.04Å; D233-R239 WeakPolarHBondContact O-CD 3.45Å; D233-R239 VanDerWaalsContact O-CG 3.28Å; D233-R239 WeakPolarHBondContact O-CG 3.46Å; D233-R239 PolarHBondContact O-NH1 3.22Å
234	N	96.3	Very high	97.8	Very high	136 Å²	136	39.7 Å²	39.7	73%	0.727	22%	0.224	S	C	*	.	S	Bend	trans	-63.6	-28.2	179.2	-67.8	-46.6	0	0	0	112.4	R239	N234-R239 PolarHBondContact O-NH1 2.91Å
235	Q	97.8	Very high	97.9	Very high	78 Å²	78	38.8 Å²	38.8	36%	0.364	22%	0.215	S	C	.	.			trans	-89.4	116	-175.9	-57	-65.5	-14.5	0	0	111.5	P198 D233 V237 V238 R239	P198-Q235 HydrophobicContact CB-CB 4.04Å; P198-Q235 HydrophobicContact CB-CG 3.91Å; P198-Q235 HydrophobicContact CG-CB 4.37Å; P198-Q235 HydrophobicContact CG-CG 3.7Å; D233-Q235 PolarHBondContact O-N 3.34Å; D233-Q235 WeakPolarHBondContact OD1-CA 3.37Å; D233-Q235 WeakPolarHBondContact OD1-CB 3.48Å; D233-Q235 PolarHBondContact OD1-N 2.89Å; Q235-V237 HydrophobicContact CB-CG2 4.49Å; Q235-V237 PolarHBondContact O-N 2.97Å; Q235-V237 VanDerWaalsContact O-N 3.12Å; Q235-V238 HydrophobicContact CB-CB 4.25Å; Q235-V238 HydrophobicContact CB-CG2 3.87Å; Q235-V238 PolarHBondContact O-N 3.36Å; Q235-R239 PolarHBondContact O-N 2.69Å; Q235-R239 VanDerWaalsContact O-N 3.15Å
236	R	97.8	Very high	98	Very high	127 Å²	127	32.3 Å²	32.3	48%	0.479	18%	0.181	S	C	.	.	H	α-helix	trans	-57.4	-31	-177.9	72.5	-173.7	-175.7	-84.7	-3.4	114.5	A240 S275 D277 V278	R236-A240 WeakPolarHBondContact O-CB 3.42Å; R236-A240 PolarHBondContact O-N 3.41Å; R236-S275 WeakPolarHBondContact CB-OG 3.44Å; R236-D277 WeakPolarHBondContact CD-OD2 3.06Å; R236-D277 IonicContact NE-OD2 3.34Å; R236-D277 PolarHBondContact NE-OD2 2.92Å; R236-V278 WeakPolarHBondContact O-CG2 3.48Å
237	V	98	Very high	98	Very high	34 Å²	34	32 Å²	32	21%	0.206	18%	0.179	C	C	.	.	H	α-helix	trans	-73.1	-34.4	179.4	-66	0	0	0	0	112	P198 A202 Q235 A240 A241	P198-V237 HydrophobicContact CB-CG2 3.75Å; A202-V237 HydrophobicContact CB-CB 4.43Å; A202-V237 HydrophobicContact CB-CG2 4.44Å; Q235-V237 HydrophobicContact CB-CG2 4.49Å; Q235-V237 PolarHBondContact O-N 2.97Å; Q235-V237 VanDerWaalsContact O-N 3.12Å; V237-A240 PolarHBondContact O-N 3.31Å; V237-A241 WeakPolarHBondContact O-CB 3.27Å; V237-A241 PolarHBondContact O-N 3Å
238	V	98.7	Very high	98	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69.7	-46.8	175.7	177.7	0	0	0	0	109.6	R201 V205 L230 D233 Q235 A240 A241 C242	R201-V238 HydrophobicContact CB-CG2 3.81Å; V205-V238 HydrophobicContact CG2-CG1 4.48Å; L230-V238 HydrophobicContact CB-CG1 4.49Å; L230-V238 HydrophobicContact CD2-CG1 4.04Å; D233-V238 HydrophobicContact CB-CB 4.27Å; D233-V238 HydrophobicContact CB-CG1 3.99Å; Q235-V238 HydrophobicContact CB-CB 4.25Å; Q235-V238 HydrophobicContact CB-CG2 3.87Å; Q235-V238 PolarHBondContact O-N 3.36Å; V238-A240 VanDerWaalsContact C-N 3.31Å; V238-A240 PolarHBondContact O-N 3.05Å; V238-A241 WeakPolarHBondContact O-CB 3.35Å; V238-A241 PolarHBondContact O-N 2.95Å; V238-A241 VanDerWaalsContact O-N 3.12Å; V238-C242 PolarHBondContact O-N 2.74Å; V238-C242 PolarHBondContact O-SG 2.8Å
239	R	98.6	Very high	98	Very high	35 Å²	35	30.8 Å²	30.8	13%	0.132	17%	0.165	C	C	.	.	H	α-helix	trans	-57.3	-42.8	174.1	-62	-160.3	-55.8	-81.6	3	112.5	V231 D233 N234 Q235 A241 C242 L270 D273 V278	V231-R239 WeakPolarHBondContact O-CD 3.34Å; D233-R239 HydrophobicContact CB-CG 4.04Å; D233-R239 WeakPolarHBondContact O-CD 3.45Å; D233-R239 VanDerWaalsContact O-CG 3.28Å; D233-R239 WeakPolarHBondContact O-CG 3.46Å; D233-R239 PolarHBondContact O-NH1 3.22Å; N234-R239 PolarHBondContact O-NH1 2.91Å; Q235-R239 PolarHBondContact O-N 2.69Å; Q235-R239 VanDerWaalsContact O-N 3.15Å; R239-A241 VanDerWaalsContact C-N 3.34Å; R239-A241 PolarHBondContact O-N 3.16Å; R239-C242 WeakPolarHBondContact O-CB 3.48Å; R239-C242 PolarHBondContact O-N 3.03Å; R239-L270 HydrophobicContact CB-CD2 4.14Å; R239-D273 IonicContact CZ-OD2 2.93Å; R239-D273 IonicContact NE-OD2 3.4Å; R239-D273 PolarHBondContact NE-OD2 3.24Å; R239-D273 IonicContact NH2-OD1 2.77Å; R239-D273 PolarHBondContact NH2-OD1 2.8Å; R239-D273 VanDerWaalsContact NH2-OD1 3.13Å; R239-D273 IonicContact NH2-OD2 2.99Å; R239-D273 PolarHBondContact NH2-OD2 3.43Å; R239-D273 VanDerWaalsContact NH2-OD2 3.12Å; R239-V278 HydrophobicContact CB-CG2 3.91Å
240	A	98.8	Very high	98.1	Very high	13 Å²	13	28.2 Å²	28.2	11%	0.107	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-40.2	177.1	0	0	0	0	0	112	R236 V237 V238 C242 L243 D277 V278 A281	R236-A240 WeakPolarHBondContact O-CB 3.42Å; R236-A240 PolarHBondContact O-N 3.41Å; V237-A240 PolarHBondContact O-N 3.31Å; V238-A240 VanDerWaalsContact C-N 3.31Å; V238-A240 PolarHBondContact O-N 3.05Å; A240-C242 PolarHBondContact O-N 3.03Å; A240-L243 PolarHBondContact O-N 3.35Å; A240-D277 HydrophobicContact CB-CB 4.38Å; A240-V278 HydrophobicContact CB-CG2 3.99Å; A240-A281 HydrophobicContact CB-CB 4.04Å
241	A	98.7	Very high	97.9	Very high	5 Å²	5	34.3 Å²	34.3	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-65.3	-20.7	178.2	0	0	0	0	0	113.6	A202 V205 Q206 V237 V238 R239 L243 P244 P245	A202-A241 HydrophobicContact CB-CB 3.98Å; V205-A241 HydrophobicContact CB-CB 3.96Å; V205-A241 HydrophobicContact CG1-CB 3.84Å; V205-A241 WeakPolarHBondContact CG1-O 3.47Å; Q206-A241 HydrophobicContact CG-CB 4.16Å; V237-A241 WeakPolarHBondContact O-CB 3.27Å; V237-A241 PolarHBondContact O-N 3Å; V238-A241 WeakPolarHBondContact O-CB 3.35Å; V238-A241 PolarHBondContact O-N 2.95Å; V238-A241 VanDerWaalsContact O-N 3.12Å; R239-A241 VanDerWaalsContact C-N 3.34Å; R239-A241 PolarHBondContact O-N 3.16Å; A241-L243 VanDerWaalsContact C-N 3.25Å; A241-L243 PolarHBondContact O-N 3.26Å; A241-P244 WeakPolarHBondContact O-CD 3.37Å; A241-P245 WeakPolarHBondContact O-CD 3.36Å
242	C	98.9	Very high	97.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-21.5	-179.9	-66	0	0	0	0	113.9	L227 L230 V231 V238 R239 A240 P245 L246 L270	L227-C242 HydrophobicContact CD2-CB 4.14Å; L230-C242 VanDerWaalsContact CB-SG 3.51Å; V231-C242 HydrophobicContact CG1-CB 4.06Å; V238-C242 PolarHBondContact O-N 2.74Å; V238-C242 PolarHBondContact O-SG 2.8Å; R239-C242 WeakPolarHBondContact O-CB 3.48Å; R239-C242 PolarHBondContact O-N 3.03Å; A240-C242 PolarHBondContact O-N 3.03Å; C242-P245 WeakPolarHBondContact O-CD 3.35Å; C242-L246 WeakPolarHBondContact O-CB 3.34Å; C242-L246 PolarHBondContact O-N 3.5Å; C242-L270 HydrophobicContact CB-CD1 4.36Å
243	L	98.8	Very high	97.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.6	-49	-171.7	-82.7	171.8	0	0	0	114.6	A240 A241 L246 V247 L270 A281 M282 V285 L289	A240-L243 PolarHBondContact O-N 3.35Å; A241-L243 VanDerWaalsContact C-N 3.25Å; A241-L243 PolarHBondContact O-N 3.26Å; L243-L246 WeakPolarHBondContact O-CB 3.22Å; L243-L246 PolarHBondContact O-N 3.27Å; L243-V247 WeakPolarHBondContact O-CG2 3.38Å; L243-V247 PolarHBondContact O-N 3.48Å; L243-L270 HydrophobicContact CD2-CB 4.19Å; L243-L270 HydrophobicContact CD2-CD1 3.6Å; L243-L270 HydrophobicContact CG-CD1 3.89Å; L243-A281 HydrophobicContact CD1-CB 3.63Å; L243-M282 HydrophobicContact CD1-CB 3.93Å; L243-M282 HydrophobicContact CD1-CE 4.5Å; L243-M282 HydrophobicContact CD2-CE 3.74Å; L243-M282 HydrophobicContact CD2-SD 4.26Å; L243-V285 HydrophobicContact CB-CG2 3.87Å; L243-V285 HydrophobicContact CD1-CG2 4.18Å; L243-V285 HydrophobicContact CD2-CG2 3.98Å; L243-V285 HydrophobicContact CG-CG2 4.24Å; L243-L289 HydrophobicContact CD2-CD1 4.18Å
244	P	98.8	Very high	97.4	Very high	52 Å²	52	38.4 Å²	38.4	34%	0.338	19%	0.191	S	C	.	.	H	α-helix	trans	-61.4	-45.3	176.1	-20.9	31.6	0	0	0	114	V209 A241 L246 V247 E248 V285	V209-P244 VanDerWaalsContact CG2-C 3.45Å; V209-P244 HydrophobicContact CG2-CB 3.85Å; A241-P244 WeakPolarHBondContact O-CD 3.37Å; P244-L246 VanDerWaalsContact C-N 3.29Å; P244-L246 PolarHBondContact O-N 3.32Å; P244-V247 WeakPolarHBondContact O-CB 3.35Å; P244-V247 PolarHBondContact O-N 3.08Å; P244-E248 PolarHBondContact O-N 3.26Å; P244-V285 HydrophobicContact CG-CG1 4.44Å
245	P	98.6	Very high	97.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-35.6	171.7	-25.2	34.4	0	0	0	113.7	V205 L208 V209 L223 L227 A241 C242 V247 E248 L249	V205-P245 HydrophobicContact CG1-CG 4.02Å; V205-P245 WeakPolarHBondContact O-CG 3.28Å; L208-P245 HydrophobicContact CB-CB 4.13Å; L208-P245 HydrophobicContact CB-CG 4.08Å; V209-P245 HydrophobicContact CG2-CB 4.35Å; V209-P245 HydrophobicContact CG2-CG 3.96Å; L223-P245 HydrophobicContact CD1-CB 4.42Å; L227-P245 HydrophobicContact CD1-CB 3.99Å; L227-P245 HydrophobicContact CD2-CB 3.99Å; A241-P245 WeakPolarHBondContact O-CD 3.36Å; C242-P245 WeakPolarHBondContact O-CD 3.35Å; P245-V247 VanDerWaalsContact C-N 3.35Å; P245-V247 PolarHBondContact O-N 3.27Å; P245-E248 PolarHBondContact O-N 3.13Å; P245-E248 VanDerWaalsContact O-N 3.17Å; P245-L249 PolarHBondContact O-N 3.43Å
246	L	98.5	Very high	97	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-38.2	176.9	-175.4	63.3	0	0	0	112.2	L227 C242 L243 P244 E248 L249 G250 V263 C266 I267 L270	L227-L246 HydrophobicContact CD1-CB 4.35Å; L227-L246 HydrophobicContact CD1-CD1 4.42Å; C242-L246 WeakPolarHBondContact O-CB 3.34Å; C242-L246 PolarHBondContact O-N 3.5Å; L243-L246 WeakPolarHBondContact O-CB 3.22Å; L243-L246 PolarHBondContact O-N 3.27Å; P244-L246 VanDerWaalsContact C-N 3.29Å; P244-L246 PolarHBondContact O-N 3.32Å; L246-E248 VanDerWaalsContact C-N 3.33Å; L246-L249 HydrophobicContact CD1-CD2 4.49Å; L246-G250 PolarHBondContact O-N 2.95Å; L246-V263 HydrophobicContact CD1-CB 4.44Å; L246-V263 HydrophobicContact CD1-CG1 3.94Å; L246-V263 HydrophobicContact CD1-CG2 4.34Å; L246-V263 HydrophobicContact CG-CG1 4.32Å; L246-C266 HydrophobicContact CD1-CB 3.71Å; L246-C266 HydrophobicContact CD2-CB 3.8Å; L246-C266 HydrophobicContact CG-CB 4.43Å; L246-I267 HydrophobicContact CD2-CG1 3.8Å; L246-I267 HydrophobicContact CG-CG1 4.41Å; L246-L270 HydrophobicContact CD2-CD1 3.94Å
247	V	98.2	Very high	96.8	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.036	18%	0.179	C	C	.	.	H	α-helix	trans	-60.7	-44.9	171.2	172.4	0	0	0	0	110.6	L243 P244 P245 G250 R251 V285 N288 L289 L292	L243-V247 WeakPolarHBondContact O-CG2 3.38Å; L243-V247 PolarHBondContact O-N 3.48Å; P244-V247 WeakPolarHBondContact O-CB 3.35Å; P244-V247 PolarHBondContact O-N 3.08Å; P245-V247 VanDerWaalsContact C-N 3.35Å; P245-V247 PolarHBondContact O-N 3.27Å; V247-G250 PolarHBondContact O-N 2.96Å; V247-R251 WeakPolarHBondContact O-CG 3.46Å; V247-R251 PolarHBondContact O-N 2.95Å; V247-R251 VanDerWaalsContact O-N 3.13Å; V247-V285 HydrophobicContact CG2-CB 3.96Å; V247-V285 HydrophobicContact CG2-CG1 4.4Å; V247-V285 HydrophobicContact CG2-CG2 4.35Å; V247-N288 HydrophobicContact CG1-CB 3.69Å; V247-N288 HydrophobicContact CG2-CB 4.1Å; V247-L289 HydrophobicContact CG2-CD2 3.59Å; V247-L289 HydrophobicContact CG2-CG 4.07Å; V247-L292 HydrophobicContact CG1-CD1 4.17Å; V247-L292 WeakPolarHBondContact O-CD1 3.41Å
248	E	97.9	Very high	96.6	Very high	22 Å²	22	32.1 Å²	32.1	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-41.6	-179	-165	62.6	-164.6	0	0	111.8	V209 A212 P244 P245 L246 G250 R251 M252	V209-E248 HydrophobicContact CG1-CG 4.5Å; A212-E248 HydrophobicContact CB-CG 3.86Å; P244-E248 PolarHBondContact O-N 3.26Å; P245-E248 PolarHBondContact O-N 3.13Å; P245-E248 VanDerWaalsContact O-N 3.17Å; L246-E248 VanDerWaalsContact C-N 3.33Å; E248-G250 VanDerWaalsContact C-N 3.31Å; E248-G250 PolarHBondContact O-N 3.09Å; E248-R251 WeakPolarHBondContact O-CB 3.42Å; E248-R251 PolarHBondContact O-N 2.79Å; E248-R251 VanDerWaalsContact O-N 3.11Å; E248-R251 IonicContact OE2-CZ 3.74Å; E248-R251 IonicContact OE2-NH1 2.82Å; E248-R251 PolarHBondContact OE2-NH1 3.23Å; E248-M252 HydrophobicContact CG-CE 4.33Å; E248-M252 WeakPolarHBondContact O-CG 3.45Å; E248-M252 PolarHBondContact O-N 3.38Å
249	L	97.7	Very high	96.4	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-57.4	-45	172	178	63.3	0	0	0	111.5	K220 L223 L227 P245 L246 R251 M252 I253 V263	K220-L249 HydrophobicContact CB-CD1 4.48Å; K220-L249 HydrophobicContact CG-CD1 3.8Å; K220-L249 WeakPolarHBondContact O-CD1 3.4Å; L223-L249 HydrophobicContact CB-CD1 4.45Å; L223-L249 HydrophobicContact CD2-CB 3.97Å; L223-L249 HydrophobicContact CD2-CD1 4.31Å; L223-L249 HydrophobicContact CG-CB 4.39Å; L223-L249 HydrophobicContact CG-CD1 4.39Å; L227-L249 HydrophobicContact CD1-CB 4.31Å; L227-L249 HydrophobicContact CD1-CD2 4.01Å; P245-L249 PolarHBondContact O-N 3.43Å; L246-L249 HydrophobicContact CD1-CD2 4.49Å; L249-R251 PolarHBondContact O-N 3.4Å; L249-M252 WeakPolarHBondContact O-CB 3.18Å; L249-M252 PolarHBondContact O-N 3.17Å; L249-I253 HydrophobicContact CD1-CD1 4.43Å; L249-I253 HydrophobicContact CG-CD1 4.22Å; L249-I253 PolarHBondContact O-N 3.49Å; L249-V263 HydrophobicContact CD2-CG2 3.92Å; L249-V263 HydrophobicContact CG-CG2 3.94Å
250	G	96.3	Very high	96.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-27.5	177.5	0	0	0	0	0	113.9	L246 V247 E248	L246-G250 PolarHBondContact O-N 2.95Å; V247-G250 PolarHBondContact O-N 2.96Å; E248-G250 VanDerWaalsContact C-N 3.31Å; E248-G250 PolarHBondContact O-N 3.09Å
251	R	95.9	Very high	95.9	Very high	131 Å²	131	37 Å²	37	49%	0.494	21%	0.214	S	C	.	.	H	α-helix	trans	-74.4	-26.5	173.3	-69.7	173.6	179.4	161.4	-2.4	113.2	V247 E248 L249 L292	V247-R251 WeakPolarHBondContact O-CG 3.46Å; V247-R251 PolarHBondContact O-N 2.95Å; V247-R251 VanDerWaalsContact O-N 3.13Å; E248-R251 WeakPolarHBondContact O-CB 3.42Å; E248-R251 PolarHBondContact O-N 2.79Å; E248-R251 VanDerWaalsContact O-N 3.11Å; E248-R251 IonicContact OE2-CZ 3.74Å; E248-R251 IonicContact OE2-NH1 2.82Å; E248-R251 PolarHBondContact OE2-NH1 3.23Å; L249-R251 PolarHBondContact O-N 3.4Å; R251-L292 HydrophobicContact CG-CD2 3.91Å
252	M	95.7	Very high	95.6	Very high	27 Å²	27	39.3 Å²	39.3	13%	0.133	23%	0.229	C	C	.	.	H	α-helix	trans	-79.9	-21.7	179.1	-65.2	177.5	169.4	0	0	112.8	A212 G216 K220 E248 L249	A212-M252 HydrophobicContact CB-CE 3.57Å; A212-M252 VanDerWaalsContact O-CE 3.27Å; A212-M252 WeakPolarHBondContact O-CE 3.35Å; G216-M252 WeakPolarHBondContact O-CE 3.19Å; K220-M252 HydrophobicContact CD-CB 4.49Å; K220-M252 HydrophobicContact CG-CB 4.46Å; E248-M252 HydrophobicContact CG-CE 4.33Å; E248-M252 WeakPolarHBondContact O-CG 3.45Å; E248-M252 PolarHBondContact O-N 3.38Å; L249-M252 WeakPolarHBondContact O-CB 3.18Å; L249-M252 PolarHBondContact O-N 3.17Å
253	I	94.5	Very high	95.5	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.026	23%	0.229	C	C	.	.			trans	-85.1	131.2	178.1	-66	160.2	0	0	0	109.2	K220 L249 D255 E258 F259 T262 V263 H296	K220-I253 HydrophobicContact CD-CG1 3.78Å; K220-I253 HydrophobicContact CG-CG1 4.31Å; L249-I253 HydrophobicContact CD1-CD1 4.43Å; L249-I253 HydrophobicContact CG-CD1 4.22Å; L249-I253 PolarHBondContact O-N 3.49Å; I253-D255 VanDerWaalsContact CG2-O 3.27Å; I253-D255 WeakPolarHBondContact CG2-O 3.5Å; I253-E258 HydrophobicContact CG1-CG 4.41Å; I253-E258 HydrophobicContact CG2-CB 3.99Å; I253-E258 HydrophobicContact CG2-CG 4.07Å; I253-F259 HydrophobicContact CG2-CB 3.81Å; I253-T262 WeakPolarHBondContact CD1-OG1 3.48Å; I253-V263 HydrophobicContact CD1-CG2 3.4Å; I253-V263 VanDerWaalsContact CD1-CG2 3.4Å; I253-H296 PolarHBondContact O-NE2 3.35Å
254	T	91.7	Very high	95.3	Very high	132 Å²	132	41 Å²	41	81%	0.81	24%	0.235	S	C	*	.			trans	-111.6	-23.6	177.2	56.7	0	0	0	0	112.7
255	D	93.2	Very high	95.1	Very high	84 Å²	84	41.8 Å²	41.8	45%	0.449	24%	0.24	S	C	.	.			trans	-88.8	128.8	179.9	-179.5	72.8	0	0	0	110.9	I253 A257 E258 F259	I253-D255 VanDerWaalsContact CG2-O 3.27Å; I253-D255 WeakPolarHBondContact CG2-O 3.5Å; D255-A257 PolarHBondContact O-N 2.85Å; D255-A257 WeakPolarHBondContact OD2-CA 3.47Å; D255-A257 WeakPolarHBondContact OD2-CB 3.45Å; D255-A257 PolarHBondContact OD2-N 3.3Å; D255-E258 HydrophobicContact CB-CB 4.02Å; D255-E258 PolarHBondContact O-N 2.85Å; D255-E258 PolarHBondContact OD2-N 3.12Å; D255-F259 PolarHBondContact O-N 3.49Å
256	A	92.7	Very high	95	Very high	39 Å²	39	42.2 Å²	42.2	32%	0.322	24%	0.243	S	C	.	.	H	α-helix	trans	-67.1	-35.1	-176.5	0	0	0	0	0	113	F259 D260 H296	A256-F259 PolarHBondContact O-N 2.72Å; A256-D260 WeakPolarHBondContact O-CB 3.46Å; A256-D260 PolarHBondContact O-N 2.85Å; A256-H296 HydrophobicContact CB-CB 4.41Å
257	A	93.2	Very high	94.9	Very high	66 Å²	66	42.3 Å²	42.3	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-72	-37.4	178.8	0	0	0	0	0	111.4	D255 S261	D255-A257 PolarHBondContact O-N 2.85Å; D255-A257 WeakPolarHBondContact OD2-CA 3.47Å; D255-A257 WeakPolarHBondContact OD2-CB 3.45Å; D255-A257 PolarHBondContact OD2-N 3.3Å; A257-S261 WeakPolarHBondContact O-CB 3.27Å; A257-S261 PolarHBondContact O-N 2.68Å; A257-S261 PolarHBondContact O-OG 3.22Å
258	E	94	Very high	94.8	Very high	54 Å²	54	45.3 Å²	45.3	25%	0.252	26%	0.259	S	S	.	.	H	α-helix	trans	-61.1	-46.3	169.4	-173.2	179.3	-168.7	0	0	110.9	K220 I253 D255 D260 S261 T262	K220-E258 WeakPolarHBondContact CE-OE1 3.14Å; K220-E258 IonicContact NZ-OE1 3Å; K220-E258 PolarHBondContact NZ-OE1 2.8Å; K220-E258 IonicContact NZ-OE2 3.98Å; K220-E258 PolarHBondContact NZ-OE2 3.48Å; I253-E258 HydrophobicContact CG1-CG 4.41Å; I253-E258 HydrophobicContact CG2-CB 3.99Å; I253-E258 HydrophobicContact CG2-CG 4.07Å; D255-E258 HydrophobicContact CB-CB 4.02Å; D255-E258 PolarHBondContact O-N 2.85Å; D255-E258 PolarHBondContact OD2-N 3.12Å; E258-D260 PolarHBondContact O-N 3.45Å; E258-S261 PolarHBondContact O-N 3.24Å; E258-S261 PolarHBondContact O-OG 3.36Å; E258-S261 VanDerWaalsContact O-OG 3.09Å; E258-T262 HydrophobicContact CG-CG2 4.25Å; E258-T262 WeakPolarHBondContact O-CB 3.21Å; E258-T262 WeakPolarHBondContact O-CG2 3.38Å; E258-T262 PolarHBondContact O-N 3.02Å; E258-T262 PolarHBondContact O-OG1 3.21Å
259	F	94.8	Very high	94.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-45.8	178.6	-176.8	-87	0	0	0	112.1	I253 D255 A256 S261 V263 R264 I267 L292 V293 H296	I253-F259 HydrophobicContact CG2-CB 3.81Å; D255-F259 PolarHBondContact O-N 3.49Å; A256-F259 PolarHBondContact O-N 2.72Å; F259-S261 VanDerWaalsContact C-N 3.31Å; F259-S261 PolarHBondContact O-N 3.43Å; F259-V263 HydrophobicContact CD2-CB 4.03Å; F259-V263 HydrophobicContact CD2-CG1 4.19Å; F259-V263 HydrophobicContact CD2-CG2 4.43Å; F259-V263 HydrophobicContact CE1-CG1 4.47Å; F259-V263 HydrophobicContact CE2-CB 3.94Å; F259-V263 HydrophobicContact CE2-CG1 3.59Å; F259-V263 HydrophobicContact CG-CB 4.45Å; F259-V263 HydrophobicContact CZ-CB 4.29Å; F259-V263 HydrophobicContact CZ-CG1 3.75Å; F259-V263 PolarHBondContact O-N 3.47Å; F259-R264 PolarHBondContact O-N 2.64Å; F259-I267 HydrophobicContact CZ-CD1 4.14Å; F259-L292 HydrophobicContact CE2-CB 4.12Å; F259-L292 HydrophobicContact CZ-CB 4.15Å; F259-V293 HydrophobicContact CE1-CG2 4.1Å; F259-V293 HydrophobicContact CZ-CG2 4.16Å; F259-H296 HydrophobicContact CB-CB 4.39Å; F259-H296 HydrophobicContact CD1-CB 4.04Å; F259-H296 AromaticContact CD2-CD2 3.99Å; F259-H296 AromaticContact CD2-CE1 3.48Å; F259-H296 VanDerWaalsContact CD2-CE1 3.48Å; F259-H296 WeakPolarHBondContact CD2-CE1 3.48Å; F259-H296 AromaticContact CD2-CG 3.87Å; F259-H296 AromaticContact CD2-ND1 3.56Å; F259-H296 AromaticContact CD2-NE2 3.75Å; F259-H296 AromaticContact CE2-CE1 3.92Å; F259-H296 AromaticContact CE2-ND1 3.81Å; F259-H296 HydrophobicContact CG-CB 4.14Å; F259-H296 AromaticContact CG-CD2 3.78Å; F259-H296 AromaticContact CG-CG 3.65Å; F259-H296 AromaticContact CG-ND1 3.83Å
260	D	93.2	Very high	94.7	Very high	67 Å²	67	49.1 Å²	49.1	36%	0.358	28%	0.275	S	S	.	.	H	α-helix	trans	-69.9	-26.6	-178.6	-77	-18	0	0	0	113.2	A256 E258 R264 P265	A256-D260 WeakPolarHBondContact O-CB 3.46Å; A256-D260 PolarHBondContact O-N 2.85Å; E258-D260 PolarHBondContact O-N 3.45Å; D260-R264 IonicContact OD1-CZ 3.3Å; D260-R264 VanDerWaalsContact OD1-CZ 3.24Å; D260-R264 IonicContact OD1-NE 2.87Å; D260-R264 PolarHBondContact OD1-NE 2.95Å; D260-R264 IonicContact OD1-NH2 3.13Å; D260-R264 PolarHBondContact OD1-NH2 3.4Å; D260-P265 WeakPolarHBondContact O-CD 3.47Å
261	S	92.6	Very high	94.7	Very high	82 Å²	82	50.3 Å²	50.3	57%	0.573	29%	0.285	S	S	*	.	H	α-helix	trans	-88.9	-25.7	177.6	55.4	0	0	0	0	113.9	A257 E258 F259	A257-S261 WeakPolarHBondContact O-CB 3.27Å; A257-S261 PolarHBondContact O-N 2.68Å; A257-S261 PolarHBondContact O-OG 3.22Å; E258-S261 PolarHBondContact O-N 3.24Å; E258-S261 PolarHBondContact O-OG 3.36Å; E258-S261 VanDerWaalsContact O-OG 3.09Å; F259-S261 VanDerWaalsContact C-N 3.31Å; F259-S261 PolarHBondContact O-N 3.43Å
262	T	93.3	Very high	94.7	Very high	55 Å²	55	47.1 Å²	47.1	34%	0.337	29%	0.293	S	S	.	.	H	α-helix	trans	-108.2	-51.4	-173.6	60.5	0	0	0	0	113.4	I253 E258 C266	I253-T262 WeakPolarHBondContact CD1-OG1 3.48Å; E258-T262 HydrophobicContact CG-CG2 4.25Å; E258-T262 WeakPolarHBondContact O-CB 3.21Å; E258-T262 WeakPolarHBondContact O-CG2 3.38Å; E258-T262 PolarHBondContact O-N 3.02Å; E258-T262 PolarHBondContact O-OG1 3.21Å; T262-C266 PolarHBondContact O-SG 3.34Å; T262-C266 VanDerWaalsContact O-SG 3.38Å
263	V	95.7	Very high	94.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-42.3	-171	171	0	0	0	0	111.9	L246 L249 I253 F259 C266 I267	L246-V263 HydrophobicContact CD1-CB 4.44Å; L246-V263 HydrophobicContact CD1-CG1 3.94Å; L246-V263 HydrophobicContact CD1-CG2 4.34Å; L246-V263 HydrophobicContact CG-CG1 4.32Å; L249-V263 HydrophobicContact CD2-CG2 3.92Å; L249-V263 HydrophobicContact CG-CG2 3.94Å; I253-V263 HydrophobicContact CD1-CG2 3.4Å; I253-V263 VanDerWaalsContact CD1-CG2 3.4Å; F259-V263 HydrophobicContact CD2-CB 4.03Å; F259-V263 HydrophobicContact CD2-CG1 4.19Å; F259-V263 HydrophobicContact CD2-CG2 4.43Å; F259-V263 HydrophobicContact CE1-CG1 4.47Å; F259-V263 HydrophobicContact CE2-CB 3.94Å; F259-V263 HydrophobicContact CE2-CG1 3.59Å; F259-V263 HydrophobicContact CG-CB 4.45Å; F259-V263 HydrophobicContact CZ-CB 4.29Å; F259-V263 HydrophobicContact CZ-CG1 3.75Å; F259-V263 PolarHBondContact O-N 3.47Å; V263-C266 WeakPolarHBondContact O-CB 3.48Å; V263-C266 PolarHBondContact O-N 3.22Å; V263-C266 VanDerWaalsContact O-N 3.13Å; V263-I267 HydrophobicContact CG1-CD1 3.67Å; V263-I267 HydrophobicContact CG1-CG1 4.07Å; V263-I267 WeakPolarHBondContact O-CG1 3.29Å; V263-I267 PolarHBondContact O-N 2.86Å
264	R	94.7	Very high	94.8	Very high	36 Å²	36	51.7 Å²	51.7	14%	0.136	32%	0.324	C	S	.	.	H	α-helix	trans	-56.3	-46.5	-178	179.1	176.2	-57.4	-71.3	-9.5	113.6	F259 D260 C266 I267 D268 A299	F259-R264 PolarHBondContact O-N 2.64Å; D260-R264 IonicContact OD1-CZ 3.3Å; D260-R264 VanDerWaalsContact OD1-CZ 3.24Å; D260-R264 IonicContact OD1-NE 2.87Å; D260-R264 PolarHBondContact OD1-NE 2.95Å; D260-R264 IonicContact OD1-NH2 3.13Å; D260-R264 PolarHBondContact OD1-NH2 3.4Å; R264-C266 PolarHBondContact O-N 2.77Å; R264-I267 PolarHBondContact O-N 2.85Å; R264-I267 VanDerWaalsContact O-N 3.12Å; R264-D268 WeakPolarHBondContact CG-OD2 3.37Å; R264-D268 PolarHBondContact O-N 2.94Å; R264-A299 PolarHBondContact NH1-O 2.89Å
265	P	94.3	Very high	95.1	Very high	68 Å²	68	46.1 Å²	46.1	44%	0.442	29%	0.291	S	S	.	.	H	α-helix	trans	-61	-35.1	179.2	-23.4	35.6	0	0	0	112.5	D260 K269	D260-P265 WeakPolarHBondContact O-CD 3.47Å; P265-K269 VanDerWaalsContact O-CB 3.27Å; P265-K269 WeakPolarHBondContact O-CB 3.44Å; P265-K269 PolarHBondContact O-N 3.12Å
266	C	97.4	Very high	95.3	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.061	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-43.8	175.6	-62.8	0	0	0	0	111.6	V231 L246 T262 V263 R264 L270	V231-C266 HydrophobicContact CG1-CB 3.98Å; V231-C266 HydrophobicContact CG2-CB 4.36Å; L246-C266 HydrophobicContact CD1-CB 3.71Å; L246-C266 HydrophobicContact CD2-CB 3.8Å; L246-C266 HydrophobicContact CG-CB 4.43Å; T262-C266 PolarHBondContact O-SG 3.34Å; T262-C266 VanDerWaalsContact O-SG 3.38Å; V263-C266 WeakPolarHBondContact O-CB 3.48Å; V263-C266 PolarHBondContact O-N 3.22Å; V263-C266 VanDerWaalsContact O-N 3.13Å; R264-C266 PolarHBondContact O-N 2.77Å; C266-L270 WeakPolarHBondContact O-CG 3.42Å; C266-L270 PolarHBondContact O-N 3.18Å; C266-L270 VanDerWaalsContact O-N 3.08Å
267	I	96.6	Very high	95.6	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-52.4	175.7	-66.9	173.7	0	0	0	110.4	L246 F259 V263 R264 K269 L270 A271 L289 V293 L303	L246-I267 HydrophobicContact CD2-CG1 3.8Å; L246-I267 HydrophobicContact CG-CG1 4.41Å; F259-I267 HydrophobicContact CZ-CD1 4.14Å; V263-I267 HydrophobicContact CG1-CD1 3.67Å; V263-I267 HydrophobicContact CG1-CG1 4.07Å; V263-I267 WeakPolarHBondContact O-CG1 3.29Å; V263-I267 PolarHBondContact O-N 2.86Å; R264-I267 PolarHBondContact O-N 2.85Å; R264-I267 VanDerWaalsContact O-N 3.12Å; I267-K269 VanDerWaalsContact C-N 3.28Å; I267-K269 PolarHBondContact O-N 3.14Å; I267-L270 PolarHBondContact O-N 3.04Å; I267-A271 VanDerWaalsContact O-CB 3.29Å; I267-A271 WeakPolarHBondContact O-CB 3.43Å; I267-A271 PolarHBondContact O-N 3.44Å; I267-L289 HydrophobicContact CD1-CD2 3.87Å; I267-L289 HydrophobicContact CG1-CD1 4.48Å; I267-L289 HydrophobicContact CG1-CD2 4.06Å; I267-L289 HydrophobicContact CG2-CD1 4.36Å; I267-V293 HydrophobicContact CD1-CG2 4.33Å; I267-L303 HydrophobicContact CG2-CD2 3.8Å
268	D	95	Very high	95.8	Very high	69 Å²	69	45.4 Å²	45.4	37%	0.369	26%	0.261	S	S	.	.	H	α-helix	trans	-62.9	-37.9	-176	-70.3	-30.1	0	0	0	111.2	R264 A271 G272 S302	R264-D268 WeakPolarHBondContact CG-OD2 3.37Å; R264-D268 PolarHBondContact O-N 2.94Å; D268-A271 PolarHBondContact O-N 3.02Å; D268-G272 PolarHBondContact O-N 3.29Å; D268-S302 PolarHBondContact OD1-OG 2.85Å
269	K	96.1	Very high	96	Very high	104 Å²	104	45.6 Å²	45.6	45%	0.452	26%	0.259	S	S	.	.	H	α-helix	trans	-62.5	-49	175.1	-176.6	163.4	-174.7	160.6	0	112.5	V231 S232 P265 I267 A271 G272	V231-K269 HydrophobicContact CG2-CD 4.22Å; S232-K269 WeakPolarHBondContact OG-CE 3.36Å; S232-K269 PolarHBondContact OG-NZ 3.36Å; P265-K269 VanDerWaalsContact O-CB 3.27Å; P265-K269 WeakPolarHBondContact O-CB 3.44Å; P265-K269 PolarHBondContact O-N 3.12Å; I267-K269 VanDerWaalsContact C-N 3.28Å; I267-K269 PolarHBondContact O-N 3.14Å; K269-A271 VanDerWaalsContact C-N 3.33Å; K269-G272 PolarHBondContact O-N 2.65Å
270	L	98.2	Very high	96.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-70.4	-30.3	180	-67.1	170.6	0	0	0	112.3	V231 R239 C242 L243 L246 C266 I267 G272 D273 V278 M282	V231-L270 HydrophobicContact CB-CD1 4.38Å; V231-L270 HydrophobicContact CB-CD2 4.21Å; V231-L270 HydrophobicContact CB-CG 4.2Å; V231-L270 HydrophobicContact CG1-CD1 3.69Å; V231-L270 HydrophobicContact CG1-CD2 4.32Å; V231-L270 HydrophobicContact CG1-CG 4.05Å; R239-L270 HydrophobicContact CB-CD2 4.14Å; C242-L270 HydrophobicContact CB-CD1 4.36Å; L243-L270 HydrophobicContact CD2-CB 4.19Å; L243-L270 HydrophobicContact CD2-CD1 3.6Å; L243-L270 HydrophobicContact CG-CD1 3.89Å; L246-L270 HydrophobicContact CD2-CD1 3.94Å; C266-L270 WeakPolarHBondContact O-CG 3.42Å; C266-L270 PolarHBondContact O-N 3.18Å; C266-L270 VanDerWaalsContact O-N 3.08Å; I267-L270 PolarHBondContact O-N 3.04Å; L270-G272 VanDerWaalsContact C-N 3.26Å; L270-G272 PolarHBondContact O-N 3.07Å; L270-D273 WeakPolarHBondContact O-CB 3.5Å; L270-D273 PolarHBondContact O-N 3.43Å; L270-V278 HydrophobicContact CB-CG1 4.34Å; L270-V278 HydrophobicContact CD2-CG1 4.03Å; L270-M282 HydrophobicContact CB-CE 3.99Å
271	A	96.3	Very high	96.5	Very high	25 Å²	25	46 Å²	46	21%	0.207	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-30.5	174.6	0	0	0	0	0	112.7	I267 D268 K269 D273 M282 T306	I267-A271 VanDerWaalsContact O-CB 3.29Å; I267-A271 WeakPolarHBondContact O-CB 3.43Å; I267-A271 PolarHBondContact O-N 3.44Å; D268-A271 PolarHBondContact O-N 3.02Å; K269-A271 VanDerWaalsContact C-N 3.33Å; A271-D273 VanDerWaalsContact C-N 3.35Å; A271-M282 HydrophobicContact CB-CE 3.93Å; A271-T306 HydrophobicContact CB-CG2 4.07Å
272	G	94.7	Very high	96.8	Very high	65 Å²	65	42.2 Å²	42.2	67%	0.67	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	6	175.4	0	0	0	0	0	115	D268 K269 L270	D268-G272 PolarHBondContact O-N 3.29Å; K269-G272 PolarHBondContact O-N 2.65Å; L270-G272 VanDerWaalsContact C-N 3.26Å; L270-G272 PolarHBondContact O-N 3.07Å
273	D	97.7	Very high	97	Very high	15 Å²	15	39.6 Å²	39.6	8%	0.08	22%	0.217	C	C	.	.			trans	-73.4	132.6	-171.8	-161.1	-71.9	0	0	0	113	R239 L270 A271 S275 V278 R279	R239-D273 IonicContact CZ-OD2 2.93Å; R239-D273 IonicContact NE-OD2 3.4Å; R239-D273 PolarHBondContact NE-OD2 3.24Å; R239-D273 IonicContact NH2-OD1 2.77Å; R239-D273 PolarHBondContact NH2-OD1 2.8Å; R239-D273 VanDerWaalsContact NH2-OD1 3.13Å; R239-D273 IonicContact NH2-OD2 2.99Å; R239-D273 PolarHBondContact NH2-OD2 3.43Å; R239-D273 VanDerWaalsContact NH2-OD2 3.12Å; L270-D273 WeakPolarHBondContact O-CB 3.5Å; L270-D273 PolarHBondContact O-N 3.43Å; A271-D273 VanDerWaalsContact C-N 3.35Å; D273-S275 VanDerWaalsContact C-N 3.31Å; D273-S275 PolarHBondContact O-N 2.64Å; D273-S275 WeakPolarHBondContact OD1-CA 3.42Å; D273-S275 WeakPolarHBondContact OD1-CB 3.37Å; D273-S275 PolarHBondContact OD1-N 3.18Å; D273-V278 HydrophobicContact CB-CB 3.77Å; D273-V278 HydrophobicContact CB-CG1 3.46Å; D273-V278 VanDerWaalsContact CB-CG1 3.46Å; D273-V278 HydrophobicContact CB-CG2 4.27Å; D273-R279 WeakPolarHBondContact O-CG 3.47Å
274	P	96.2	Very high	97.2	Very high	113 Å²	113	42.2 Å²	42.2	73%	0.734	24%	0.235	S	C	*	.			trans	-79	-9.5	-179.4	32.9	-37.6	0	0	0	113.9	R279	P274-R279 PolarHBondContact O-NH1 2.94Å
275	S	97.9	Very high	97.3	Very high	14 Å²	14	41 Å²	41	10%	0.098	23%	0.232	C	C	.	.			trans	-74	131.3	179.1	177.5	0	0	0	0	111.5	R236 D273 D277 V278 R279	R236-S275 WeakPolarHBondContact CB-OG 3.44Å; D273-S275 VanDerWaalsContact C-N 3.31Å; D273-S275 PolarHBondContact O-N 2.64Å; D273-S275 WeakPolarHBondContact OD1-CA 3.42Å; D273-S275 WeakPolarHBondContact OD1-CB 3.37Å; D273-S275 PolarHBondContact OD1-N 3.18Å; S275-D277 PolarHBondContact O-N 3.27Å; S275-D277 PolarHBondContact OG-N 2.98Å; S275-D277 VanDerWaalsContact OG-N 3.16Å; S275-V278 PolarHBondContact O-N 3.05Å; S275-R279 WeakPolarHBondContact O-CG 3.47Å; S275-R279 PolarHBondContact O-N 3.31Å
276	R	97.2	Very high	97.5	Very high	149 Å²	149	37.8 Å²	37.8	56%	0.562	21%	0.211	S	C	*	.	H	α-helix	trans	-54.9	-36.5	171.1	77.8	175.8	-175.3	178.4	-3.4	112.2	R279 R280 E315	R276-R279 PolarHBondContact O-N 3.41Å; R276-R280 WeakPolarHBondContact O-CB 3.47Å; R276-R280 PolarHBondContact O-N 2.86Å; R276-E315 WeakPolarHBondContact CB-OE2 3.21Å
277	D	97.8	Very high	97.5	Very high	25 Å²	25	38 Å²	38	13%	0.134	21%	0.212	C	C	.	.	H	α-helix	trans	-71	-37.7	-174.9	-59.2	-40.5	0	0	0	110.7	R236 A240 S275 R280 A281	R236-D277 WeakPolarHBondContact CD-OD2 3.06Å; R236-D277 IonicContact NE-OD2 3.34Å; R236-D277 PolarHBondContact NE-OD2 2.92Å; A240-D277 HydrophobicContact CB-CB 4.38Å; S275-D277 PolarHBondContact O-N 3.27Å; S275-D277 PolarHBondContact OG-N 2.98Å; S275-D277 VanDerWaalsContact OG-N 3.16Å; D277-R280 IonicContact OD1-CZ 3.9Å; D277-R280 IonicContact OD1-NH1 2.75Å; D277-R280 PolarHBondContact OD1-NH1 2.96Å; D277-R280 IonicContact OD1-NH2 3.21Å; D277-A281 WeakPolarHBondContact O-CB 3.48Å; D277-A281 PolarHBondContact O-N 3.13Å
278	V	98.7	Very high	97.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-71.5	-41.1	175.8	-177.3	0	0	0	0	110.5	R236 R239 A240 L270 D273 S275 A281 M282	R236-V278 WeakPolarHBondContact O-CG2 3.48Å; R239-V278 HydrophobicContact CB-CG2 3.91Å; A240-V278 HydrophobicContact CB-CG2 3.99Å; L270-V278 HydrophobicContact CB-CG1 4.34Å; L270-V278 HydrophobicContact CD2-CG1 4.03Å; D273-V278 HydrophobicContact CB-CB 3.77Å; D273-V278 HydrophobicContact CB-CG1 3.46Å; D273-V278 VanDerWaalsContact CB-CG1 3.46Å; D273-V278 HydrophobicContact CB-CG2 4.27Å; S275-V278 PolarHBondContact O-N 3.05Å; V278-A281 PolarHBondContact O-N 2.91Å; V278-M282 WeakPolarHBondContact O-CB 3.48Å; V278-M282 PolarHBondContact O-N 3.28Å
279	R	98.6	Very high	97.7	Very high	58 Å²	58	37.6 Å²	37.6	22%	0.219	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-41.3	175.7	-67.6	-162.6	-51.1	-82.5	-0.6	112.9	D273 P274 S275 R276 M282 A283 L310 D313 T318	D273-R279 WeakPolarHBondContact O-CG 3.47Å; P274-R279 PolarHBondContact O-NH1 2.94Å; S275-R279 WeakPolarHBondContact O-CG 3.47Å; S275-R279 PolarHBondContact O-N 3.31Å; R276-R279 PolarHBondContact O-N 3.41Å; R279-M282 WeakPolarHBondContact O-CB 3.27Å; R279-M282 PolarHBondContact O-N 3.32Å; R279-A283 PolarHBondContact O-N 3.41Å; R279-L310 HydrophobicContact CB-CD2 3.83Å; R279-L310 HydrophobicContact CG-CD2 4.39Å; R279-L310 WeakPolarHBondContact O-CD2 3.37Å; R279-D313 WeakPolarHBondContact CD-OD2 3.47Å; R279-D313 IonicContact CZ-OD2 2.67Å; R279-D313 IonicContact NE-OD2 2.88Å; R279-D313 PolarHBondContact NE-OD2 3.47Å; R279-D313 IonicContact NH2-OD1 2.76Å; R279-D313 IonicContact NH2-OD2 3.23Å; R279-T318 HydrophobicContact CB-CG2 4.48Å
280	R	98.4	Very high	97.7	Very high	59 Å²	59	32.6 Å²	32.6	22%	0.223	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-43.4	174.5	-163.1	-173.6	-52.7	102.6	1.7	111.5	R276 D277 M282 A283 S284 E315 I321	R276-R280 WeakPolarHBondContact O-CB 3.47Å; R276-R280 PolarHBondContact O-N 2.86Å; D277-R280 IonicContact OD1-CZ 3.9Å; D277-R280 IonicContact OD1-NH1 2.75Å; D277-R280 PolarHBondContact OD1-NH1 2.96Å; D277-R280 IonicContact OD1-NH2 3.21Å; R280-M282 VanDerWaalsContact C-N 3.34Å; R280-A283 WeakPolarHBondContact O-CB 3.4Å; R280-A283 PolarHBondContact O-N 3.18Å; R280-S284 PolarHBondContact O-N 3.04Å; R280-S284 VanDerWaalsContact O-N 3.14Å; R280-E315 IonicContact CZ-OE1 3.65Å; R280-E315 IonicContact CZ-OE2 2.83Å; R280-E315 IonicContact NE-OE1 3.83Å; R280-E315 PolarHBondContact NE-OE1 3.45Å; R280-E315 IonicContact NE-OE2 2.99Å; R280-E315 IonicContact NH2-OE1 3.38Å; R280-E315 PolarHBondContact NH2-OE1 3.18Å; R280-E315 IonicContact NH2-OE2 2.96Å; R280-E315 PolarHBondContact NH2-OE2 3.06Å; R280-I321 HydrophobicContact CG-CD1 3.67Å
281	A	98.7	Very high	97.6	Very high	18 Å²	18	35.2 Å²	35.2	15%	0.149	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-40.2	173.7	0	0	0	0	0	111.5	A240 L243 D277 V278 S284 V285	A240-A281 HydrophobicContact CB-CB 4.04Å; L243-A281 HydrophobicContact CD1-CB 3.63Å; D277-A281 WeakPolarHBondContact O-CB 3.48Å; D277-A281 PolarHBondContact O-N 3.13Å; V278-A281 PolarHBondContact O-N 2.91Å; A281-S284 PolarHBondContact O-N 3.11Å; A281-S284 PolarHBondContact O-OG 3.14Å; A281-V285 PolarHBondContact O-N 3.29Å
282	M	98.7	Very high	97.6	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-49.7	175.9	178.7	58.6	77.3	0	0	110.3	L243 L270 A271 V278 R279 R280 S284 V285 I286 L289 T306 L310	L243-M282 HydrophobicContact CD1-CB 3.93Å; L243-M282 HydrophobicContact CD1-CE 4.5Å; L243-M282 HydrophobicContact CD2-CE 3.74Å; L243-M282 HydrophobicContact CD2-SD 4.26Å; L270-M282 HydrophobicContact CB-CE 3.99Å; A271-M282 HydrophobicContact CB-CE 3.93Å; V278-M282 WeakPolarHBondContact O-CB 3.48Å; V278-M282 PolarHBondContact O-N 3.28Å; R279-M282 WeakPolarHBondContact O-CB 3.27Å; R279-M282 PolarHBondContact O-N 3.32Å; R280-M282 VanDerWaalsContact C-N 3.34Å; M282-S284 PolarHBondContact O-N 3.2Å; M282-V285 PolarHBondContact O-N 2.84Å; M282-I286 WeakPolarHBondContact O-CB 3.44Å; M282-I286 PolarHBondContact O-N 3.06Å; M282-L289 HydrophobicContact CE-CD1 4.16Å; M282-L289 HydrophobicContact SD-CD1 3.62Å; M282-T306 HydrophobicContact CG-CG2 3.97Å; M282-L310 HydrophobicContact CG-CD1 4.01Å
283	A	98.8	Very high	97.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-50.8	-45.4	174.9	0	0	0	0	0	111.5	R279 R280 V285 I286 L310 T318 I321 S322 Q325	R279-A283 PolarHBondContact O-N 3.41Å; R280-A283 WeakPolarHBondContact O-CB 3.4Å; R280-A283 PolarHBondContact O-N 3.18Å; A283-V285 VanDerWaalsContact C-N 3.27Å; A283-V285 PolarHBondContact O-N 3.27Å; A283-I286 WeakPolarHBondContact O-CG2 3.21Å; A283-L310 HydrophobicContact CB-CD1 4.16Å; A283-T318 HydrophobicContact CB-CG2 4.34Å; A283-I321 HydrophobicContact CB-CB 4.26Å; A283-I321 HydrophobicContact CB-CG2 3.86Å; A283-S322 WeakPolarHBondContact CB-OG 3.18Å; A283-Q325 WeakPolarHBondContact O-CG 3.44Å
284	S	98.5	Very high	97.4	Very high	54 Å²	54	32.8 Å²	32.8	38%	0.378	18%	0.175	S	C	.	.	H	α-helix	trans	-65.3	-22.7	-178.5	76	0	0	0	0	115.3	R280 A281 M282 Q325	R280-S284 PolarHBondContact O-N 3.04Å; R280-S284 VanDerWaalsContact O-N 3.14Å; A281-S284 PolarHBondContact O-N 3.11Å; A281-S284 PolarHBondContact O-OG 3.14Å; M282-S284 PolarHBondContact O-N 3.2Å; S284-Q325 PolarHBondContact O-NE2 3.32Å
285	V	98.4	Very high	97.2	Very high	11 Å²	11	33.3 Å²	33.3	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-117.5	-6.8	-176.5	-57.6	0	0	0	0	114.7	L243 P244 V247 A281 M282 A283 T287 N288 L289	L243-V285 HydrophobicContact CB-CG2 3.87Å; L243-V285 HydrophobicContact CD1-CG2 4.18Å; L243-V285 HydrophobicContact CD2-CG2 3.98Å; L243-V285 HydrophobicContact CG-CG2 4.24Å; P244-V285 HydrophobicContact CG-CG1 4.44Å; V247-V285 HydrophobicContact CG2-CB 3.96Å; V247-V285 HydrophobicContact CG2-CG1 4.4Å; V247-V285 HydrophobicContact CG2-CG2 4.35Å; A281-V285 PolarHBondContact O-N 3.29Å; M282-V285 PolarHBondContact O-N 2.84Å; A283-V285 VanDerWaalsContact C-N 3.27Å; A283-V285 PolarHBondContact O-N 3.27Å; V285-T287 PolarHBondContact O-N 2.78Å; V285-T287 VanDerWaalsContact O-N 3.1Å; V285-N288 WeakPolarHBondContact O-CB 3.47Å; V285-N288 PolarHBondContact O-N 2.95Å; V285-L289 HydrophobicContact CG2-CD1 3.87Å; V285-L289 HydrophobicContact CG2-CG 4.21Å; V285-L289 PolarHBondContact O-N 3.43Å; V285-L289 VanDerWaalsContact O-N 3.14Å
286	I	98.3	Very high	96.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.8	-34.6	-168.9	-166.1	166.8	0	0	0	113.4	M282 A283 L289 Q290 L303 T306 M307 L310 Q325 F329	M282-I286 WeakPolarHBondContact O-CB 3.44Å; M282-I286 PolarHBondContact O-N 3.06Å; A283-I286 WeakPolarHBondContact O-CG2 3.21Å; I286-L289 PolarHBondContact O-N 2.85Å; I286-Q290 WeakPolarHBondContact O-CB 3.35Å; I286-Q290 PolarHBondContact O-N 3.32Å; I286-L303 HydrophobicContact CG1-CD2 4.41Å; I286-T306 HydrophobicContact CD1-CG2 3.89Å; I286-M307 HydrophobicContact CD1-CB 3.89Å; I286-M307 HydrophobicContact CD1-CE 4.39Å; I286-M307 HydrophobicContact CG2-CE 3.34Å; I286-L310 HydrophobicContact CD1-CD1 3.78Å; I286-Q325 HydrophobicContact CG2-CB 4.42Å; I286-F329 HydrophobicContact CD1-CE2 4.23Å; I286-F329 HydrophobicContact CG1-CD2 4.15Å; I286-F329 HydrophobicContact CG1-CE2 3.81Å; I286-F329 HydrophobicContact CG2-CD2 4.29Å
287	T	97.6	Very high	96.3	Very high	13 Å²	13	30.2 Å²	30.2	8%	0.08	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-44.9	174.1	-58.4	0	0	0	0	112.1	V285 L289 Q290 T291 Q325 D328	V285-T287 PolarHBondContact O-N 2.78Å; V285-T287 VanDerWaalsContact O-N 3.1Å; T287-L289 VanDerWaalsContact C-N 3.33Å; T287-L289 PolarHBondContact O-N 3.01Å; T287-Q290 WeakPolarHBondContact O-CB 3.22Å; T287-Q290 PolarHBondContact O-N 3.42Å; T287-T291 PolarHBondContact O-N 3Å; T287-T291 PolarHBondContact O-OG1 2.92Å; T287-T291 VanDerWaalsContact O-OG1 3.13Å; T287-Q325 PolarHBondContact OG1-NE2 3.23Å; T287-Q325 PolarHBondContact OG1-O 2.96Å; T287-Q325 VanDerWaalsContact OG1-O 3.09Å; T287-D328 HydrophobicContact CG2-CB 3.6Å
288	N	98.1	Very high	95	Very high	63 Å²	63	29.9 Å²	29.9	34%	0.337	18%	0.184	S	C	.	.	H	α-helix	trans	-64.3	-41.6	177.8	-65.4	-57.6	0	0	0	110.9	V247 V285 Q290 T291 L292	V247-N288 HydrophobicContact CG1-CB 3.69Å; V247-N288 HydrophobicContact CG2-CB 4.1Å; V285-N288 WeakPolarHBondContact O-CB 3.47Å; V285-N288 PolarHBondContact O-N 2.95Å; N288-Q290 VanDerWaalsContact C-N 3.33Å; N288-Q290 PolarHBondContact O-N 3.29Å; N288-T291 PolarHBondContact O-N 2.84Å; N288-L292 VanDerWaalsContact O-CG 3.31Å; N288-L292 WeakPolarHBondContact O-CG 3.39Å; N288-L292 PolarHBondContact O-N 3.23Å
289	L	97.3	Very high	93.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-40	176.2	-63	178.2	0	0	0	111.6	L243 V247 I267 M282 V285 I286 T287 L292 V293 L303	L243-L289 HydrophobicContact CD2-CD1 4.18Å; V247-L289 HydrophobicContact CG2-CD2 3.59Å; V247-L289 HydrophobicContact CG2-CG 4.07Å; I267-L289 HydrophobicContact CD1-CD2 3.87Å; I267-L289 HydrophobicContact CG1-CD1 4.48Å; I267-L289 HydrophobicContact CG1-CD2 4.06Å; I267-L289 HydrophobicContact CG2-CD1 4.36Å; M282-L289 HydrophobicContact CE-CD1 4.16Å; M282-L289 HydrophobicContact SD-CD1 3.62Å; V285-L289 HydrophobicContact CG2-CD1 3.87Å; V285-L289 HydrophobicContact CG2-CG 4.21Å; V285-L289 PolarHBondContact O-N 3.43Å; V285-L289 VanDerWaalsContact O-N 3.14Å; I286-L289 PolarHBondContact O-N 2.85Å; T287-L289 VanDerWaalsContact C-N 3.33Å; T287-L289 PolarHBondContact O-N 3.01Å; L289-L292 PolarHBondContact O-N 3.43Å; L289-V293 WeakPolarHBondContact O-CG2 3.43Å; L289-V293 PolarHBondContact O-N 3.43Å; L289-L303 HydrophobicContact CB-CD1 3.94Å
290	Q	96.8	Very high	92.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-46.9	175.7	179.7	59.4	34.1	0	0	111.6	I286 T287 N288 L292 V293 C294 L303 H304 F329 A332	I286-Q290 WeakPolarHBondContact O-CB 3.35Å; I286-Q290 PolarHBondContact O-N 3.32Å; T287-Q290 WeakPolarHBondContact O-CB 3.22Å; T287-Q290 PolarHBondContact O-N 3.42Å; N288-Q290 VanDerWaalsContact C-N 3.33Å; N288-Q290 PolarHBondContact O-N 3.29Å; Q290-L292 VanDerWaalsContact C-N 3.32Å; Q290-L292 PolarHBondContact O-N 3.49Å; Q290-V293 PolarHBondContact O-N 2.85Å; Q290-C294 PolarHBondContact NE2-SG 2.69Å; Q290-C294 WeakPolarHBondContact O-CB 3.32Å; Q290-C294 PolarHBondContact O-N 2.71Å; Q290-L303 HydrophobicContact CB-CD1 4.38Å; Q290-H304 PolarHBondContact NE2-NE2 3.45Å; Q290-F329 HydrophobicContact CB-CD2 3.61Å; Q290-F329 HydrophobicContact CB-CE2 3.52Å; Q290-F329 HydrophobicContact CB-CZ 4.48Å; Q290-F329 HydrophobicContact CG-CD2 3.83Å; Q290-F329 HydrophobicContact CG-CE2 3.67Å; Q290-F329 HydrophobicContact CG-CG 4.48Å; Q290-F329 HydrophobicContact CG-CZ 4.2Å; Q290-A332 HydrophobicContact CB-CB 4.45Å; Q290-A332 HydrophobicContact CG-CB 3.9Å
291	T	96.1	Very high	92.2	Very high	55 Å²	55	38.4 Å²	38.4	34%	0.337	23%	0.234	S	C	.	.	H	α-helix	trans	-58.4	-44.8	175	-55.8	0	0	0	0	111.3	T287 N288 C294 N295	T287-T291 PolarHBondContact O-N 3Å; T287-T291 PolarHBondContact O-OG1 2.92Å; T287-T291 VanDerWaalsContact O-OG1 3.13Å; N288-T291 PolarHBondContact O-N 2.84Å; T291-C294 PolarHBondContact O-N 3.26Å; T291-N295 WeakPolarHBondContact O-CB 3.49Å; T291-N295 PolarHBondContact O-N 3.29Å; T291-N295 PolarHBondContact O-ND2 3.23Å; T291-N295 PolarHBondContact O-OD1 3.05Å
292	L	95.9	Very high	91.7	Very high	13 Å²	13	39.6 Å²	39.6	7%	0.068	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-48.2	178.4	-71.3	171.6	0	0	0	112.4	V247 R251 F259 N288 L289 Q290 C294 N295 H296	V247-L292 HydrophobicContact CG1-CD1 4.17Å; V247-L292 WeakPolarHBondContact O-CD1 3.41Å; R251-L292 HydrophobicContact CG-CD2 3.91Å; F259-L292 HydrophobicContact CE2-CB 4.12Å; F259-L292 HydrophobicContact CZ-CB 4.15Å; N288-L292 VanDerWaalsContact O-CG 3.31Å; N288-L292 WeakPolarHBondContact O-CG 3.39Å; N288-L292 PolarHBondContact O-N 3.23Å; L289-L292 PolarHBondContact O-N 3.43Å; Q290-L292 VanDerWaalsContact C-N 3.32Å; Q290-L292 PolarHBondContact O-N 3.49Å; L292-C294 VanDerWaalsContact C-N 3.31Å; L292-C294 PolarHBondContact O-N 2.88Å; L292-N295 PolarHBondContact O-N 2.87Å; L292-H296 PolarHBondContact O-N 3.34Å; L292-H296 PolarHBondContact O-ND1 2.86Å
293	V	94.8	Very high	91.6	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-41.4	179.6	167.9	0	0	0	0	111.3	F259 I267 L289 Q290 H296 G297 G298 L303	F259-V293 HydrophobicContact CE1-CG2 4.1Å; F259-V293 HydrophobicContact CZ-CG2 4.16Å; I267-V293 HydrophobicContact CD1-CG2 4.33Å; L289-V293 WeakPolarHBondContact O-CG2 3.43Å; L289-V293 PolarHBondContact O-N 3.43Å; Q290-V293 PolarHBondContact O-N 2.85Å; V293-H296 PolarHBondContact O-N 3.1Å; V293-G297 PolarHBondContact O-N 3.14Å; V293-G298 PolarHBondContact O-N 2.9Å; V293-G298 VanDerWaalsContact O-N 3.15Å; V293-L303 HydrophobicContact CB-CD1 4.27Å; V293-L303 HydrophobicContact CG2-CD1 3.79Å
294	C	92.5	Very high	91.5	Very high	41 Å²	41	40.1 Å²	40.1	28%	0.277	24%	0.244	S	C	.	.	H	α-helix	trans	-67.9	-39.6	177.1	-81.4	0	0	0	0	112.8	Q290 T291 L292 H296 G297 A332	Q290-C294 PolarHBondContact NE2-SG 2.69Å; Q290-C294 WeakPolarHBondContact O-CB 3.32Å; Q290-C294 PolarHBondContact O-N 2.71Å; T291-C294 PolarHBondContact O-N 3.26Å; L292-C294 VanDerWaalsContact C-N 3.31Å; L292-C294 PolarHBondContact O-N 2.88Å; C294-H296 PolarHBondContact O-N 3.39Å; C294-G297 PolarHBondContact O-N 3.36Å; C294-G297 VanDerWaalsContact O-N 3.11Å; C294-A332 PolarHBondContact SG-O 3.46Å
295	N	92.1	Very high	91.4	Very high	123 Å²	123	42.4 Å²	42.4	66%	0.658	25%	0.248	S	C	*	.	H	α-helix	trans	-64.4	-27.8	177.4	-72.7	-10.3	0	0	0	112.9	T291 L292	T291-N295 WeakPolarHBondContact O-CB 3.49Å; T291-N295 PolarHBondContact O-N 3.29Å; T291-N295 PolarHBondContact O-ND2 3.23Å; T291-N295 PolarHBondContact O-OD1 3.05Å; L292-N295 PolarHBondContact O-N 2.87Å
296	H	92.4	Very high	91.3	Very high	26 Å²	26	42.6 Å²	42.6	12%	0.12	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	7.4	176.4	-66.8	88	0	0	0	113.7	I253 A256 F259 L292 V293 C294 G298	I253-H296 PolarHBondContact O-NE2 3.35Å; A256-H296 HydrophobicContact CB-CB 4.41Å; F259-H296 HydrophobicContact CB-CB 4.39Å; F259-H296 HydrophobicContact CD1-CB 4.04Å; F259-H296 AromaticContact CD2-CD2 3.99Å; F259-H296 AromaticContact CD2-CE1 3.48Å; F259-H296 VanDerWaalsContact CD2-CE1 3.48Å; F259-H296 WeakPolarHBondContact CD2-CE1 3.48Å; F259-H296 AromaticContact CD2-CG 3.87Å; F259-H296 AromaticContact CD2-ND1 3.56Å; F259-H296 AromaticContact CD2-NE2 3.75Å; F259-H296 AromaticContact CE2-CE1 3.92Å; F259-H296 AromaticContact CE2-ND1 3.81Å; F259-H296 HydrophobicContact CG-CB 4.14Å; F259-H296 AromaticContact CG-CD2 3.78Å; F259-H296 AromaticContact CG-CG 3.65Å; F259-H296 AromaticContact CG-ND1 3.83Å; L292-H296 PolarHBondContact O-N 3.34Å; L292-H296 PolarHBondContact O-ND1 2.86Å; V293-H296 PolarHBondContact O-N 3.1Å; C294-H296 PolarHBondContact O-N 3.39Å; H296-G298 PolarHBondContact O-N 3.48Å
297	G	83.4	Confident	91.3	Very high	73 Å²	73	42.6 Å²	42.6	75%	0.753	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	12.3	177	0	0	0	0	0	115.2	V293 C294	V293-G297 PolarHBondContact O-N 3.14Å; C294-G297 PolarHBondContact O-N 3.36Å; C294-G297 VanDerWaalsContact O-N 3.11Å
298	G	71.5	Confident	91.3	Very high	18 Å²	18	42.6 Å²	42.6	19%	0.186	25%	0.249	C	C	.	.			trans	-81	165.9	-176.9	0	0	0	0	0	114.3	V293 H296 S300	V293-G298 PolarHBondContact O-N 2.9Å; V293-G298 VanDerWaalsContact O-N 3.15Å; H296-G298 PolarHBondContact O-N 3.48Å; G298-S300 PolarHBondContact O-N 3.01Å
299	A	72	Confident	91.3	Very high	76 Å²	76	43.5 Å²	43.5	63%	0.628	25%	0.254	S	S	*	.			trans	-68.4	112	174.8	0	0	0	0	0	110.8	R264 R301	R264-A299 PolarHBondContact NH1-O 2.89Å; A299-R301 VanDerWaalsContact C-N 3.26Å; A299-R301 PolarHBondContact O-N 2.81Å
300	S	78.9	Confident	91.4	Very high	12 Å²	12	43.8 Å²	43.8	8%	0.084	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-0.5	176.2	42.4	0	0	0	0	114.2	G298 S302 L303 H304	G298-S300 PolarHBondContact O-N 3.01Å; S300-S302 PolarHBondContact O-N 3.27Å; S300-L303 PolarHBondContact O-N 3.34Å; S300-H304 PolarHBondContact O-N 3.38Å; S300-H304 PolarHBondContact O-ND1 3.37Å; S300-H304 PolarHBondContact OG-CE1 2.84Å
301	R	84.6	Confident	91.5	Very high	208 Å²	208	44 Å²	44	79%	0.785	26%	0.257	S	S	*	.	H	α-helix	trans	-56.7	-36.2	-175.5	-170.6	-179.9	-65.7	166.2	0.6	112.9	A299 H304 Q305	A299-R301 VanDerWaalsContact C-N 3.26Å; A299-R301 PolarHBondContact O-N 2.81Å; R301-H304 PolarHBondContact O-N 3.18Å; R301-Q305 PolarHBondContact O-N 3.2Å; R301-Q305 VanDerWaalsContact O-N 3.12Å
302	S	88.8	Confident	91.5	Very high	42 Å²	42	46.3 Å²	46.3	29%	0.294	26%	0.264	S	S	.	.	H	α-helix	trans	-63.2	-48.8	177.1	59.3	0	0	0	0	111	D268 S300 H304 Q305 T306	D268-S302 PolarHBondContact OD1-OG 2.85Å; S300-S302 PolarHBondContact O-N 3.27Å; S302-H304 PolarHBondContact O-N 3.07Å; S302-Q305 PolarHBondContact O-N 3.22Å; S302-T306 PolarHBondContact O-N 3.3Å; S302-T306 PolarHBondContact O-OG1 3.43Å
303	L	96.5	Very high	91.6	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-34.1	178.5	-68.7	-177.1	0	0	0	113.3	I267 I286 L289 Q290 V293 S300 Q305 T306 M307 F329	I267-L303 HydrophobicContact CG2-CD2 3.8Å; I286-L303 HydrophobicContact CG1-CD2 4.41Å; L289-L303 HydrophobicContact CB-CD1 3.94Å; Q290-L303 HydrophobicContact CB-CD1 4.38Å; V293-L303 HydrophobicContact CB-CD1 4.27Å; V293-L303 HydrophobicContact CG2-CD1 3.79Å; S300-L303 PolarHBondContact O-N 3.34Å; L303-Q305 VanDerWaalsContact C-N 3.34Å; L303-T306 PolarHBondContact O-N 2.97Å; L303-M307 PolarHBondContact O-N 3.2Å; L303-F329 HydrophobicContact CB-CE2 4.37Å; L303-F329 HydrophobicContact CB-CZ 4.45Å; L303-F329 WeakPolarHBondContact O-CZ 3.27Å
304	H	96.3	Very high	91.7	Very high	13 Å²	13	53.7 Å²	53.7	6%	0.06	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-46.4	171.2	-63	138	0	0	0	111.3	Q290 S300 R301 S302 M307 L308 F329 S333	Q290-H304 PolarHBondContact NE2-NE2 3.45Å; S300-H304 PolarHBondContact O-N 3.38Å; S300-H304 PolarHBondContact O-ND1 3.37Å; S300-H304 PolarHBondContact OG-CE1 2.84Å; R301-H304 PolarHBondContact O-N 3.18Å; S302-H304 PolarHBondContact O-N 3.07Å; H304-M307 PolarHBondContact O-N 3.13Å; H304-L308 WeakPolarHBondContact O-CG 3.42Å; H304-L308 PolarHBondContact O-N 2.92Å; H304-L308 VanDerWaalsContact O-N 3.15Å; H304-F329 AromaticContact CD2-CE1 3.66Å; H304-F329 AromaticContact CD2-CZ 3.66Å; H304-S333 PolarHBondContact NE2-OG 3.11Å
305	Q	96.4	Very high	91.9	Very high	101 Å²	101	53.7 Å²	53.7	47%	0.472	30%	0.299	S	S	.	.	H	α-helix	trans	-64.7	-41.5	175.6	-173.3	61.7	55.1	0	0	111.7	R301 S302 L303 M307 L308 N309	R301-Q305 PolarHBondContact O-N 3.2Å; R301-Q305 VanDerWaalsContact O-N 3.12Å; S302-Q305 PolarHBondContact O-N 3.22Å; L303-Q305 VanDerWaalsContact C-N 3.34Å; Q305-M307 PolarHBondContact O-N 3.5Å; Q305-L308 PolarHBondContact O-N 3.45Å; Q305-N309 PolarHBondContact NE2-OD1 3.31Å; Q305-N309 PolarHBondContact O-N 2.91Å; Q305-N309 PolarHBondContact O-OD1 3.15Å
306	T	97.9	Very high	92.2	Very high	15 Å²	15	50.8 Å²	50.8	9%	0.092	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-46.2	176.6	-55.5	0	0	0	0	111.2	A271 M282 I286 S302 L303 L308 N309 L310	A271-T306 HydrophobicContact CB-CG2 4.07Å; M282-T306 HydrophobicContact CG-CG2 3.97Å; I286-T306 HydrophobicContact CD1-CG2 3.89Å; S302-T306 PolarHBondContact O-N 3.3Å; S302-T306 PolarHBondContact O-OG1 3.43Å; L303-T306 PolarHBondContact O-N 2.97Å; T306-L308 VanDerWaalsContact C-N 3.34Å; T306-L308 PolarHBondContact O-N 3.23Å; T306-N309 PolarHBondContact O-N 3.42Å; T306-L310 HydrophobicContact CG2-CD1 3.94Å; T306-L310 HydrophobicContact CG2-CG 4.33Å; T306-L310 WeakPolarHBondContact O-CG 3.34Å; T306-L310 PolarHBondContact O-N 2.88Å
307	M	98.3	Very high	92.4	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.4	-46.7	175.8	175.1	57.5	82.7	0	0	111.5	I286 L303 H304 Q305 N309 L310 L311 Q325 L326 F329	I286-M307 HydrophobicContact CD1-CB 3.89Å; I286-M307 HydrophobicContact CD1-CE 4.39Å; I286-M307 HydrophobicContact CG2-CE 3.34Å; L303-M307 PolarHBondContact O-N 3.2Å; H304-M307 PolarHBondContact O-N 3.13Å; Q305-M307 PolarHBondContact O-N 3.5Å; M307-N309 VanDerWaalsContact C-N 3.35Å; M307-N309 PolarHBondContact O-N 3.23Å; M307-L310 PolarHBondContact O-N 3.47Å; M307-L311 HydrophobicContact CG-CD1 4.27Å; M307-L311 WeakPolarHBondContact O-CG 3.37Å; M307-L311 PolarHBondContact O-N 3.12Å; M307-L311 HydrophobicContact SD-CD1 4.35Å; M307-L311 HydrophobicContact SD-CG 4.16Å; M307-Q325 HydrophobicContact CE-CB 4.38Å; M307-L326 HydrophobicContact CE-CD1 4.41Å; M307-L326 HydrophobicContact CG-CD1 3.86Å; M307-L326 HydrophobicContact SD-CD1 4.1Å; M307-F329 HydrophobicContact CB-CD1 4.23Å; M307-F329 HydrophobicContact CB-CE1 3.66Å; M307-F329 HydrophobicContact CB-CE2 4.22Å; M307-F329 HydrophobicContact CB-CZ 3.68Å; M307-F329 HydrophobicContact CE-CB 3.67Å; M307-F329 HydrophobicContact CE-CD1 3.88Å; M307-F329 HydrophobicContact CE-CD2 3.71Å; M307-F329 HydrophobicContact CE-CE1 4.45Å; M307-F329 HydrophobicContact CE-CE2 4.32Å; M307-F329 HydrophobicContact CE-CG 3.47Å; M307-F329 VanDerWaalsContact CE-CG 3.47Å; M307-F329 HydrophobicContact CG-CD1 3.89Å; M307-F329 HydrophobicContact CG-CE1 3.79Å; M307-F329 HydrophobicContact CG-CG 4.43Å; M307-F329 HydrophobicContact CG-CZ 4.27Å
308	L	97.6	Very high	93.1	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.068	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-42	178.2	-65	178.1	0	0	0	112	H304 Q305 T306 L310 L311 E312 R345	H304-L308 WeakPolarHBondContact O-CG 3.42Å; H304-L308 PolarHBondContact O-N 2.92Å; H304-L308 VanDerWaalsContact O-N 3.15Å; Q305-L308 PolarHBondContact O-N 3.45Å; T306-L308 VanDerWaalsContact C-N 3.34Å; T306-L308 PolarHBondContact O-N 3.23Å; L308-L310 VanDerWaalsContact C-N 3.31Å; L308-L310 PolarHBondContact O-N 3.42Å; L308-L311 HydrophobicContact CD2-CD1 4.48Å; L308-L311 PolarHBondContact O-N 3.45Å; L308-E312 PolarHBondContact O-N 3.17Å; L308-R345 HydrophobicContact CD1-CG 4.29Å; L308-R345 HydrophobicContact CD2-CB 3.66Å; L308-R345 HydrophobicContact CD2-CG 3.9Å
309	N	97.8	Very high	94.4	Very high	83 Å²	83	50.3 Å²	50.3	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-63.4	-37.5	176	-65.8	-9.6	0	0	0	111.9	Q305 T306 M307 E312 D313	Q305-N309 PolarHBondContact NE2-OD1 3.31Å; Q305-N309 PolarHBondContact O-N 2.91Å; Q305-N309 PolarHBondContact O-OD1 3.15Å; T306-N309 PolarHBondContact O-N 3.42Å; M307-N309 VanDerWaalsContact C-N 3.35Å; M307-N309 PolarHBondContact O-N 3.23Å; N309-E312 CarbonylContact O-C 3.51Å; N309-E312 PolarHBondContact O-N 3.5Å; N309-D313 PolarHBondContact O-N 2.86Å; N309-D313 VanDerWaalsContact O-N 3.11Å
310	L	98.6	Very high	95.7	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-73.9	-27.3	179.1	-65.6	166.8	0	0	0	112.9	R279 M282 A283 I286 T306 M307 L308 D313 T318 S322	R279-L310 HydrophobicContact CB-CD2 3.83Å; R279-L310 HydrophobicContact CG-CD2 4.39Å; R279-L310 WeakPolarHBondContact O-CD2 3.37Å; M282-L310 HydrophobicContact CG-CD1 4.01Å; A283-L310 HydrophobicContact CB-CD1 4.16Å; I286-L310 HydrophobicContact CD1-CD1 3.78Å; T306-L310 HydrophobicContact CG2-CD1 3.94Å; T306-L310 HydrophobicContact CG2-CG 4.33Å; T306-L310 WeakPolarHBondContact O-CG 3.34Å; T306-L310 PolarHBondContact O-N 2.88Å; M307-L310 PolarHBondContact O-N 3.47Å; L308-L310 VanDerWaalsContact C-N 3.31Å; L308-L310 PolarHBondContact O-N 3.42Å; L310-D313 WeakPolarHBondContact O-CB 3.4Å; L310-D313 PolarHBondContact O-N 3.44Å; L310-T318 HydrophobicContact CD2-CG2 3.86Å; L310-S322 VanDerWaalsContact CB-OG 3.22Å; L310-S322 WeakPolarHBondContact CB-OG 3.4Å; L310-S322 PolarHBondContact O-OG 3.19Å
311	L	98.3	Very high	96.6	Very high	6 Å²	6	51.1 Å²	51.1	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-72.8	-18.1	169.4	-69.2	170.8	0	0	0	112.5	M307 L308 R319 A323 L326 H349 L362	M307-L311 HydrophobicContact CG-CD1 4.27Å; M307-L311 WeakPolarHBondContact O-CG 3.37Å; M307-L311 PolarHBondContact O-N 3.12Å; M307-L311 HydrophobicContact SD-CD1 4.35Å; M307-L311 HydrophobicContact SD-CG 4.16Å; L308-L311 HydrophobicContact CD2-CD1 4.48Å; L308-L311 PolarHBondContact O-N 3.45Å; L311-R319 WeakPolarHBondContact O-CD 3.28Å; L311-A323 HydrophobicContact CD2-CB 4.32Å; L311-L326 HydrophobicContact CD1-CD1 4.17Å; L311-L326 HydrophobicContact CD1-CD2 3.88Å; L311-L326 HydrophobicContact CD2-CD2 4.31Å; L311-H349 WeakPolarHBondContact CB-NE2 3.31Å; L311-L362 HydrophobicContact CD2-CD2 4.3Å
312	E	97.1	Very high	97.3	Very high	102 Å²	102	41.2 Å²	41.2	48%	0.477	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	12.4	174.8	-63.9	179.4	178.9	0	0	112.1	L308 N309 R345 H349	L308-E312 PolarHBondContact O-N 3.17Å; N309-E312 CarbonylContact O-C 3.51Å; N309-E312 PolarHBondContact O-N 3.5Å; E312-R345 IonicContact OE1-CZ 3.9Å; E312-R345 IonicContact OE1-NH2 3.05Å; E312-R345 PolarHBondContact OE1-NH2 2.85Å; E312-H349 WeakPolarHBondContact CG-NE2 3.41Å; E312-H349 IonicContact OE1-CE1 2.97Å; E312-H349 IonicContact OE1-NE2 3.29Å
313	D	98	Very high	97.8	Very high	11 Å²	11	39.2 Å²	39.2	6%	0.059	19%	0.193	C	C	.	.			trans	-62	142.9	-176.6	-158.8	-73.2	0	0	0	111.6	R279 N309 L310 E315 T318 R319	R279-D313 WeakPolarHBondContact CD-OD2 3.47Å; R279-D313 IonicContact CZ-OD2 2.67Å; R279-D313 IonicContact NE-OD2 2.88Å; R279-D313 PolarHBondContact NE-OD2 3.47Å; R279-D313 IonicContact NH2-OD1 2.76Å; R279-D313 IonicContact NH2-OD2 3.23Å; N309-D313 PolarHBondContact O-N 2.86Å; N309-D313 VanDerWaalsContact O-N 3.11Å; L310-D313 WeakPolarHBondContact O-CB 3.4Å; L310-D313 PolarHBondContact O-N 3.44Å; D313-E315 PolarHBondContact O-N 3.34Å; D313-E315 WeakPolarHBondContact OD1-CB 3.39Å; D313-E315 PolarHBondContact OD1-N 2.86Å; D313-T318 HydrophobicContact CB-CG2 3.79Å; D313-R319 HydrophobicContact CB-CG 4.01Å; D313-R319 WeakPolarHBondContact O-CD 3.45Å; D313-R319 WeakPolarHBondContact O-CG 3.12Å; D313-R319 PolarHBondContact O-NH1 3.35Å
314	N	96.7	Very high	97.8	Very high	158 Å²	158	40.9 Å²	40.9	85%	0.845	21%	0.211	S	C	*	.	S	Bend	trans	-62.3	-30	175.9	-66.4	-49.6	0	0	0	112
315	E	96.7	Very high	97.9	Very high	42 Å²	42	42.6 Å²	42.6	20%	0.196	22%	0.219	C	C	.	.	S	Bend	trans	-82	120.3	177.6	-173.4	-179.6	167.2	0	0	111.9	R276 R280 D313 E317 T318 R319	R276-E315 WeakPolarHBondContact CB-OE2 3.21Å; R280-E315 IonicContact CZ-OE1 3.65Å; R280-E315 IonicContact CZ-OE2 2.83Å; R280-E315 IonicContact NE-OE1 3.83Å; R280-E315 PolarHBondContact NE-OE1 3.45Å; R280-E315 IonicContact NE-OE2 2.99Å; R280-E315 IonicContact NH2-OE1 3.38Å; R280-E315 PolarHBondContact NH2-OE1 3.18Å; R280-E315 IonicContact NH2-OE2 2.96Å; R280-E315 PolarHBondContact NH2-OE2 3.06Å; D313-E315 PolarHBondContact O-N 3.34Å; D313-E315 WeakPolarHBondContact OD1-CB 3.39Å; D313-E315 PolarHBondContact OD1-N 2.86Å; E315-E317 VanDerWaalsContact C-N 3.33Å; E315-E317 HydrophobicContact CG-CB 4.44Å; E315-E317 PolarHBondContact O-N 2.99Å; E315-T318 PolarHBondContact O-N 3.07Å; E315-T318 PolarHBondContact OE2-OG1 3.41Å; E315-R319 PolarHBondContact O-N 3.24Å; E315-R319 VanDerWaalsContact O-N 3.14Å
316	V	97.5	Very high	98	Very high	61 Å²	61	38 Å²	38	37%	0.37	20%	0.198	S	C	.	.	H	α-helix	trans	-53.8	-46.6	178.6	170.6	0	0	0	0	112.6	T318 R319 R320 E355 V358	V316-T318 VanDerWaalsContact C-N 3.33Å; V316-T318 PolarHBondContact O-N 3.31Å; V316-R319 PolarHBondContact O-N 3.17Å; V316-R320 PolarHBondContact O-N 3.19Å; V316-E355 HydrophobicContact CG1-CB 4.42Å; V316-E355 HydrophobicContact CG1-CG 3.69Å; V316-V358 HydrophobicContact CG1-CG2 4.13Å
317	E	97.7	Very high	98.1	Very high	72 Å²	72	40.8 Å²	40.8	34%	0.336	21%	0.208	S	C	.	.	H	α-helix	trans	-67.1	-35.5	-176.5	-176.6	57.9	-166.5	0	0	112.1	E315 R320 I321	E315-E317 VanDerWaalsContact C-N 3.33Å; E315-E317 HydrophobicContact CG-CB 4.44Å; E315-E317 PolarHBondContact O-N 2.99Å; E317-R320 PolarHBondContact O-N 3.06Å; E317-R320 IonicContact OE1-CZ 2.99Å; E317-R320 IonicContact OE1-NE 2.78Å; E317-R320 PolarHBondContact OE1-NE 3.09Å; E317-R320 IonicContact OE1-NH2 3.33Å; E317-R320 PolarHBondContact OE1-NH2 3.5Å; E317-R320 IonicContact OE2-CZ 3.3Å; E317-R320 IonicContact OE2-NE 2.76Å; E317-R320 PolarHBondContact OE2-NE 3.27Å; E317-R320 IonicContact OE2-NH2 2.8Å; E317-I321 HydrophobicContact CG-CD1 4.11Å; E317-I321 WeakPolarHBondContact O-CG1 3.38Å; E317-I321 PolarHBondContact O-N 3.45Å
318	T	98.6	Very high	98.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-46	173.1	-59.6	0	0	0	0	110.8	R279 A283 L310 D313 E315 V316 R320 I321 S322	R279-T318 HydrophobicContact CB-CG2 4.48Å; A283-T318 HydrophobicContact CB-CG2 4.34Å; L310-T318 HydrophobicContact CD2-CG2 3.86Å; D313-T318 HydrophobicContact CB-CG2 3.79Å; E315-T318 PolarHBondContact O-N 3.07Å; E315-T318 PolarHBondContact OE2-OG1 3.41Å; V316-T318 VanDerWaalsContact C-N 3.33Å; V316-T318 PolarHBondContact O-N 3.31Å; T318-R320 VanDerWaalsContact C-N 3.33Å; T318-R320 PolarHBondContact O-N 3.04Å; T318-I321 PolarHBondContact O-N 3.01Å; T318-S322 WeakPolarHBondContact O-CB 3.4Å; T318-S322 PolarHBondContact O-N 3.23Å; T318-S322 PolarHBondContact O-OG 3.17Å
319	R	98.6	Very high	98.1	Very high	36 Å²	36	44 Å²	44	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-61.1	-41.3	175.4	-61.7	-158.4	-56.4	-78.3	3.6	112.2	L311 D313 E315 V316 S322 A323 E353 V358	L311-R319 WeakPolarHBondContact O-CD 3.28Å; D313-R319 HydrophobicContact CB-CG 4.01Å; D313-R319 WeakPolarHBondContact O-CD 3.45Å; D313-R319 WeakPolarHBondContact O-CG 3.12Å; D313-R319 PolarHBondContact O-NH1 3.35Å; E315-R319 PolarHBondContact O-N 3.24Å; E315-R319 VanDerWaalsContact O-N 3.14Å; V316-R319 PolarHBondContact O-N 3.17Å; R319-S322 PolarHBondContact O-N 3.27Å; R319-A323 WeakPolarHBondContact O-CB 3.49Å; R319-A323 PolarHBondContact O-N 3.46Å; R319-E353 IonicContact CZ-OE1 2.68Å; R319-E353 IonicContact CZ-OE2 3.12Å; R319-E353 IonicContact NE-OE1 2.8Å; R319-E353 IonicContact NE-OE2 2.74Å; R319-E353 PolarHBondContact NE-OE2 3.43Å; R319-E353 IonicContact NH2-OE1 3.52Å; R319-E353 PolarHBondContact NH2-OE1 3Å; R319-E353 VanDerWaalsContact NH2-OE1 3.13Å; R319-E353 IonicContact NH2-OE2 2.79Å; R319-V358 HydrophobicContact CB-CG1 3.97Å; R319-V358 HydrophobicContact CB-CG2 4.24Å
320	R	98.4	Very high	98.1	Very high	71 Å²	71	40 Å²	40	27%	0.268	21%	0.205	S	C	.	.	H	α-helix	trans	-60.6	-49.2	178.9	-165	-167.5	67	74.3	2.4	111.7	V316 E317 T318 S322 A323 G324 V358 E361	V316-R320 PolarHBondContact O-N 3.19Å; E317-R320 PolarHBondContact O-N 3.06Å; E317-R320 IonicContact OE1-CZ 2.99Å; E317-R320 IonicContact OE1-NE 2.78Å; E317-R320 PolarHBondContact OE1-NE 3.09Å; E317-R320 IonicContact OE1-NH2 3.33Å; E317-R320 PolarHBondContact OE1-NH2 3.5Å; E317-R320 IonicContact OE2-CZ 3.3Å; E317-R320 IonicContact OE2-NE 2.76Å; E317-R320 PolarHBondContact OE2-NE 3.27Å; E317-R320 IonicContact OE2-NH2 2.8Å; T318-R320 VanDerWaalsContact C-N 3.33Å; T318-R320 PolarHBondContact O-N 3.04Å; R320-S322 VanDerWaalsContact C-N 3.34Å; R320-A323 PolarHBondContact O-N 3.42Å; R320-G324 PolarHBondContact O-N 3.23Å; R320-V358 HydrophobicContact CB-CG2 3.99Å; R320-E361 HydrophobicContact CG-CG 4.06Å; R320-E361 IonicContact NH1-OE1 2.83Å
321	I	98.7	Very high	97.9	Very high	33 Å²	33	43.4 Å²	43.4	17%	0.169	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-44.8	177.7	-66.2	166.4	0	0	0	110	R280 A283 E317 T318 A323 G324 Q325	R280-I321 HydrophobicContact CG-CD1 3.67Å; A283-I321 HydrophobicContact CB-CB 4.26Å; A283-I321 HydrophobicContact CB-CG2 3.86Å; E317-I321 HydrophobicContact CG-CD1 4.11Å; E317-I321 WeakPolarHBondContact O-CG1 3.38Å; E317-I321 PolarHBondContact O-N 3.45Å; T318-I321 PolarHBondContact O-N 3.01Å; I321-A323 PolarHBondContact O-N 3.15Å; I321-G324 PolarHBondContact O-N 3.11Å; I321-Q325 HydrophobicContact CG2-CG 4.45Å; I321-Q325 VanDerWaalsContact O-CG 3.28Å; I321-Q325 WeakPolarHBondContact O-CG 3.42Å; I321-Q325 PolarHBondContact O-N 3Å
322	S	98.8	Very high	97.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-44.8	177	-58.5	0	0	0	0	112.6	A283 L310 T318 R319 R320 G324 Q325 L326	A283-S322 WeakPolarHBondContact CB-OG 3.18Å; L310-S322 VanDerWaalsContact CB-OG 3.22Å; L310-S322 WeakPolarHBondContact CB-OG 3.4Å; L310-S322 PolarHBondContact O-OG 3.19Å; T318-S322 WeakPolarHBondContact O-CB 3.4Å; T318-S322 PolarHBondContact O-N 3.23Å; T318-S322 PolarHBondContact O-OG 3.17Å; R319-S322 PolarHBondContact O-N 3.27Å; R320-S322 VanDerWaalsContact C-N 3.34Å; S322-G324 VanDerWaalsContact C-N 3.33Å; S322-G324 PolarHBondContact O-N 3.13Å; S322-Q325 PolarHBondContact O-N 3.45Å; S322-Q325 VanDerWaalsContact O-N 3.17Å; S322-L326 PolarHBondContact O-N 3.41Å
323	A	98.7	Very high	97.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-41.1	175.9	0	0	0	0	0	112	L311 R319 R320 I321 Q325 L326 V358 E361 L362	L311-A323 HydrophobicContact CD2-CB 4.32Å; R319-A323 WeakPolarHBondContact O-CB 3.49Å; R319-A323 PolarHBondContact O-N 3.46Å; R320-A323 PolarHBondContact O-N 3.42Å; I321-A323 PolarHBondContact O-N 3.15Å; A323-Q325 VanDerWaalsContact C-N 3.29Å; A323-Q325 PolarHBondContact O-N 3.46Å; A323-L326 WeakPolarHBondContact O-CB 3.43Å; A323-L326 PolarHBondContact O-N 3.43Å; A323-V358 HydrophobicContact CB-CG1 4.25Å; A323-E361 HydrophobicContact CB-CB 3.74Å; A323-L362 HydrophobicContact CB-CD2 3.76Å; A323-L362 HydrophobicContact CB-CG 3.94Å
324	G	98	Very high	97.5	Very high	37 Å²	37	41.6 Å²	41.6	38%	0.381	22%	0.222	S	C	.	.	H	α-helix	trans	-63.8	-32.2	175.2	0	0	0	0	0	113.6	R320 I321 S322	R320-G324 PolarHBondContact O-N 3.23Å; I321-G324 PolarHBondContact O-N 3.11Å; S322-G324 VanDerWaalsContact C-N 3.33Å; S322-G324 PolarHBondContact O-N 3.13Å
325	Q	98.4	Very high	97.2	Very high	49 Å²	49	42.6 Å²	42.6	23%	0.229	22%	0.219	C	C	.	.	H	α-helix	trans	-83.3	-21.4	179.6	-67.8	-74.5	114.5	0	0	113.4	A283 S284 I286 T287 M307 I321 S322 A323 K327 D328 F329	A283-Q325 WeakPolarHBondContact O-CG 3.44Å; S284-Q325 PolarHBondContact O-NE2 3.32Å; I286-Q325 HydrophobicContact CG2-CB 4.42Å; T287-Q325 PolarHBondContact OG1-NE2 3.23Å; T287-Q325 PolarHBondContact OG1-O 2.96Å; T287-Q325 VanDerWaalsContact OG1-O 3.09Å; M307-Q325 HydrophobicContact CE-CB 4.38Å; I321-Q325 HydrophobicContact CG2-CG 4.45Å; I321-Q325 VanDerWaalsContact O-CG 3.28Å; I321-Q325 WeakPolarHBondContact O-CG 3.42Å; I321-Q325 PolarHBondContact O-N 3Å; S322-Q325 PolarHBondContact O-N 3.45Å; S322-Q325 VanDerWaalsContact O-N 3.17Å; A323-Q325 VanDerWaalsContact C-N 3.29Å; A323-Q325 PolarHBondContact O-N 3.46Å; Q325-K327 VanDerWaalsContact C-N 3.34Å; Q325-K327 PolarHBondContact O-N 3.32Å; Q325-D328 PolarHBondContact O-N 3.37Å; Q325-F329 WeakPolarHBondContact O-CB 3.45Å; Q325-F329 PolarHBondContact O-N 2.66Å
326	L	98.6	Very high	97	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-36.1	-167.8	-177.7	59.7	0	0	0	113.9	M307 L311 S322 A323 F329 C330 L346 L362	M307-L326 HydrophobicContact CE-CD1 4.41Å; M307-L326 HydrophobicContact CG-CD1 3.86Å; M307-L326 HydrophobicContact SD-CD1 4.1Å; L311-L326 HydrophobicContact CD1-CD1 4.17Å; L311-L326 HydrophobicContact CD1-CD2 3.88Å; L311-L326 HydrophobicContact CD2-CD2 4.31Å; S322-L326 PolarHBondContact O-N 3.41Å; A323-L326 WeakPolarHBondContact O-CB 3.43Å; A323-L326 PolarHBondContact O-N 3.43Å; L326-F329 HydrophobicContact CD1-CD1 4.4Å; L326-F329 PolarHBondContact O-N 2.67Å; L326-C330 VanDerWaalsContact O-CB 3.28Å; L326-C330 WeakPolarHBondContact O-CB 3.41Å; L326-C330 PolarHBondContact O-N 2.98Å; L326-C330 PolarHBondContact O-SG 3.5Å; L326-L346 HydrophobicContact CD2-CB 4.5Å; L326-L346 HydrophobicContact CD2-CD1 3.86Å; L326-L362 HydrophobicContact CD2-CD2 4.2Å
327	K	98.4	Very high	96.8	Very high	73 Å²	73	44.3 Å²	44.3	32%	0.317	23%	0.227	S	C	.	.	H	α-helix	trans	-57.8	-56.4	178.1	175.1	-166.2	166.4	-174.9	0	110.7	Q325 F329 C330 L331 C365 G368 L369	Q325-K327 VanDerWaalsContact C-N 3.34Å; Q325-K327 PolarHBondContact O-N 3.32Å; K327-F329 VanDerWaalsContact C-N 3.29Å; K327-F329 PolarHBondContact O-N 3.17Å; K327-C330 VanDerWaalsContact O-CB 3.28Å; K327-C330 WeakPolarHBondContact O-CB 3.27Å; K327-C330 PolarHBondContact O-N 2.8Å; K327-L331 HydrophobicContact CG-CD1 4.46Å; K327-L331 WeakPolarHBondContact O-CG 3.37Å; K327-L331 PolarHBondContact O-N 2.95Å; K327-C365 HydrophobicContact CB-CB 4.48Å; K327-C365 PolarHBondContact N-SG 3.48Å; K327-G368 VanDerWaalsContact CE-O 3.23Å; K327-G368 WeakPolarHBondContact CE-O 3.5Å; K327-L369 HydrophobicContact CB-CD2 4.5Å; K327-L369 HydrophobicContact CB-CG 4.46Å; K327-L369 HydrophobicContact CG-CD2 3.87Å; K327-L369 HydrophobicContact CG-CG 4.03Å
328	D	98.1	Very high	96.7	Very high	81 Å²	81	41.6 Å²	41.6	43%	0.433	22%	0.215	S	C	.	.	H	α-helix	trans	-72.4	-30.3	-175	-64.7	-26.3	0	0	0	110.7	T287 Q325 L331 A332	T287-D328 HydrophobicContact CG2-CB 3.6Å; Q325-D328 PolarHBondContact O-N 3.37Å; D328-L331 PolarHBondContact O-N 2.76Å; D328-A332 WeakPolarHBondContact O-CB 3.47Å; D328-A332 PolarHBondContact O-N 3.26Å
329	F	98.3	Very high	96.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-42.5	170.4	-177.8	-91.1	0	0	0	112.3	I286 Q290 L303 H304 M307 Q325 L326 K327 A332 S333 L342	I286-F329 HydrophobicContact CD1-CE2 4.23Å; I286-F329 HydrophobicContact CG1-CD2 4.15Å; I286-F329 HydrophobicContact CG1-CE2 3.81Å; I286-F329 HydrophobicContact CG2-CD2 4.29Å; Q290-F329 HydrophobicContact CB-CD2 3.61Å; Q290-F329 HydrophobicContact CB-CE2 3.52Å; Q290-F329 HydrophobicContact CB-CZ 4.48Å; Q290-F329 HydrophobicContact CG-CD2 3.83Å; Q290-F329 HydrophobicContact CG-CE2 3.67Å; Q290-F329 HydrophobicContact CG-CG 4.48Å; Q290-F329 HydrophobicContact CG-CZ 4.2Å; L303-F329 HydrophobicContact CB-CE2 4.37Å; L303-F329 HydrophobicContact CB-CZ 4.45Å; L303-F329 WeakPolarHBondContact O-CZ 3.27Å; H304-F329 AromaticContact CD2-CE1 3.66Å; H304-F329 AromaticContact CD2-CZ 3.66Å; M307-F329 HydrophobicContact CB-CD1 4.23Å; M307-F329 HydrophobicContact CB-CE1 3.66Å; M307-F329 HydrophobicContact CB-CE2 4.22Å; M307-F329 HydrophobicContact CB-CZ 3.68Å; M307-F329 HydrophobicContact CE-CB 3.67Å; M307-F329 HydrophobicContact CE-CD1 3.88Å; M307-F329 HydrophobicContact CE-CD2 3.71Å; M307-F329 HydrophobicContact CE-CE1 4.45Å; M307-F329 HydrophobicContact CE-CE2 4.32Å; M307-F329 HydrophobicContact CE-CG 3.47Å; M307-F329 VanDerWaalsContact CE-CG 3.47Å; M307-F329 HydrophobicContact CG-CD1 3.89Å; M307-F329 HydrophobicContact CG-CE1 3.79Å; M307-F329 HydrophobicContact CG-CG 4.43Å; M307-F329 HydrophobicContact CG-CZ 4.27Å; Q325-F329 WeakPolarHBondContact O-CB 3.45Å; Q325-F329 PolarHBondContact O-N 2.66Å; L326-F329 HydrophobicContact CD1-CD1 4.4Å; L326-F329 PolarHBondContact O-N 2.67Å; K327-F329 VanDerWaalsContact C-N 3.29Å; K327-F329 PolarHBondContact O-N 3.17Å; F329-A332 PolarHBondContact O-N 3.32Å; F329-S333 PolarHBondContact O-N 2.9Å; F329-S333 PolarHBondContact O-OG 2.83Å; F329-L342 HydrophobicContact CD1-CD1 4.34Å; F329-L342 HydrophobicContact CE1-CD1 4.27Å; F329-L342 HydrophobicContact CE1-CD2 4.28Å
330	C	97.4	Very high	96.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-43.6	172.6	-82.7	0	0	0	0	111.7	L326 K327 S333 L338 L342 L369	L326-C330 VanDerWaalsContact O-CB 3.28Å; L326-C330 WeakPolarHBondContact O-CB 3.41Å; L326-C330 PolarHBondContact O-N 2.98Å; L326-C330 PolarHBondContact O-SG 3.5Å; K327-C330 VanDerWaalsContact O-CB 3.28Å; K327-C330 WeakPolarHBondContact O-CB 3.27Å; K327-C330 PolarHBondContact O-N 2.8Å; C330-S333 WeakPolarHBondContact O-CB 3.26Å; C330-S333 PolarHBondContact O-N 2.75Å; C330-L338 HydrophobicContact CB-CD1 3.56Å; C330-L342 HydrophobicContact CB-CD1 4.46Å; C330-L369 HydrophobicContact CB-CD1 4.18Å; C330-L369 HydrophobicContact CB-CD2 3.89Å
331	L	96	Very high	96.3	Very high	75 Å²	75	45.5 Å²	45.5	39%	0.393	25%	0.25	S	S	.	.	H	α-helix	trans	-72	-28	179.4	-63.5	179	0	0	0	113.3	K327 D328 S333 L369	K327-L331 HydrophobicContact CG-CD1 4.46Å; K327-L331 WeakPolarHBondContact O-CG 3.37Å; K327-L331 PolarHBondContact O-N 2.95Å; D328-L331 PolarHBondContact O-N 2.76Å; L331-S333 VanDerWaalsContact C-N 3.25Å; L331-L369 HydrophobicContact CD2-CD2 3.91Å; L331-L369 HydrophobicContact CG-CD2 3.99Å
332	A	94.8	Very high	96.2	Very high	23 Å²	23	44.1 Å²	44.1	19%	0.19	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-9.1	172.3	0	0	0	0	0	113.3	Q290 C294 D328 F329	Q290-A332 HydrophobicContact CB-CB 4.45Å; Q290-A332 HydrophobicContact CG-CB 3.9Å; C294-A332 PolarHBondContact SG-O 3.46Å; D328-A332 WeakPolarHBondContact O-CB 3.47Å; D328-A332 PolarHBondContact O-N 3.26Å; F329-A332 PolarHBondContact O-N 3.32Å
333	S	95.5	Very high	96.1	Very high	11 Å²	11	44.7 Å²	44.7	8%	0.077	25%	0.246	C	C	.	.	S	Bend	trans	-91.6	154.5	-177	-67.4	0	0	0	0	112.7	H304 F329 C330 L331	H304-S333 PolarHBondContact NE2-OG 3.11Å; F329-S333 PolarHBondContact O-N 2.9Å; F329-S333 PolarHBondContact O-OG 2.83Å; C330-S333 WeakPolarHBondContact O-CB 3.26Å; C330-S333 PolarHBondContact O-N 2.75Å; L331-S333 VanDerWaalsContact C-N 3.25Å
334	P	92.7	Very high	96	Very high	47 Å²	47	47.9 Å²	47.9	31%	0.305	27%	0.267	S	S	.	.			trans	-54.6	141.1	171.2	-26.1	36	0	0	0	112.3	D336 I337 L338	P334-D336 VanDerWaalsContact C-N 3.27Å; P334-D336 WeakPolarHBondContact CB-OD1 3.46Å; P334-D336 PolarHBondContact O-N 2.93Å; P334-I337 HydrophobicContact CB-CG1 4.23Å; P334-I337 HydrophobicContact CG-CG1 4.49Å; P334-I337 PolarHBondContact O-N 3.27Å; P334-I337 VanDerWaalsContact O-N 3.12Å; P334-L338 PolarHBondContact O-N 3.36Å
335	K	91.6	Very high	96	Very high	180 Å²	180	49 Å²	49	78%	0.783	26%	0.26	S	S	*	.	H	α-helix	trans	-60.4	-35.1	-173.9	-70.4	-174.9	177.8	-179.9	0	113.3	V339	K335-V339 WeakPolarHBondContact O-CG2 3.26Å; K335-V339 PolarHBondContact O-N 3.15Å; K335-V339 VanDerWaalsContact O-N 3.15Å
336	D	92.7	Very high	96	Very high	98 Å²	98	46.8 Å²	46.8	52%	0.524	25%	0.25	S	C	.	.	H	α-helix	trans	-64.3	-46.1	176.4	63	-58.8	0	0	0	111	P334 V339 T340	P334-D336 VanDerWaalsContact C-N 3.27Å; P334-D336 WeakPolarHBondContact CB-OD1 3.46Å; P334-D336 PolarHBondContact O-N 2.93Å; D336-V339 PolarHBondContact O-N 3.44Å; D336-T340 VanDerWaalsContact O-CB 3.3Å; D336-T340 WeakPolarHBondContact O-CB 3.46Å; D336-T340 VanDerWaalsContact O-CG2 3.31Å; D336-T340 WeakPolarHBondContact O-CG2 3.32Å; D336-T340 PolarHBondContact O-N 2.97Å; D336-T340 PolarHBondContact O-OG1 3.03Å
337	I	93.9	Very high	95.9	Very high	41 Å²	41	52.4 Å²	52.4	21%	0.21	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-40.2	177.6	-58.4	-60.2	0	0	0	111.5	P334 V339 V341 L342	P334-I337 HydrophobicContact CB-CG1 4.23Å; P334-I337 HydrophobicContact CG-CG1 4.49Å; P334-I337 PolarHBondContact O-N 3.27Å; P334-I337 VanDerWaalsContact O-N 3.12Å; I337-V339 PolarHBondContact O-N 3.5Å; I337-V341 HydrophobicContact CG2-CB 4.17Å; I337-V341 HydrophobicContact CG2-CG2 4.37Å; I337-V341 WeakPolarHBondContact O-CA 3.44Å; I337-V341 WeakPolarHBondContact O-CB 3.28Å; I337-V341 PolarHBondContact O-N 3.48Å; I337-L342 HydrophobicContact CG2-CD1 4.47Å; I337-L342 HydrophobicContact CG2-CG 4.25Å; I337-L342 PolarHBondContact O-N 3.09Å
338	L	94.8	Very high	95.8	Very high	15 Å²	15	52.7 Å²	52.7	8%	0.079	27%	0.273	C	S	.	.	I	π-helix	trans	-52.6	-55	174.7	173.4	58.7	0	0	0	110.7	C330 P334 L342 L343 I373	C330-L338 HydrophobicContact CB-CD1 3.56Å; P334-L338 PolarHBondContact O-N 3.36Å; L338-L342 HydrophobicContact CD1-CB 4.34Å; L338-L342 PolarHBondContact O-N 3.16Å; L338-L343 HydrophobicContact CD1-CD2 3.93Å; L338-L343 HydrophobicContact CD1-CG 3.97Å; L338-L343 HydrophobicContact CG-CG 4.32Å; L338-L343 WeakPolarHBondContact O-CG 3.43Å; L338-L343 PolarHBondContact O-N 3.09Å; L338-I373 HydrophobicContact CD2-CG2 4.15Å
339	V	95.3	Very high	95.8	Very high	44 Å²	44	49.5 Å²	49.5	27%	0.267	26%	0.255	S	S	.	.	I	π-helix	trans	-73.2	-42.9	-175.2	175.7	0	0	0	0	112.2	K335 D336 I337 P344	K335-V339 WeakPolarHBondContact O-CG2 3.26Å; K335-V339 PolarHBondContact O-N 3.15Å; K335-V339 VanDerWaalsContact O-N 3.15Å; D336-V339 PolarHBondContact O-N 3.44Å; I337-V339 PolarHBondContact O-N 3.5Å; V339-P344 VanDerWaalsContact O-CD 3.27Å; V339-P344 WeakPolarHBondContact O-CD 3.42Å
340	T	95.1	Very high	95.6	Very high	93 Å²	93	49.5 Å²	49.5	57%	0.571	26%	0.255	S	S	*	.	I	π-helix	trans	-85.6	-22.7	-171.1	60.5	0	0	0	0	114.1	D336	D336-T340 VanDerWaalsContact O-CB 3.3Å; D336-T340 WeakPolarHBondContact O-CB 3.46Å; D336-T340 VanDerWaalsContact O-CG2 3.31Å; D336-T340 WeakPolarHBondContact O-CG2 3.32Å; D336-T340 PolarHBondContact O-N 2.97Å; D336-T340 PolarHBondContact O-OG1 3.03Å
341	V	95.8	Very high	95.3	Very high	51 Å²	51	51.8 Å²	51.8	31%	0.309	27%	0.271	S	S	.	.	I	π-helix	trans	-124.2	-59	-175.1	-175.8	0	0	0	0	111.5	I337 P344 R345	I337-V341 HydrophobicContact CG2-CB 4.17Å; I337-V341 HydrophobicContact CG2-CG2 4.37Å; I337-V341 WeakPolarHBondContact O-CA 3.44Å; I337-V341 WeakPolarHBondContact O-CB 3.28Å; I337-V341 PolarHBondContact O-N 3.48Å; V341-P344 WeakPolarHBondContact O-CD 3.44Å; V341-R345 WeakPolarHBondContact O-CB 3.37Å; V341-R345 WeakPolarHBondContact O-CG 3.3Å; V341-R345 PolarHBondContact O-N 2.82Å; V341-R345 VanDerWaalsContact O-N 3.1Å
342	L	97.3	Very high	95.2	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.021	28%	0.282	C	S	.	.	I	π-helix	trans	-70.9	-43.7	-167	-60	177.5	0	0	0	112.9	F329 C330 I337 L338 R345 L346	F329-L342 HydrophobicContact CD1-CD1 4.34Å; F329-L342 HydrophobicContact CE1-CD1 4.27Å; F329-L342 HydrophobicContact CE1-CD2 4.28Å; C330-L342 HydrophobicContact CB-CD1 4.46Å; I337-L342 HydrophobicContact CG2-CD1 4.47Å; I337-L342 HydrophobicContact CG2-CG 4.25Å; I337-L342 PolarHBondContact O-N 3.09Å; L338-L342 HydrophobicContact CD1-CB 4.34Å; L338-L342 PolarHBondContact O-N 3.16Å; L342-R345 PolarHBondContact O-N 3.35Å; L342-L346 WeakPolarHBondContact O-CB 3.42Å; L342-L346 PolarHBondContact O-N 3.44Å
343	L	97.4	Very high	95.2	Very high	12 Å²	12	53.9 Å²	53.9	6%	0.063	28%	0.277	C	S	.	.	H	α-helix	trans	-64.3	-45.9	177.9	-65	-176.1	0	0	0	112.8	L338 R345 L346 R347 L369 I373 D377 L381	L338-L343 HydrophobicContact CD1-CD2 3.93Å; L338-L343 HydrophobicContact CD1-CG 3.97Å; L338-L343 HydrophobicContact CG-CG 4.32Å; L338-L343 WeakPolarHBondContact O-CG 3.43Å; L338-L343 PolarHBondContact O-N 3.09Å; L343-R345 VanDerWaalsContact C-N 3.33Å; L343-R345 PolarHBondContact O-N 3.34Å; L343-L346 PolarHBondContact O-N 3.24Å; L343-R347 PolarHBondContact O-N 3.07Å; L343-L369 HydrophobicContact CD2-CD1 4.09Å; L343-I373 HydrophobicContact CD1-CD1 4.08Å; L343-I373 HydrophobicContact CD1-CG2 4.44Å; L343-I373 HydrophobicContact CD2-CD1 4.45Å; L343-D377 HydrophobicContact CD1-CB 3.88Å; L343-L381 HydrophobicContact CD2-CD1 4.22Å
344	P	97.1	Very high	95.1	Very high	67 Å²	67	64.5 Å²	64.5	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-55.5	-44.7	171.2	-28.9	35.4	0	0	0	113.3	V339 V341 R347 E348	V339-P344 VanDerWaalsContact O-CD 3.27Å; V339-P344 WeakPolarHBondContact O-CD 3.42Å; V341-P344 WeakPolarHBondContact O-CD 3.44Å; P344-R347 WeakPolarHBondContact O-CB 3.31Å; P344-R347 PolarHBondContact O-N 3.23Å; P344-E348 PolarHBondContact O-N 2.82Å
345	R	97.1	Very high	95.1	Very high	62 Å²	62	65.2 Å²	65.2	23%	0.234	31%	0.314	C	S	.	.	H	α-helix	trans	-69.2	-37.8	-180	-65.8	-67.9	-76.6	167	-1.9	112.3	L308 E312 V341 L342 L343 R347 E348 H349	L308-R345 HydrophobicContact CD1-CG 4.29Å; L308-R345 HydrophobicContact CD2-CB 3.66Å; L308-R345 HydrophobicContact CD2-CG 3.9Å; E312-R345 IonicContact OE1-CZ 3.9Å; E312-R345 IonicContact OE1-NH2 3.05Å; E312-R345 PolarHBondContact OE1-NH2 2.85Å; V341-R345 WeakPolarHBondContact O-CB 3.37Å; V341-R345 WeakPolarHBondContact O-CG 3.3Å; V341-R345 PolarHBondContact O-N 2.82Å; V341-R345 VanDerWaalsContact O-N 3.1Å; L342-R345 PolarHBondContact O-N 3.35Å; L343-R345 VanDerWaalsContact C-N 3.33Å; L343-R345 PolarHBondContact O-N 3.34Å; R345-R347 VanDerWaalsContact C-N 3.3Å; R345-R347 PolarHBondContact O-N 3.38Å; R345-E348 WeakPolarHBondContact CD-OE2 3.46Å; R345-E348 IonicContact CZ-OE2 3.75Å; R345-E348 IonicContact NE-OE2 3.63Å; R345-E348 IonicContact NH1-OE1 2.72Å; R345-E348 PolarHBondContact NH1-OE1 3.34Å; R345-E348 IonicContact NH1-OE2 2.85Å; R345-E348 PolarHBondContact NH1-OE2 3.29Å; R345-E348 WeakPolarHBondContact O-CB 3.46Å; R345-E348 PolarHBondContact O-N 3.21Å; R345-H349 PolarHBondContact O-N 3.2Å; R345-H349 PolarHBondContact O-ND1 3.04Å
346	L	98.2	Very high	95.1	Very high	2 Å²	2	61 Å²	61	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-57.7	-43.9	171.2	170.2	57.6	0	0	0	111.1	L326 L342 L343 E348 H349 L350 L362 A366 L369 L381	L326-L346 HydrophobicContact CD2-CB 4.5Å; L326-L346 HydrophobicContact CD2-CD1 3.86Å; L342-L346 WeakPolarHBondContact O-CB 3.42Å; L342-L346 PolarHBondContact O-N 3.44Å; L343-L346 PolarHBondContact O-N 3.24Å; L346-E348 VanDerWaalsContact C-N 3.33Å; L346-E348 PolarHBondContact O-N 3.46Å; L346-H349 PolarHBondContact O-N 3.46Å; L346-L350 HydrophobicContact CD1-CD1 4.45Å; L346-L350 HydrophobicContact CD1-CG 4.31Å; L346-L350 HydrophobicContact CG-CD1 4.44Å; L346-L350 WeakPolarHBondContact O-CG 3.42Å; L346-L350 PolarHBondContact O-N 3.12Å; L346-L362 HydrophobicContact CD1-CD2 3.99Å; L346-A366 HydrophobicContact CD2-CB 3.98Å; L346-A366 HydrophobicContact CG-CB 4.44Å; L346-L369 HydrophobicContact CD2-CD1 3.85Å; L346-L381 HydrophobicContact CD2-CD2 4.4Å; L346-L381 HydrophobicContact CG-CD2 4.4Å
347	R	96.7	Very high	95.1	Very high	121 Å²	121	62.3 Å²	62.3	46%	0.457	30%	0.295	S	S	.	.	H	α-helix	trans	-63.4	-39.7	177.1	-160.9	-176.1	92.6	-177.5	7.4	112.4	L343 P344 R345 S351 L381 H384	L343-R347 PolarHBondContact O-N 3.07Å; P344-R347 WeakPolarHBondContact O-CB 3.31Å; P344-R347 PolarHBondContact O-N 3.23Å; R345-R347 VanDerWaalsContact C-N 3.3Å; R345-R347 PolarHBondContact O-N 3.38Å; R347-S351 PolarHBondContact O-N 2.87Å; R347-L381 HydrophobicContact CB-CD2 4.19Å; R347-L381 HydrophobicContact CG-CD2 4.49Å; R347-H384 HydrophobicContact CG-CB 4.11Å
348	E	96.3	Very high	95.2	Very high	79 Å²	79	60.4 Å²	60.4	37%	0.369	29%	0.285	S	S	.	.	H	α-helix	trans	-62.9	-47.1	174.8	-173.3	-178.6	167.7	0	0	111.5	P344 R345 L346 L350 S351 M352	P344-E348 PolarHBondContact O-N 2.82Å; R345-E348 WeakPolarHBondContact CD-OE2 3.46Å; R345-E348 IonicContact CZ-OE2 3.75Å; R345-E348 IonicContact NE-OE2 3.63Å; R345-E348 IonicContact NH1-OE1 2.72Å; R345-E348 PolarHBondContact NH1-OE1 3.34Å; R345-E348 IonicContact NH1-OE2 2.85Å; R345-E348 PolarHBondContact NH1-OE2 3.29Å; R345-E348 WeakPolarHBondContact O-CB 3.46Å; R345-E348 PolarHBondContact O-N 3.21Å; L346-E348 VanDerWaalsContact C-N 3.33Å; L346-E348 PolarHBondContact O-N 3.46Å; E348-L350 VanDerWaalsContact C-N 3.34Å; E348-L350 PolarHBondContact O-N 3.17Å; E348-S351 WeakPolarHBondContact O-CA 3.47Å; E348-S351 WeakPolarHBondContact O-CB 3.47Å; E348-S351 PolarHBondContact O-N 3.13Å; E348-S351 PolarHBondContact O-OG 3.28Å; E348-M352 HydrophobicContact CG-CG 4.34Å; E348-M352 WeakPolarHBondContact O-CG 3.41Å; E348-M352 PolarHBondContact O-N 3Å
349	H	96.9	Very high	95.2	Very high	14 Å²	14	61 Å²	61	7%	0.065	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-36.9	178.7	-74.7	78.7	0	0	0	112.6	L311 E312 R345 L346 S351 M352 E353 L362	L311-H349 WeakPolarHBondContact CB-NE2 3.31Å; E312-H349 WeakPolarHBondContact CG-NE2 3.41Å; E312-H349 IonicContact OE1-CE1 2.97Å; E312-H349 IonicContact OE1-NE2 3.29Å; R345-H349 PolarHBondContact O-N 3.2Å; R345-H349 PolarHBondContact O-ND1 3.04Å; L346-H349 PolarHBondContact O-N 3.46Å; H349-S351 PolarHBondContact O-N 2.6Å; H349-M352 PolarHBondContact O-N 3.36Å; H349-E353 VanDerWaalsContact O-CB 3.27Å; H349-E353 WeakPolarHBondContact O-CB 3.46Å; H349-E353 PolarHBondContact O-N 3.11Å; H349-L362 HydrophobicContact CB-CD1 4Å; H349-L362 HydrophobicContact CB-CD2 4.42Å
350	L	96	Very high	95.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-55.7	-31.5	170.8	-80.3	169.5	0	0	0	112.3	L346 E348 R359 L362 V363 A366 L381 I385 F388	L346-L350 HydrophobicContact CD1-CD1 4.45Å; L346-L350 HydrophobicContact CD1-CG 4.31Å; L346-L350 HydrophobicContact CG-CD1 4.44Å; L346-L350 WeakPolarHBondContact O-CG 3.42Å; L346-L350 PolarHBondContact O-N 3.12Å; E348-L350 VanDerWaalsContact C-N 3.34Å; E348-L350 PolarHBondContact O-N 3.17Å; L350-R359 PolarHBondContact O-NH1 3.26Å; L350-R359 PolarHBondContact O-NH2 3.06Å; L350-L362 HydrophobicContact CD2-CB 3.7Å; L350-L362 HydrophobicContact CG-CB 4.33Å; L350-V363 HydrophobicContact CD2-CG2 3.76Å; L350-A366 HydrophobicContact CD1-CB 4.06Å; L350-L381 HydrophobicContact CD1-CD2 4.42Å; L350-I385 HydrophobicContact CD1-CG1 4.36Å; L350-F388 HydrophobicContact CB-CZ 4.36Å; L350-F388 HydrophobicContact CD2-CE2 4.48Å; L350-F388 HydrophobicContact CD2-CZ 4.38Å
351	S	91.1	Very high	95.1	Very high	48 Å²	48	57.4 Å²	57.4	34%	0.336	26%	0.261	S	S	.	.	H	α-helix	trans	-82.8	-42.8	177.8	74.5	0	0	0	0	112.9	R347 E348 H349 R359	R347-S351 PolarHBondContact O-N 2.87Å; E348-S351 WeakPolarHBondContact O-CA 3.47Å; E348-S351 WeakPolarHBondContact O-CB 3.47Å; E348-S351 PolarHBondContact O-N 3.13Å; E348-S351 PolarHBondContact O-OG 3.28Å; H349-S351 PolarHBondContact O-N 2.6Å; S351-R359 PolarHBondContact O-NH1 2.85Å
352	M	92.9	Very high	95.3	Very high	126 Å²	126	55 Å²	55	62%	0.621	25%	0.247	S	C	*	.	H	α-helix	trans	-83.6	-28.3	-169.9	-63.6	-60.5	160.5	0	0	113.7	E348 H349 R354	E348-M352 HydrophobicContact CG-CG 4.34Å; E348-M352 WeakPolarHBondContact O-CG 3.41Å; E348-M352 PolarHBondContact O-N 3Å; H349-M352 PolarHBondContact O-N 3.36Å; M352-R354 PolarHBondContact O-N 2.62Å
353	E	94.9	Very high	95.3	Very high	16 Å²	16	54.9 Å²	54.9	8%	0.075	25%	0.246	C	C	.	.			trans	-65.7	127.8	-175.4	-177.8	55.7	-102.5	0	0	111.6	R319 H349 E355 V358 R359 L362	R319-E353 IonicContact CZ-OE1 2.68Å; R319-E353 IonicContact CZ-OE2 3.12Å; R319-E353 IonicContact NE-OE1 2.8Å; R319-E353 IonicContact NE-OE2 2.74Å; R319-E353 PolarHBondContact NE-OE2 3.43Å; R319-E353 IonicContact NH2-OE1 3.52Å; R319-E353 PolarHBondContact NH2-OE1 3Å; R319-E353 VanDerWaalsContact NH2-OE1 3.13Å; R319-E353 IonicContact NH2-OE2 2.79Å; H349-E353 VanDerWaalsContact O-CB 3.27Å; H349-E353 WeakPolarHBondContact O-CB 3.46Å; H349-E353 PolarHBondContact O-N 3.11Å; E353-E355 WeakPolarHBondContact OE1-CB 3.2Å; E353-E355 PolarHBondContact OE1-N 2.96Å; E353-V358 HydrophobicContact CG-CB 3.7Å; E353-V358 HydrophobicContact CG-CG1 3.78Å; E353-V358 VanDerWaalsContact OE2-CG1 3.27Å; E353-V358 WeakPolarHBondContact OE2-CG1 3.47Å; E353-R359 HydrophobicContact CG-CB 4.18Å; E353-R359 PolarHBondContact O-NH1 3.06Å; E353-L362 HydrophobicContact CB-CD1 3.84Å; E353-L362 HydrophobicContact CG-CD1 4.15Å
354	R	92.8	Very high	95.3	Very high	234 Å²	234	61.2 Å²	61.2	88%	0.883	27%	0.269	S	S	*	.			trans	-103	-26.1	-175.4	-61.1	-175.7	-176.8	137.2	2	112.5	M352 E356	M352-R354 PolarHBondContact O-N 2.62Å; R354-E356 PolarHBondContact O-N 3.41Å
355	E	93.7	Very high	95.3	Very high	63 Å²	63	58.3 Å²	58.3	29%	0.294	25%	0.25	S	S	.	.			trans	-77.9	121.6	177.8	-179.1	60.4	-146.6	0	0	110.2	V316 E353 R357 V358 R359	V316-E355 HydrophobicContact CG1-CB 4.42Å; V316-E355 HydrophobicContact CG1-CG 3.69Å; E353-E355 WeakPolarHBondContact OE1-CB 3.2Å; E353-E355 PolarHBondContact OE1-N 2.96Å; E355-R357 VanDerWaalsContact C-N 3.32Å; E355-R357 HydrophobicContact CG-CB 4.48Å; E355-R357 PolarHBondContact O-N 3.38Å; E355-V358 HydrophobicContact CB-CB 4.24Å; E355-V358 HydrophobicContact CB-CG2 3.9Å; E355-V358 HydrophobicContact CG-CB 4.49Å; E355-V358 HydrophobicContact CG-CG2 3.85Å; E355-V358 PolarHBondContact O-N 3.19Å; E355-V358 VanDerWaalsContact O-N 3.17Å; E355-R359 WeakPolarHBondContact O-CB 3.4Å; E355-R359 PolarHBondContact O-N 2.96Å
356	E	91.9	Very high	95.4	Very high	90 Å²	90	55.3 Å²	55.3	42%	0.421	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-40.2	-174.8	-68.2	-172.6	158.9	0	0	112.5	R354 R359 S360 Q395 Y399	R354-E356 PolarHBondContact O-N 3.41Å; E356-R359 PolarHBondContact O-N 2.92Å; E356-S360 WeakPolarHBondContact O-CB 3.32Å; E356-S360 PolarHBondContact O-N 3.32Å; E356-Q395 HydrophobicContact CB-CG 4.34Å; E356-Q395 HydrophobicContact CG-CG 4.15Å; E356-Q395 WeakPolarHBondContact OE1-CB 3.33Å; E356-Y399 VanDerWaalsContact C-OH 3.28Å; E356-Y399 VanDerWaalsContact CA-OH 3.26Å; E356-Y399 WeakPolarHBondContact CA-OH 3.46Å; E356-Y399 VanDerWaalsContact CB-OH 3.26Å; E356-Y399 WeakPolarHBondContact CB-OH 3.39Å; E356-Y399 PolarHBondContact O-OH 2.92Å
357	R	91.3	Very high	95.4	Very high	127 Å²	127	55.8 Å²	55.8	48%	0.479	24%	0.242	S	C	.	.	H	α-helix	trans	-65.6	-40.9	178.1	-69.3	-172.9	174.9	84.5	3.8	112.4	E355 S360 E361 L622 D624	E355-R357 VanDerWaalsContact C-N 3.32Å; E355-R357 HydrophobicContact CG-CB 4.48Å; E355-R357 PolarHBondContact O-N 3.38Å; R357-S360 WeakPolarHBondContact O-CB 3.36Å; R357-S360 PolarHBondContact O-N 3.46Å; R357-E361 PolarHBondContact O-N 3.22Å; R357-L622 HydrophobicContact CG-CD2 4.38Å; R357-D624 IonicContact NH2-OD1 3.23Å
358	V	96.2	Very high	95.4	Very high	1 Å²	1	51 Å²	51	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-69.8	-42.6	178.2	-173.9	0	0	0	0	110.3	V316 R319 R320 A323 E353 E355 S360 E361 L362	V316-V358 HydrophobicContact CG1-CG2 4.13Å; R319-V358 HydrophobicContact CB-CG1 3.97Å; R319-V358 HydrophobicContact CB-CG2 4.24Å; R320-V358 HydrophobicContact CB-CG2 3.99Å; A323-V358 HydrophobicContact CB-CG1 4.25Å; E353-V358 HydrophobicContact CG-CB 3.7Å; E353-V358 HydrophobicContact CG-CG1 3.78Å; E353-V358 VanDerWaalsContact OE2-CG1 3.27Å; E353-V358 WeakPolarHBondContact OE2-CG1 3.47Å; E355-V358 HydrophobicContact CB-CB 4.24Å; E355-V358 HydrophobicContact CB-CG2 3.9Å; E355-V358 HydrophobicContact CG-CB 4.49Å; E355-V358 HydrophobicContact CG-CG2 3.85Å; E355-V358 PolarHBondContact O-N 3.19Å; E355-V358 VanDerWaalsContact O-N 3.17Å; V358-S360 VanDerWaalsContact C-N 3.28Å; V358-S360 PolarHBondContact O-N 3.37Å; V358-E361 PolarHBondContact O-N 3.03Å; V358-E361 VanDerWaalsContact O-N 3.15Å; V358-L362 HydrophobicContact CG1-CD1 4.42Å; V358-L362 WeakPolarHBondContact O-CG 3.47Å; V358-L362 PolarHBondContact O-N 3.33Å
359	R	94.6	Very high	95.5	Very high	28 Å²	28	47.3 Å²	47.3	11%	0.106	21%	0.213	C	C	.	.	H	α-helix	trans	-59.8	-39.6	176.2	-165.2	175.6	-171.9	107.4	-5.6	111.9	L350 S351 E353 E355 E356 L362 V363 D391 Y399	L350-R359 PolarHBondContact O-NH1 3.26Å; L350-R359 PolarHBondContact O-NH2 3.06Å; S351-R359 PolarHBondContact O-NH1 2.85Å; E353-R359 HydrophobicContact CG-CB 4.18Å; E353-R359 PolarHBondContact O-NH1 3.06Å; E355-R359 WeakPolarHBondContact O-CB 3.4Å; E355-R359 PolarHBondContact O-N 2.96Å; E356-R359 PolarHBondContact O-N 2.92Å; R359-L362 PolarHBondContact O-N 3.1Å; R359-V363 WeakPolarHBondContact O-CG2 3.15Å; R359-V363 PolarHBondContact O-N 3.42Å; R359-D391 IonicContact NH2-OD2 2.85Å; R359-Y399 HydrophobicContact CB-CE2 4.43Å; R359-Y399 HydrophobicContact CG-CE2 4.25Å
360	S	93.5	Very high	95.6	Very high	11 Å²	11	47.2 Å²	47.2	8%	0.077	21%	0.213	C	C	.	.	H	α-helix	trans	-58.6	-46.4	174.2	-161.6	0	0	0	0	112	E356 R357 V358 L362 V363 R364	E356-S360 WeakPolarHBondContact O-CB 3.32Å; E356-S360 PolarHBondContact O-N 3.32Å; R357-S360 WeakPolarHBondContact O-CB 3.36Å; R357-S360 PolarHBondContact O-N 3.46Å; V358-S360 VanDerWaalsContact C-N 3.28Å; V358-S360 PolarHBondContact O-N 3.37Å; S360-L362 PolarHBondContact O-N 2.93Å; S360-V363 PolarHBondContact O-N 2.63Å; S360-R364 WeakPolarHBondContact O-CB 3.07Å; S360-R364 PolarHBondContact O-N 2.98Å
361	E	96.3	Very high	95.6	Very high	49 Å²	49	52.7 Å²	52.7	23%	0.229	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-37.4	177	-66.7	-65.3	176.5	0	0	112.2	R320 A323 R357 V358 R364 C365	R320-E361 HydrophobicContact CG-CG 4.06Å; R320-E361 IonicContact NH1-OE1 2.83Å; A323-E361 HydrophobicContact CB-CB 3.74Å; R357-E361 PolarHBondContact O-N 3.22Å; V358-E361 PolarHBondContact O-N 3.03Å; V358-E361 VanDerWaalsContact O-N 3.15Å; E361-R364 PolarHBondContact O-N 2.83Å; E361-C365 WeakPolarHBondContact O-CB 3.5Å; E361-C365 PolarHBondContact O-N 3.42Å
362	L	98.2	Very high	95.8	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-40.7	174.8	-69.6	171.2	0	0	0	112.2	L311 A323 L326 L346 H349 L350 E353 V358 R359 S360 C365 A366	L311-L362 HydrophobicContact CD2-CD2 4.3Å; A323-L362 HydrophobicContact CB-CD2 3.76Å; A323-L362 HydrophobicContact CB-CG 3.94Å; L326-L362 HydrophobicContact CD2-CD2 4.2Å; L346-L362 HydrophobicContact CD1-CD2 3.99Å; H349-L362 HydrophobicContact CB-CD1 4Å; H349-L362 HydrophobicContact CB-CD2 4.42Å; L350-L362 HydrophobicContact CD2-CB 3.7Å; L350-L362 HydrophobicContact CG-CB 4.33Å; E353-L362 HydrophobicContact CB-CD1 3.84Å; E353-L362 HydrophobicContact CG-CD1 4.15Å; V358-L362 HydrophobicContact CG1-CD1 4.42Å; V358-L362 WeakPolarHBondContact O-CG 3.47Å; V358-L362 PolarHBondContact O-N 3.33Å; R359-L362 PolarHBondContact O-N 3.1Å; S360-L362 PolarHBondContact O-N 2.93Å; L362-C365 WeakPolarHBondContact O-CB 3.46Å; L362-C365 PolarHBondContact O-N 3.22Å; L362-A366 WeakPolarHBondContact O-CB 3.39Å; L362-A366 PolarHBondContact O-N 3.06Å
363	V	98	Very high	95.9	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-47.4	174.1	174.7	0	0	0	0	110	L350 R359 S360 C365 A366 V367 I385 F388 Y399	L350-V363 HydrophobicContact CD2-CG2 3.76Å; R359-V363 WeakPolarHBondContact O-CG2 3.15Å; R359-V363 PolarHBondContact O-N 3.42Å; S360-V363 PolarHBondContact O-N 2.63Å; V363-C365 VanDerWaalsContact C-N 3.29Å; V363-C365 PolarHBondContact O-N 3.35Å; V363-A366 PolarHBondContact O-N 2.93Å; V363-V367 HydrophobicContact CG1-CG2 4.18Å; V363-V367 WeakPolarHBondContact O-CB 3.38Å; V363-V367 WeakPolarHBondContact O-CG2 3.34Å; V363-V367 PolarHBondContact O-N 3.35Å; V363-I385 HydrophobicContact CG1-CD1 4.45Å; V363-I385 HydrophobicContact CG1-CG2 4.14Å; V363-F388 HydrophobicContact CG2-CD2 4.38Å; V363-F388 HydrophobicContact CG2-CE2 3.7Å; V363-Y399 HydrophobicContact CG2-CG 4.49Å
364	R	97	Very high	95.9	Very high	145 Å²	145	54.4 Å²	54.4	55%	0.547	25%	0.253	S	S	.	.	H	α-helix	trans	-57.4	-43.1	176.7	-172.1	-175.4	-173.8	87.6	0.8	111.7	S360 E361 G368	S360-R364 WeakPolarHBondContact O-CB 3.07Å; S360-R364 PolarHBondContact O-N 2.98Å; E361-R364 PolarHBondContact O-N 2.83Å; R364-G368 PolarHBondContact O-N 3.42Å
365	C	98.2	Very high	95.9	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.041	24%	0.238	C	C	.	.	H	α-helix	trans	-59.5	-52.7	174.2	171	0	0	0	0	111.1	K327 E361 L362 V363 V367 G368 L369	K327-C365 HydrophobicContact CB-CB 4.48Å; K327-C365 PolarHBondContact N-SG 3.48Å; E361-C365 WeakPolarHBondContact O-CB 3.5Å; E361-C365 PolarHBondContact O-N 3.42Å; L362-C365 WeakPolarHBondContact O-CB 3.46Å; L362-C365 PolarHBondContact O-N 3.22Å; V363-C365 VanDerWaalsContact C-N 3.29Å; V363-C365 PolarHBondContact O-N 3.35Å; C365-V367 PolarHBondContact O-N 2.94Å; C365-G368 PolarHBondContact O-N 2.91Å; C365-L369 WeakPolarHBondContact O-CG 3.41Å; C365-L369 PolarHBondContact O-N 3.32Å
366	A	98.5	Very high	95.9	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-46.3	-178.6	0	0	0	0	0	112.2	L346 L350 L362 V363 L369 L370 I385	L346-A366 HydrophobicContact CD2-CB 3.98Å; L346-A366 HydrophobicContact CG-CB 4.44Å; L350-A366 HydrophobicContact CD1-CB 4.06Å; L362-A366 WeakPolarHBondContact O-CB 3.39Å; L362-A366 PolarHBondContact O-N 3.06Å; V363-A366 PolarHBondContact O-N 2.93Å; A366-L369 PolarHBondContact O-N 3.44Å; A366-L370 WeakPolarHBondContact O-CG 3.33Å; A366-L370 PolarHBondContact O-N 3.12Å; A366-I385 HydrophobicContact CB-CD1 3.86Å
367	V	98.2	Very high	96.1	Very high	11 Å²	11	50.3 Å²	50.3	7%	0.067	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-43.6	176	173.9	0	0	0	0	110.8	V363 C365 L369 L370 I385 H403 E406 L407	V363-V367 HydrophobicContact CG1-CG2 4.18Å; V363-V367 WeakPolarHBondContact O-CB 3.38Å; V363-V367 WeakPolarHBondContact O-CG2 3.34Å; V363-V367 PolarHBondContact O-N 3.35Å; C365-V367 PolarHBondContact O-N 2.94Å; V367-L369 PolarHBondContact O-N 3.26Å; V367-L370 HydrophobicContact CB-CD1 4.49Å; V367-L370 HydrophobicContact CG1-CD1 4.42Å; V367-L370 WeakPolarHBondContact O-CB 3.49Å; V367-L370 WeakPolarHBondContact O-CG 3.43Å; V367-L370 PolarHBondContact O-N 2.88Å; V367-L370 VanDerWaalsContact O-N 3.14Å; V367-I385 HydrophobicContact CG2-CD1 4.04Å; V367-H403 HydrophobicContact CB-CB 4.43Å; V367-H403 HydrophobicContact CG1-CB 4.03Å; V367-H403 HydrophobicContact CG2-CB 3.75Å; V367-E406 HydrophobicContact CG1-CB 3.85Å; V367-E406 HydrophobicContact CG1-CG 4.19Å; V367-L407 HydrophobicContact CG2-CD2 4.19Å
368	G	97.8	Very high	96.3	Very high	22 Å²	22	44.4 Å²	44.4	23%	0.227	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-20.8	179.3	0	0	0	0	0	114.7	K327 R364 C365	K327-G368 VanDerWaalsContact CE-O 3.23Å; K327-G368 WeakPolarHBondContact CE-O 3.5Å; R364-G368 PolarHBondContact O-N 3.42Å; C365-G368 PolarHBondContact O-N 2.91Å
369	L	98.3	Very high	96.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-82.9	-24	174.3	-74.6	170.5	0	0	0	113.2	K327 C330 L331 L343 L346 C365 A366 V367 P371 S372 I373	K327-L369 HydrophobicContact CB-CD2 4.5Å; K327-L369 HydrophobicContact CB-CG 4.46Å; K327-L369 HydrophobicContact CG-CD2 3.87Å; K327-L369 HydrophobicContact CG-CG 4.03Å; C330-L369 HydrophobicContact CB-CD1 4.18Å; C330-L369 HydrophobicContact CB-CD2 3.89Å; L331-L369 HydrophobicContact CD2-CD2 3.91Å; L331-L369 HydrophobicContact CG-CD2 3.99Å; L343-L369 HydrophobicContact CD2-CD1 4.09Å; L346-L369 HydrophobicContact CD2-CD1 3.85Å; C365-L369 WeakPolarHBondContact O-CG 3.41Å; C365-L369 PolarHBondContact O-N 3.32Å; A366-L369 PolarHBondContact O-N 3.44Å; V367-L369 PolarHBondContact O-N 3.26Å; L369-P371 VanDerWaalsContact C-CD 3.43Å; L369-P371 VanDerWaalsContact C-N 3.33Å; L369-S372 PolarHBondContact O-N 2.77Å; L369-I373 PolarHBondContact O-N 3.13Å
370	L	97.6	Very high	96.2	Very high	12 Å²	12	49.2 Å²	49.2	6%	0.063	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-52.2	-41.1	-173.6	-60.8	175.3	0	0	0	114.1	A366 V367 S372 C378 V382 L407 L410	A366-L370 WeakPolarHBondContact O-CG 3.33Å; A366-L370 PolarHBondContact O-N 3.12Å; V367-L370 HydrophobicContact CB-CD1 4.49Å; V367-L370 HydrophobicContact CG1-CD1 4.42Å; V367-L370 WeakPolarHBondContact O-CB 3.49Å; V367-L370 WeakPolarHBondContact O-CG 3.43Å; V367-L370 PolarHBondContact O-N 2.88Å; V367-L370 VanDerWaalsContact O-N 3.14Å; L370-S372 PolarHBondContact O-N 2.95Å; L370-C378 HydrophobicContact CD2-CB 3.92Å; L370-C378 PolarHBondContact O-SG 3.15Å; L370-V382 HydrophobicContact CD1-CG2 4.16Å; L370-V382 HydrophobicContact CD2-CG2 3.94Å; L370-L407 HydrophobicContact CD1-CD2 4.23Å; L370-L410 HydrophobicContact CB-CD1 4.1Å; L370-L410 HydrophobicContact CD1-CD1 3.95Å; L370-L410 HydrophobicContact CD2-CD1 4.11Å; L370-L410 HydrophobicContact CG-CD1 4.27Å
371	P	96.7	Very high	96.3	Very high	116 Å²	116	48.9 Å²	48.9	75%	0.753	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-71.3	-15.5	179.2	-19.8	34.8	0	0	0	114.3	L369	L369-P371 VanDerWaalsContact C-CD 3.43Å; L369-P371 VanDerWaalsContact C-N 3.33Å
372	S	95.8	Very high	96.3	Very high	73 Å²	73	46.7 Å²	46.7	51%	0.51	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-108.5	-5.8	-171.7	-57.6	0	0	0	0	114	L369 L370	L369-S372 PolarHBondContact O-N 2.77Å; L370-S372 PolarHBondContact O-N 2.95Å
373	I	95.5	Very high	96.1	Very high	24 Å²	24	51.7 Å²	51.7	12%	0.123	26%	0.257	C	S	.	.	S	Bend	trans	-112.3	167.7	178.7	67.8	-179.1	0	0	0	111.3	L338 L343 L369 D377 C378 L381	L338-I373 HydrophobicContact CD2-CG2 4.15Å; L343-I373 HydrophobicContact CD1-CD1 4.08Å; L343-I373 HydrophobicContact CD1-CG2 4.44Å; L343-I373 HydrophobicContact CD2-CD1 4.45Å; L369-I373 PolarHBondContact O-N 3.13Å; I373-D377 HydrophobicContact CD1-CB 4.28Å; I373-C378 WeakPolarHBondContact CG1-SG 3.28Å; I373-L381 HydrophobicContact CD1-CD1 4.06Å
374	R	94.7	Very high	96	Very high	128 Å²	128	54 Å²	54	48%	0.483	27%	0.268	S	S	.	.			trans	-72.9	150.4	-179.1	-56.6	175.3	-65.5	152.9	13.1	109.7	E376 D377 C378	R374-E376 HydrophobicContact CB-CG 4.05Å; R374-E376 IonicContact CZ-OE1 2.7Å; R374-E376 IonicContact NE-OE1 3.9Å; R374-E376 IonicContact NH1-OE1 3.78Å; R374-E376 PolarHBondContact NH1-OE1 3.46Å; R374-E376 IonicContact NH2-OE1 3.53Å; R374-E376 PolarHBondContact NH2-OE1 3.17Å; R374-E376 PolarHBondContact O-N 3.32Å; R374-E376 VanDerWaalsContact O-N 3.15Å; R374-D377 WeakPolarHBondContact CB-OD2 3.31Å; R374-D377 IonicContact CZ-OD1 3.21Å; R374-D377 IonicContact CZ-OD2 2.74Å; R374-D377 VanDerWaalsContact CZ-OD2 3.3Å; R374-D377 IonicContact NE-OD2 3.72Å; R374-D377 PolarHBondContact NE-OD2 3.37Å; R374-D377 IonicContact NH2-OD1 2.81Å; R374-D377 PolarHBondContact NH2-OD1 3.04Å; R374-D377 IonicContact NH2-OD2 3.55Å; R374-D377 PolarHBondContact NH2-OD2 2.92Å; R374-D377 WeakPolarHBondContact O-CA 3.28Å; R374-D377 WeakPolarHBondContact O-CB 3.23Å; R374-D377 PolarHBondContact O-N 3.22Å; R374-C378 PolarHBondContact O-N 3.4Å; R374-C378 PolarHBondContact O-SG 3.45Å; R374-C378 VanDerWaalsContact O-SG 3.38Å
375	R	92.2	Very high	96	Very high	151 Å²	151	47 Å²	47	57%	0.57	24%	0.242	S	C	*	.	H	α-helix	trans	-54.9	-36.5	-179.8	-174.1	173.7	179.9	77	7.4	113.4	D377 C378 L379 L410	R375-D377 VanDerWaalsContact C-N 3.33Å; R375-C378 PolarHBondContact O-N 2.88Å; R375-L379 PolarHBondContact O-N 3.45Å; R375-L410 PolarHBondContact NH2-O 2.91Å
376	E	93.7	Very high	95.9	Very high	125 Å²	125	47.8 Å²	47.8	58%	0.584	25%	0.245	S	C	*	.	H	α-helix	trans	-65	-35.6	176	60.5	-172.5	-143.4	0	0	112.8	R374 P380	R374-E376 HydrophobicContact CB-CG 4.05Å; R374-E376 IonicContact CZ-OE1 2.7Å; R374-E376 IonicContact NE-OE1 3.9Å; R374-E376 IonicContact NH1-OE1 3.78Å; R374-E376 PolarHBondContact NH1-OE1 3.46Å; R374-E376 IonicContact NH2-OE1 3.53Å; R374-E376 PolarHBondContact NH2-OE1 3.17Å; R374-E376 PolarHBondContact O-N 3.32Å; R374-E376 VanDerWaalsContact O-N 3.15Å; E376-P380 WeakPolarHBondContact O-CD 3.45Å
377	D	95.1	Very high	95.6	Very high	25 Å²	25	49.1 Å²	49.1	13%	0.134	26%	0.259	C	S	.	.	H	α-helix	trans	-79.3	-25.3	179	-55.3	-44.4	0	0	0	111.6	L343 I373 R374 R375 P380	L343-D377 HydrophobicContact CD1-CB 3.88Å; I373-D377 HydrophobicContact CD1-CB 4.28Å; R374-D377 WeakPolarHBondContact CB-OD2 3.31Å; R374-D377 IonicContact CZ-OD1 3.21Å; R374-D377 IonicContact CZ-OD2 2.74Å; R374-D377 VanDerWaalsContact CZ-OD2 3.3Å; R374-D377 IonicContact NE-OD2 3.72Å; R374-D377 PolarHBondContact NE-OD2 3.37Å; R374-D377 IonicContact NH2-OD1 2.81Å; R374-D377 PolarHBondContact NH2-OD1 3.04Å; R374-D377 IonicContact NH2-OD2 3.55Å; R374-D377 PolarHBondContact NH2-OD2 2.92Å; R374-D377 WeakPolarHBondContact O-CA 3.28Å; R374-D377 WeakPolarHBondContact O-CB 3.23Å; R374-D377 PolarHBondContact O-N 3.22Å; R375-D377 VanDerWaalsContact C-N 3.33Å; D377-P380 WeakPolarHBondContact O-CD 3.12Å
378	C	95.9	Very high	95.5	Very high	4 Å²	4	48.8 Å²	48.8	3%	0.027	26%	0.257	C	S	.	.	H	α-helix	trans	-65.6	-38.6	174	-63.4	0	0	0	0	112.7	L370 I373 R374 R375 L381 V382 L410	L370-C378 HydrophobicContact CD2-CB 3.92Å; L370-C378 PolarHBondContact O-SG 3.15Å; I373-C378 WeakPolarHBondContact CG1-SG 3.28Å; R374-C378 PolarHBondContact O-N 3.4Å; R374-C378 PolarHBondContact O-SG 3.45Å; R374-C378 VanDerWaalsContact O-SG 3.38Å; R375-C378 PolarHBondContact O-N 2.88Å; C378-L381 WeakPolarHBondContact O-CB 3.42Å; C378-L381 PolarHBondContact O-N 2.89Å; C378-L381 VanDerWaalsContact O-N 3.08Å; C378-V382 WeakPolarHBondContact O-CG2 2.97Å; C378-V382 PolarHBondContact O-N 2.88Å; C378-L410 HydrophobicContact CB-CD1 3.88Å
379	L	93.3	Very high	95.4	Very high	83 Å²	83	48 Å²	48	44%	0.435	25%	0.247	S	C	.	.	H	α-helix	trans	-57.7	-47.6	-166.1	179.6	66.3	0	0	0	113.1	R375 L381 V382 Q383	R375-L379 PolarHBondContact O-N 3.45Å; L379-L381 VanDerWaalsContact C-N 3.28Å; L379-L381 PolarHBondContact O-N 3.05Å; L379-V382 PolarHBondContact O-N 3.25Å; L379-Q383 HydrophobicContact CD1-CG 4.02Å; L379-Q383 HydrophobicContact CG-CG 4.37Å; L379-Q383 WeakPolarHBondContact O-CB 3.11Å; L379-Q383 VanDerWaalsContact O-CG 3.28Å; L379-Q383 WeakPolarHBondContact O-CG 3.22Å; L379-Q383 PolarHBondContact O-N 3.41Å
380	P	94.8	Very high	95.1	Very high	46 Å²	46	52.7 Å²	52.7	30%	0.299	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-32.8	177.8	-23.4	34.9	0	0	0	113.9	E376 D377 H384	E376-P380 WeakPolarHBondContact O-CD 3.45Å; D377-P380 WeakPolarHBondContact O-CD 3.12Å; P380-H384 WeakPolarHBondContact O-CB 3.43Å; P380-H384 PolarHBondContact O-N 2.98Å; P380-H384 VanDerWaalsContact O-N 3.11Å
381	L	96.6	Very high	94.7	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-72.2	-48.1	177.8	-66	177.7	0	0	0	111.1	L343 L346 R347 L350 I373 C378 L379 Q383 H384 I385	L343-L381 HydrophobicContact CD2-CD1 4.22Å; L346-L381 HydrophobicContact CD2-CD2 4.4Å; L346-L381 HydrophobicContact CG-CD2 4.4Å; R347-L381 HydrophobicContact CB-CD2 4.19Å; R347-L381 HydrophobicContact CG-CD2 4.49Å; L350-L381 HydrophobicContact CD1-CD2 4.42Å; I373-L381 HydrophobicContact CD1-CD1 4.06Å; C378-L381 WeakPolarHBondContact O-CB 3.42Å; C378-L381 PolarHBondContact O-N 2.89Å; C378-L381 VanDerWaalsContact O-N 3.08Å; L379-L381 VanDerWaalsContact C-N 3.28Å; L379-L381 PolarHBondContact O-N 3.05Å; L381-Q383 VanDerWaalsContact C-N 3.33Å; L381-Q383 PolarHBondContact O-N 3.22Å; L381-H384 PolarHBondContact O-N 3.11Å; L381-H384 VanDerWaalsContact O-N 3.17Å; L381-I385 WeakPolarHBondContact O-CG1 3.39Å; L381-I385 PolarHBondContact O-N 3.02Å
382	V	96.5	Very high	94.4	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.024	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-46.5	178.1	174.2	0	0	0	0	110.3	L370 C378 L379 H384 I385 L386 L407 L410 M411	L370-V382 HydrophobicContact CD1-CG2 4.16Å; L370-V382 HydrophobicContact CD2-CG2 3.94Å; C378-V382 WeakPolarHBondContact O-CG2 2.97Å; C378-V382 PolarHBondContact O-N 2.88Å; L379-V382 PolarHBondContact O-N 3.25Å; V382-H384 VanDerWaalsContact C-N 3.32Å; V382-H384 PolarHBondContact O-N 2.98Å; V382-I385 PolarHBondContact O-N 3.01Å; V382-L386 HydrophobicContact CG1-CD1 3.71Å; V382-L386 HydrophobicContact CG1-CG 4.26Å; V382-L386 WeakPolarHBondContact O-CB 3.33Å; V382-L386 VanDerWaalsContact O-CG 3.26Å; V382-L386 WeakPolarHBondContact O-CG 3.27Å; V382-L386 PolarHBondContact O-N 3.47Å; V382-L407 HydrophobicContact CB-CD2 4.45Å; V382-L407 HydrophobicContact CG1-CD2 4.27Å; V382-L407 HydrophobicContact CG2-CD2 4.19Å; V382-L410 HydrophobicContact CG2-CB 4.44Å; V382-L410 HydrophobicContact CG2-CD1 3.76Å; V382-M411 HydrophobicContact CG1-CG 4.48Å
383	Q	94.7	Very high	94.2	Very high	107 Å²	107	54.7 Å²	54.7	50%	0.5	28%	0.28	S	S	.	.	H	α-helix	trans	-60.1	-41.3	176.6	-74.2	175.9	-15	0	0	112.3	L379 L381 G387	L379-Q383 HydrophobicContact CD1-CG 4.02Å; L379-Q383 HydrophobicContact CG-CG 4.37Å; L379-Q383 WeakPolarHBondContact O-CB 3.11Å; L379-Q383 VanDerWaalsContact O-CG 3.28Å; L379-Q383 WeakPolarHBondContact O-CG 3.22Å; L379-Q383 PolarHBondContact O-N 3.41Å; L381-Q383 VanDerWaalsContact C-N 3.33Å; L381-Q383 PolarHBondContact O-N 3.22Å; Q383-G387 PolarHBondContact O-N 3.39Å
384	H	94.9	Very high	94.1	Very high	47 Å²	47	55.1 Å²	55.1	22%	0.218	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-48.9	178.4	-165.7	86.7	0	0	0	111.7	R347 P380 L381 V382 G387 F388	R347-H384 HydrophobicContact CG-CB 4.11Å; P380-H384 WeakPolarHBondContact O-CB 3.43Å; P380-H384 PolarHBondContact O-N 2.98Å; P380-H384 VanDerWaalsContact O-N 3.11Å; L381-H384 PolarHBondContact O-N 3.11Å; L381-H384 VanDerWaalsContact O-N 3.17Å; V382-H384 VanDerWaalsContact C-N 3.32Å; V382-H384 PolarHBondContact O-N 2.98Å; H384-G387 WeakPolarHBondContact O-CA 3.31Å; H384-G387 PolarHBondContact O-N 3.31Å; H384-G387 VanDerWaalsContact O-N 3.08Å; H384-F388 AromaticContact CD2-CE1 3.73Å; H384-F388 AromaticContact CD2-CZ 3.82Å; H384-F388 AromaticContact NE2-CE1 3.66Å; H384-F388 AromaticContact NE2-CZ 3.95Å
385	I	96.8	Very high	93.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-44.9	-179.4	-62.7	164.6	0	0	0	110.5	L350 V363 A366 V367 L381 V382 G387 F388 V400 L407	L350-I385 HydrophobicContact CD1-CG1 4.36Å; V363-I385 HydrophobicContact CG1-CD1 4.45Å; V363-I385 HydrophobicContact CG1-CG2 4.14Å; A366-I385 HydrophobicContact CB-CD1 3.86Å; V367-I385 HydrophobicContact CG2-CD1 4.04Å; L381-I385 WeakPolarHBondContact O-CG1 3.39Å; L381-I385 PolarHBondContact O-N 3.02Å; V382-I385 PolarHBondContact O-N 3.01Å; I385-G387 PolarHBondContact O-N 3.28Å; I385-F388 VanDerWaalsContact O-CB 3.24Å; I385-F388 WeakPolarHBondContact O-CB 3.3Å; I385-F388 WeakPolarHBondContact O-CG 3.46Å; I385-F388 PolarHBondContact O-N 3.19Å; I385-V400 HydrophobicContact CG2-CG2 4.3Å; I385-V400 WeakPolarHBondContact O-CG2 3.44Å; I385-L407 HydrophobicContact CB-CD1 4.44Å; I385-L407 HydrophobicContact CB-CD2 4.24Å; I385-L407 HydrophobicContact CD1-CD2 4.05Å; I385-L407 HydrophobicContact CG2-CD1 3.63Å; I385-L407 HydrophobicContact CG2-CD2 4.18Å
386	L	95.6	Very high	93.9	Very high	21 Å²	21	43.5 Å²	43.5	11%	0.11	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-27.2	174.7	-69.3	174	0	0	0	112.4	V382 F388 L389 V400 L407 M411 L420	V382-L386 HydrophobicContact CG1-CD1 3.71Å; V382-L386 HydrophobicContact CG1-CG 4.26Å; V382-L386 WeakPolarHBondContact O-CB 3.33Å; V382-L386 VanDerWaalsContact O-CG 3.26Å; V382-L386 WeakPolarHBondContact O-CG 3.27Å; V382-L386 PolarHBondContact O-N 3.47Å; L386-F388 PolarHBondContact O-N 3.13Å; L386-L389 HydrophobicContact CD2-CD1 4.45Å; L386-L389 VanDerWaalsContact O-CB 3.27Å; L386-L389 WeakPolarHBondContact O-CB 3.44Å; L386-L389 WeakPolarHBondContact O-CG 3.4Å; L386-L389 PolarHBondContact O-N 3.26Å; L386-L389 VanDerWaalsContact O-N 3.11Å; L386-V400 HydrophobicContact CD2-CG1 3.81Å; L386-L407 HydrophobicContact CD2-CB 4.39Å; L386-L407 HydrophobicContact CD2-CD1 4.29Å; L386-M411 HydrophobicContact CD1-CE 3.87Å; L386-M411 HydrophobicContact CD1-CG 4.31Å; L386-M411 HydrophobicContact CD1-SD 3.34Å; L386-M411 WeakPolarHBondContact CD1-SD 3.23Å; L386-L420 HydrophobicContact CD2-CD1 4.24Å
387	G	93.8	Very high	93.9	Very high	28 Å²	28	38.3 Å²	38.3	29%	0.289	22%	0.219	S	C	.	.	H	α-helix	trans	-55.6	-30.8	171.7	0	0	0	0	0	113.4	Q383 H384 I385 L389 N390	Q383-G387 PolarHBondContact O-N 3.39Å; H384-G387 WeakPolarHBondContact O-CA 3.31Å; H384-G387 PolarHBondContact O-N 3.31Å; H384-G387 VanDerWaalsContact O-N 3.08Å; I385-G387 PolarHBondContact O-N 3.28Å; G387-L389 PolarHBondContact O-N 2.87Å; G387-L389 VanDerWaalsContact O-N 3.12Å; G387-N390 WeakPolarHBondContact O-CB 3.5Å; G387-N390 PolarHBondContact O-N 3.13Å
388	F	95.1	Very high	93.9	Very high	5 Å²	5	37.3 Å²	37.3	2%	0.022	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-63.5	-17.2	178	-62.6	-12.8	0	0	0	113.6	L350 V363 H384 I385 L386 N390 D391 S396 K397 V400	L350-F388 HydrophobicContact CB-CZ 4.36Å; L350-F388 HydrophobicContact CD2-CE2 4.48Å; L350-F388 HydrophobicContact CD2-CZ 4.38Å; V363-F388 HydrophobicContact CG2-CD2 4.38Å; V363-F388 HydrophobicContact CG2-CE2 3.7Å; H384-F388 AromaticContact CD2-CE1 3.73Å; H384-F388 AromaticContact CD2-CZ 3.82Å; H384-F388 AromaticContact NE2-CE1 3.66Å; H384-F388 AromaticContact NE2-CZ 3.95Å; I385-F388 VanDerWaalsContact O-CB 3.24Å; I385-F388 WeakPolarHBondContact O-CB 3.3Å; I385-F388 WeakPolarHBondContact O-CG 3.46Å; I385-F388 PolarHBondContact O-N 3.19Å; L386-F388 PolarHBondContact O-N 3.13Å; F388-N390 PolarHBondContact O-N 2.94Å; F388-D391 WeakPolarHBondContact O-CB 3.34Å; F388-D391 PolarHBondContact O-N 3.25Å; F388-D391 VanDerWaalsContact O-N 3.13Å; F388-S396 WeakPolarHBondContact CB-O 3.42Å; F388-K397 WeakPolarHBondContact O-CG 3.49Å; F388-V400 HydrophobicContact CB-CG2 3.77Å
389	L	95	Very high	93.8	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-60	-23.5	169.6	-68	179.7	0	0	0	112.4	L386 G387 V400 F401 L420 L424 L427	L386-L389 HydrophobicContact CD2-CD1 4.45Å; L386-L389 VanDerWaalsContact O-CB 3.27Å; L386-L389 WeakPolarHBondContact O-CB 3.44Å; L386-L389 WeakPolarHBondContact O-CG 3.4Å; L386-L389 PolarHBondContact O-N 3.26Å; L386-L389 VanDerWaalsContact O-N 3.11Å; G387-L389 PolarHBondContact O-N 2.87Å; G387-L389 VanDerWaalsContact O-N 3.12Å; L389-V400 HydrophobicContact CD1-CG1 4.19Å; L389-V400 HydrophobicContact CD2-CB 3.75Å; L389-V400 HydrophobicContact CD2-CG1 3.78Å; L389-V400 HydrophobicContact CD2-CG2 4.02Å; L389-V400 HydrophobicContact CG-CB 4.19Å; L389-V400 HydrophobicContact CG-CG1 3.89Å; L389-V400 HydrophobicContact CG-CG2 4.11Å; L389-F401 HydrophobicContact CD2-CE1 4Å; L389-F401 HydrophobicContact CD2-CZ 4.02Å; L389-L420 HydrophobicContact CD1-CD1 3.72Å; L389-L424 HydrophobicContact CD1-CD2 4.36Å; L389-L427 HydrophobicContact CB-CD1 3.91Å; L389-L427 HydrophobicContact CD2-CD1 3.75Å; L389-L427 HydrophobicContact CG-CD1 4.29Å
390	N	92.2	Very high	93.9	Very high	100 Å²	100	33.3 Å²	33.3	54%	0.535	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-96.9	-1.5	179.1	-61.6	-55.2	0	0	0	113.7	G387 F388 R426	G387-N390 WeakPolarHBondContact O-CB 3.5Å; G387-N390 PolarHBondContact O-N 3.13Å; F388-N390 PolarHBondContact O-N 2.94Å; N390-R426 PolarHBondContact OD1-NH2 3.31Å
391	D	90.7	Very high	94	Very high	55 Å²	55	31.4 Å²	31.4	29%	0.294	18%	0.179	S	C	.	.	S	Bend	trans	-66.4	155.5	179	-79.8	0.8	0	0	0	111.7	R359 F388 S396 K397	R359-D391 IonicContact NH2-OD2 2.85Å; F388-D391 WeakPolarHBondContact O-CB 3.34Å; F388-D391 PolarHBondContact O-N 3.25Å; F388-D391 VanDerWaalsContact O-N 3.13Å; D391-S396 WeakPolarHBondContact OD2-CB 3.4Å; D391-S396 PolarHBondContact OD2-OG 2.78Å; D391-K397 WeakPolarHBondContact O-CE 3.19Å; D391-K397 PolarHBondContact O-NZ 3.39Å
392	T	90.6	Very high	93.9	Very high	146 Å²	146	33.6 Å²	33.6	90%	0.896	19%	0.19	S	C	*	.	S	Bend	trans	-69.4	-38	173.5	50.4	0	0	0	0	111.6	S394	T392-S394 PolarHBondContact O-N 3.4Å
393	S	91.1	Very high	93.9	Very high	42 Å²	42	34.2 Å²	34.2	29%	0.294	19%	0.192	S	C	.	.			trans	-67.3	129.3	179	-179.5	0	0	0	0	111.2	Q395	S393-Q395 PolarHBondContact O-N 2.88Å; S393-Q395 WeakPolarHBondContact OG-CB 3.45Å; S393-Q395 PolarHBondContact OG-N 2.99Å; S393-Q395 VanDerWaalsContact OG-N 3.11Å
394	S	92.1	Very high	94	Very high	32 Å²	32	29.3 Å²	29.3	22%	0.224	17%	0.169	C	C	.	.	H	α-helix	trans	-62.3	-31.5	169.4	-61.5	0	0	0	0	111.4	T392 K397 Q398 N432	T392-S394 PolarHBondContact O-N 3.4Å; S394-K397 WeakPolarHBondContact O-CB 3.39Å; S394-K397 PolarHBondContact O-N 3.28Å; S394-Q398 WeakPolarHBondContact O-CG 3.43Å; S394-Q398 PolarHBondContact O-N 3.11Å; S394-N432 VanDerWaalsContact CB-ND2 3.32Å; S394-N432 WeakPolarHBondContact CB-ND2 3.4Å; S394-N432 WeakPolarHBondContact OG-CB 3.47Å
395	Q	91.4	Very high	94	Very high	23 Å²	23	30.3 Å²	30.3	11%	0.107	18%	0.181	C	C	.	.	H	α-helix	trans	-67	-43.8	-177.3	-167.8	61.4	20.5	0	0	112.1	E356 S393 K397 Q398 Y399 A621	E356-Q395 HydrophobicContact CB-CG 4.34Å; E356-Q395 HydrophobicContact CG-CG 4.15Å; E356-Q395 WeakPolarHBondContact OE1-CB 3.33Å; S393-Q395 PolarHBondContact O-N 2.88Å; S393-Q395 WeakPolarHBondContact OG-CB 3.45Å; S393-Q395 PolarHBondContact OG-N 2.99Å; S393-Q395 VanDerWaalsContact OG-N 3.11Å; Q395-K397 PolarHBondContact O-N 3.24Å; Q395-Q398 WeakPolarHBondContact O-CB 3.24Å; Q395-Q398 PolarHBondContact O-N 3.46Å; Q395-Y399 HydrophobicContact CG-CE1 4.26Å; Q395-Y399 HydrophobicContact CG-CE2 4.19Å; Q395-Y399 WeakPolarHBondContact CG-OH 3.49Å; Q395-Y399 WeakPolarHBondContact O-CD2 3.35Å; Q395-Y399 PolarHBondContact O-N 3.36Å; Q395-A621 PolarHBondContact NE2-O 3.17Å; Q395-A621 PolarHBondContact OE1-O 3.45Å
396	S	91.5	Very high	93.9	Very high	12 Å²	12	34.3 Å²	34.3	8%	0.084	20%	0.2	C	C	.	.	H	α-helix	trans	-51.4	-44.3	173.8	-67.5	0	0	0	0	112.5	F388 D391 Q398 Y399	F388-S396 WeakPolarHBondContact CB-O 3.42Å; D391-S396 WeakPolarHBondContact OD2-CB 3.4Å; D391-S396 PolarHBondContact OD2-OG 2.78Å; S396-Q398 VanDerWaalsContact C-N 3.32Å; S396-Q398 PolarHBondContact O-N 3.28Å; S396-Y399 WeakPolarHBondContact O-CD2 3.4Å; S396-Y399 PolarHBondContact O-N 3.15Å
397	K	94.6	Very high	94	Very high	16 Å²	16	33.3 Å²	33.3	7%	0.07	20%	0.195	C	C	.	.	H	α-helix	trans	-64.9	-37	178.9	-59.5	168.3	-178.6	152.3	0	111.9	F388 D391 S394 Q395 Y399 V400 F401 L427 D430 V435	F388-K397 WeakPolarHBondContact O-CG 3.49Å; D391-K397 WeakPolarHBondContact O-CE 3.19Å; D391-K397 PolarHBondContact O-NZ 3.39Å; S394-K397 WeakPolarHBondContact O-CB 3.39Å; S394-K397 PolarHBondContact O-N 3.28Å; Q395-K397 PolarHBondContact O-N 3.24Å; K397-Y399 VanDerWaalsContact C-N 3.32Å; K397-Y399 PolarHBondContact O-N 2.68Å; K397-V400 WeakPolarHBondContact O-CB 3.35Å; K397-V400 PolarHBondContact O-N 3.4Å; K397-V400 VanDerWaalsContact O-N 3.15Å; K397-F401 HydrophobicContact CB-CE2 4.25Å; K397-F401 WeakPolarHBondContact O-CD2 3.37Å; K397-F401 PolarHBondContact O-N 2.86Å; K397-L427 HydrophobicContact CD-CD2 3.89Å; K397-D430 IonicContact NZ-OD2 3.52Å; K397-D430 PolarHBondContact NZ-OD2 3.03Å; K397-V435 HydrophobicContact CB-CG2 4.34Å; K397-V435 HydrophobicContact CD-CG1 3.99Å; K397-V435 HydrophobicContact CD-CG2 4.13Å
398	Q	94.4	Very high	94	Very high	5 Å²	5	32.3 Å²	32.3	2%	0.023	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-34.9	-178.3	-71	-177.7	74.1	0	0	112.6	S394 Q395 S396 V400 F401 E402 Y619 A621	S394-Q398 WeakPolarHBondContact O-CG 3.43Å; S394-Q398 PolarHBondContact O-N 3.11Å; Q395-Q398 WeakPolarHBondContact O-CB 3.24Å; Q395-Q398 PolarHBondContact O-N 3.46Å; S396-Q398 VanDerWaalsContact C-N 3.32Å; S396-Q398 PolarHBondContact O-N 3.28Å; Q398-V400 PolarHBondContact O-N 3.41Å; Q398-F401 PolarHBondContact O-N 3.15Å; Q398-F401 VanDerWaalsContact O-N 3.11Å; Q398-E402 PolarHBondContact O-N 3.43Å; Q398-Y619 HydrophobicContact CB-CE1 3.99Å; Q398-Y619 HydrophobicContact CG-CE1 4.2Å; Q398-Y619 WeakPolarHBondContact CG-OH 3.44Å; Q398-A621 HydrophobicContact CB-CB 3.7Å; Q398-A621 PolarHBondContact OE1-O 3.46Å; Q398-A621 VanDerWaalsContact OE1-O 3.13Å
399	Y	93.2	Very high	94	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-34	174.3	-54.5	-49.4	0	0	0	112.8	E356 R359 V363 Q395 S396 K397 A621 L622	E356-Y399 VanDerWaalsContact C-OH 3.28Å; E356-Y399 VanDerWaalsContact CA-OH 3.26Å; E356-Y399 WeakPolarHBondContact CA-OH 3.46Å; E356-Y399 VanDerWaalsContact CB-OH 3.26Å; E356-Y399 WeakPolarHBondContact CB-OH 3.39Å; E356-Y399 PolarHBondContact O-OH 2.92Å; R359-Y399 HydrophobicContact CB-CE2 4.43Å; R359-Y399 HydrophobicContact CG-CE2 4.25Å; V363-Y399 HydrophobicContact CG2-CG 4.49Å; Q395-Y399 HydrophobicContact CG-CE1 4.26Å; Q395-Y399 HydrophobicContact CG-CE2 4.19Å; Q395-Y399 WeakPolarHBondContact CG-OH 3.49Å; Q395-Y399 WeakPolarHBondContact O-CD2 3.35Å; Q395-Y399 PolarHBondContact O-N 3.36Å; S396-Y399 WeakPolarHBondContact O-CD2 3.4Å; S396-Y399 PolarHBondContact O-N 3.15Å; K397-Y399 VanDerWaalsContact C-N 3.32Å; K397-Y399 PolarHBondContact O-N 2.68Å; Y399-A621 HydrophobicContact CD1-CB 3.56Å; Y399-A621 HydrophobicContact CE1-CB 4.04Å; Y399-A621 HydrophobicContact CG-CB 4.48Å; Y399-L622 HydrophobicContact CE1-CD2 4.22Å
400	V	96.3	Very high	93.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.7	-40.3	177.2	-171.2	0	0	0	0	110.7	I385 L386 F388 L389 K397 Q398 H403 F404 L407	I385-V400 HydrophobicContact CG2-CG2 4.3Å; I385-V400 WeakPolarHBondContact O-CG2 3.44Å; L386-V400 HydrophobicContact CD2-CG1 3.81Å; F388-V400 HydrophobicContact CB-CG2 3.77Å; L389-V400 HydrophobicContact CD1-CG1 4.19Å; L389-V400 HydrophobicContact CD2-CB 3.75Å; L389-V400 HydrophobicContact CD2-CG1 3.78Å; L389-V400 HydrophobicContact CD2-CG2 4.02Å; L389-V400 HydrophobicContact CG-CB 4.19Å; L389-V400 HydrophobicContact CG-CG1 3.89Å; L389-V400 HydrophobicContact CG-CG2 4.11Å; K397-V400 WeakPolarHBondContact O-CB 3.35Å; K397-V400 PolarHBondContact O-N 3.4Å; K397-V400 VanDerWaalsContact O-N 3.15Å; Q398-V400 PolarHBondContact O-N 3.41Å; V400-H403 CarbonylContact O-C 3.53Å; V400-H403 PolarHBondContact O-N 3.3Å; V400-F404 HydrophobicContact CG1-CD2 4.44Å; V400-F404 WeakPolarHBondContact O-CA 3.45Å; V400-F404 WeakPolarHBondContact O-CB 3.36Å; V400-F404 PolarHBondContact O-N 3.36Å; V400-L407 HydrophobicContact CG1-CD1 4.03Å
401	F	95.9	Very high	93.8	Very high	7 Å²	7	34 Å²	34	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-69.1	-35.7	179.3	-59.9	-47.3	0	0	0	112.7	L389 K397 Q398 H403 F404 L424 L427 V435 V439 S442 Y619	L389-F401 HydrophobicContact CD2-CE1 4Å; L389-F401 HydrophobicContact CD2-CZ 4.02Å; K397-F401 HydrophobicContact CB-CE2 4.25Å; K397-F401 WeakPolarHBondContact O-CD2 3.37Å; K397-F401 PolarHBondContact O-N 2.86Å; Q398-F401 PolarHBondContact O-N 3.15Å; Q398-F401 VanDerWaalsContact O-N 3.11Å; F401-H403 PolarHBondContact O-N 3.43Å; F401-F404 PolarHBondContact O-N 3.32Å; F401-L424 HydrophobicContact CE1-CD2 3.78Å; F401-L427 HydrophobicContact CZ-CD1 4.37Å; F401-V435 HydrophobicContact CE2-CB 4.44Å; F401-V435 HydrophobicContact CE2-CG1 4Å; F401-V435 HydrophobicContact CZ-CG1 4.38Å; F401-V439 HydrophobicContact CE1-CG2 4.12Å; F401-V439 HydrophobicContact CZ-CG2 3.74Å; F401-S442 WeakPolarHBondContact CD1-OG 3.32Å; F401-Y619 HydrophobicContact CB-CD1 3.84Å; F401-Y619 HydrophobicContact CB-CD2 4.41Å; F401-Y619 HydrophobicContact CB-CE1 3.82Å; F401-Y619 HydrophobicContact CB-CE2 4.4Å; F401-Y619 HydrophobicContact CB-CG 4.14Å; F401-Y619 HydrophobicContact CD2-CE1 4.5Å
402	E	95	Very high	93.9	Very high	50 Å²	50	34.2 Å²	34.2	23%	0.234	21%	0.206	C	C	.	.	H	α-helix	trans	-59.1	-34.5	175.4	-177	165.3	170.4	0	0	112.7	Q398 Y619 A621	Q398-E402 PolarHBondContact O-N 3.43Å; E402-Y619 HydrophobicContact CB-CD1 4.26Å; E402-A621 HydrophobicContact CB-CB 4.32Å; E402-A621 WeakPolarHBondContact OE2-CB 3.46Å; E402-A621 PolarHBondContact OE2-N 3.37Å
403	H	96.3	Very high	93.9	Very high	16 Å²	16	29.4 Å²	29.4	7%	0.074	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	23.6	-177.5	-62.3	-57.6	0	0	0	113.5	V367 V400 F401 S405 E406 L407	V367-H403 HydrophobicContact CB-CB 4.43Å; V367-H403 HydrophobicContact CG1-CB 4.03Å; V367-H403 HydrophobicContact CG2-CB 3.75Å; V400-H403 CarbonylContact O-C 3.53Å; V400-H403 PolarHBondContact O-N 3.3Å; F401-H403 PolarHBondContact O-N 3.43Å; H403-S405 VanDerWaalsContact C-N 3.32Å; H403-S405 PolarHBondContact O-N 2.91Å; H403-E406 IonicContact ND1-OE1 3.81Å; H403-E406 PolarHBondContact O-N 3.28Å; H403-L407 HydrophobicContact CB-CD1 4.38Å; H403-L407 VanDerWaalsContact O-CG 3.28Å; H403-L407 WeakPolarHBondContact O-CG 3.43Å; H403-L407 PolarHBondContact O-N 2.91Å
404	F	96.6	Very high	94.1	Very high	5 Å²	5	33 Å²	33	2%	0.022	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-40.8	-167.7	-172.5	-98.3	0	0	0	112.6	V400 F401 L407 V408 L420 L424 S442 C445 L446	V400-F404 HydrophobicContact CG1-CD2 4.44Å; V400-F404 WeakPolarHBondContact O-CA 3.45Å; V400-F404 WeakPolarHBondContact O-CB 3.36Å; V400-F404 PolarHBondContact O-N 3.36Å; F401-F404 PolarHBondContact O-N 3.32Å; F404-L407 PolarHBondContact O-N 3.06Å; F404-V408 HydrophobicContact CD1-CG2 3.95Å; F404-V408 HydrophobicContact CD2-CG2 4.33Å; F404-V408 HydrophobicContact CE1-CG2 3.56Å; F404-V408 HydrophobicContact CE2-CG2 3.96Å; F404-V408 HydrophobicContact CG-CG2 4.32Å; F404-V408 HydrophobicContact CZ-CG2 3.56Å; F404-V408 WeakPolarHBondContact O-CB 3.16Å; F404-V408 VanDerWaalsContact O-CG2 3.31Å; F404-V408 WeakPolarHBondContact O-CG2 3.49Å; F404-V408 PolarHBondContact O-N 3.14Å; F404-L420 HydrophobicContact CE2-CD1 4.32Å; F404-L420 HydrophobicContact CE2-CD2 4.12Å; F404-L420 HydrophobicContact CZ-CD2 3.87Å; F404-L420 HydrophobicContact CZ-CG 4.48Å; F404-L424 HydrophobicContact CE2-CD1 3.92Å; F404-L424 HydrophobicContact CE2-CD2 4.11Å; F404-L424 HydrophobicContact CZ-CD1 3.61Å; F404-S442 VanDerWaalsContact CD1-CB 3.48Å; F404-S442 VanDerWaalsContact CE1-O 3.26Å; F404-S442 WeakPolarHBondContact CE1-O 3.42Å; F404-C445 HydrophobicContact CD1-CB 4.35Å; F404-C445 HydrophobicContact CE1-CB 4.36Å; F404-L446 HydrophobicContact CE1-CD2 3.72Å; F404-L446 HydrophobicContact CE1-CG 4.16Å; F404-L446 HydrophobicContact CZ-CD1 4.29Å; F404-L446 HydrophobicContact CZ-CD2 3.9Å; F404-L446 HydrophobicContact CZ-CG 4.3Å
405	S	94.8	Very high	94.2	Very high	67 Å²	67	35.1 Å²	35.1	47%	0.469	20%	0.204	S	C	.	.	H	α-helix	trans	-68.1	-39.4	-175.1	64.5	0	0	0	0	112.7	H403 A409	H403-S405 VanDerWaalsContact C-N 3.32Å; H403-S405 PolarHBondContact O-N 2.91Å; S405-A409 WeakPolarHBondContact O-CB 3.41Å; S405-A409 PolarHBondContact O-N 3.31Å; S405-A409 VanDerWaalsContact O-N 3.14Å
406	E	96.3	Very high	94.3	Very high	84 Å²	84	34.1 Å²	34.1	39%	0.393	20%	0.199	S	C	.	.	H	α-helix	trans	-67	-40.8	177.2	-60.9	94.4	128.7	0	0	111.2	V367 H403	V367-E406 HydrophobicContact CG1-CB 3.85Å; V367-E406 HydrophobicContact CG1-CG 4.19Å; H403-E406 IonicContact ND1-OE1 3.81Å; H403-E406 PolarHBondContact O-N 3.28Å
407	L	96.6	Very high	94.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-47.2	178.6	-67.2	168.3	0	0	0	111.7	V367 L370 V382 I385 L386 V400 H403 F404 A409 L410	V367-L407 HydrophobicContact CG2-CD2 4.19Å; L370-L407 HydrophobicContact CD1-CD2 4.23Å; V382-L407 HydrophobicContact CB-CD2 4.45Å; V382-L407 HydrophobicContact CG1-CD2 4.27Å; V382-L407 HydrophobicContact CG2-CD2 4.19Å; I385-L407 HydrophobicContact CB-CD1 4.44Å; I385-L407 HydrophobicContact CB-CD2 4.24Å; I385-L407 HydrophobicContact CD1-CD2 4.05Å; I385-L407 HydrophobicContact CG2-CD1 3.63Å; I385-L407 HydrophobicContact CG2-CD2 4.18Å; L386-L407 HydrophobicContact CD2-CB 4.39Å; L386-L407 HydrophobicContact CD2-CD1 4.29Å; V400-L407 HydrophobicContact CG1-CD1 4.03Å; H403-L407 HydrophobicContact CB-CD1 4.38Å; H403-L407 VanDerWaalsContact O-CG 3.28Å; H403-L407 WeakPolarHBondContact O-CG 3.43Å; H403-L407 PolarHBondContact O-N 2.91Å; F404-L407 PolarHBondContact O-N 3.06Å; L407-A409 VanDerWaalsContact C-N 3.31Å; L407-A409 PolarHBondContact O-N 3.43Å; L407-L410 PolarHBondContact O-N 3.21Å
408	V	94.7	Very high	94.5	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-68.4	-30.2	-177.1	170.1	0	0	0	0	112.3	F404 L410 M411 I416 L420 L446	F404-V408 HydrophobicContact CD1-CG2 3.95Å; F404-V408 HydrophobicContact CD2-CG2 4.33Å; F404-V408 HydrophobicContact CE1-CG2 3.56Å; F404-V408 HydrophobicContact CE2-CG2 3.96Å; F404-V408 HydrophobicContact CG-CG2 4.32Å; F404-V408 HydrophobicContact CZ-CG2 3.56Å; F404-V408 WeakPolarHBondContact O-CB 3.16Å; F404-V408 VanDerWaalsContact O-CG2 3.31Å; F404-V408 WeakPolarHBondContact O-CG2 3.49Å; F404-V408 PolarHBondContact O-N 3.14Å; V408-L410 PolarHBondContact O-N 3.29Å; V408-M411 PolarHBondContact O-N 3.1Å; V408-I416 HydrophobicContact CG1-CD1 3.74Å; V408-I416 HydrophobicContact CG1-CG1 4.38Å; V408-L420 HydrophobicContact CG2-CD2 3.64Å; V408-L446 HydrophobicContact CB-CD2 4.38Å; V408-L446 HydrophobicContact CG1-CD2 3.53Å; V408-L446 HydrophobicContact CG2-CD2 4.01Å
409	A	93.6	Very high	94.4	Very high	74 Å²	74	45.1 Å²	45.1	61%	0.612	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.3	176.5	0	0	0	0	0	113.2	S405 L407	S405-A409 WeakPolarHBondContact O-CB 3.41Å; S405-A409 PolarHBondContact O-N 3.31Å; S405-A409 VanDerWaalsContact O-N 3.14Å; L407-A409 VanDerWaalsContact C-N 3.31Å; L407-A409 PolarHBondContact O-N 3.43Å
410	L	92.3	Very high	94.5	Very high	44 Å²	44	45.4 Å²	45.4	23%	0.23	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-8.6	177.9	-62.7	176.7	0	0	0	114	L370 R375 C378 V382 L407 V408	L370-L410 HydrophobicContact CB-CD1 4.1Å; L370-L410 HydrophobicContact CD1-CD1 3.95Å; L370-L410 HydrophobicContact CD2-CD1 4.11Å; L370-L410 HydrophobicContact CG-CD1 4.27Å; R375-L410 PolarHBondContact NH2-O 2.91Å; C378-L410 HydrophobicContact CB-CD1 3.88Å; V382-L410 HydrophobicContact CG2-CB 4.44Å; V382-L410 HydrophobicContact CG2-CD1 3.76Å; L407-L410 PolarHBondContact O-N 3.21Å; V408-L410 PolarHBondContact O-N 3.29Å
411	M	92.4	Very high	94.5	Very high	27 Å²	27	45.5 Å²	45.5	13%	0.133	26%	0.26	C	S	.	.	S	Bend	trans	-89	140.2	-175.9	-65.1	-172.7	76.8	0	0	113.3	V382 L386 V408 E415 I416 L420	V382-M411 HydrophobicContact CG1-CG 4.48Å; L386-M411 HydrophobicContact CD1-CE 3.87Å; L386-M411 HydrophobicContact CD1-CG 4.31Å; L386-M411 HydrophobicContact CD1-SD 3.34Å; L386-M411 WeakPolarHBondContact CD1-SD 3.23Å; V408-M411 PolarHBondContact O-N 3.1Å; M411-E415 HydrophobicContact CE-CB 3.98Å; M411-I416 HydrophobicContact CB-CD1 4.16Å; M411-I416 HydrophobicContact CB-CG1 3.86Å; M411-L420 HydrophobicContact CE-CB 4.41Å; M411-L420 HydrophobicContact SD-CD2 3.86Å
412	P	91.6	Very high	94.4	Very high	59 Å²	59	48.3 Å²	48.3	38%	0.383	28%	0.279	S	S	.	.			trans	-64.8	144.4	168.1	-18.5	31.5	0	0	0	112.3	N414 E415 I416	P412-N414 PolarHBondContact O-N 3.07Å; P412-N414 VanDerWaalsContact O-N 3.15Å; P412-E415 HydrophobicContact CG-CG 4.44Å; P412-E415 PolarHBondContact O-N 2.92Å; P412-I416 PolarHBondContact O-N 3.1Å; P412-I416 VanDerWaalsContact O-N 3.13Å
413	A	91.8	Very high	94.4	Very high	46 Å²	46	47.4 Å²	47.4	38%	0.38	28%	0.278	S	S	.	.	H	α-helix	trans	-54.6	-36.1	179.1	0	0	0	0	0	113.7	E415 I416 Q417	A413-E415 PolarHBondContact O-N 3.12Å; A413-I416 WeakPolarHBondContact O-CB 3.44Å; A413-I416 PolarHBondContact O-N 3.23Å; A413-Q417 PolarHBondContact O-N 2.92Å
414	N	93.9	Very high	94.4	Very high	117 Å²	117	46.6 Å²	46.6	63%	0.626	28%	0.275	S	S	*	.	H	α-helix	trans	-63.1	-41.2	177.5	-68.5	-17.7	0	0	0	112.3	P412 Q417 L418	P412-N414 PolarHBondContact O-N 3.07Å; P412-N414 VanDerWaalsContact O-N 3.15Å; N414-Q417 PolarHBondContact O-N 3.43Å; N414-L418 WeakPolarHBondContact O-CB 3.36Å; N414-L418 WeakPolarHBondContact O-CG 3.43Å; N414-L418 PolarHBondContact O-N 3.42Å
415	E	94.2	Very high	94.3	Very high	77 Å²	77	48 Å²	48	36%	0.36	28%	0.282	S	S	.	.	H	α-helix	trans	-69.7	-39.1	177.2	-67.8	-174.3	-178.5	0	0	110.9	M411 P412 A413 Q417 T419 L420	M411-E415 HydrophobicContact CE-CB 3.98Å; P412-E415 HydrophobicContact CG-CG 4.44Å; P412-E415 PolarHBondContact O-N 2.92Å; A413-E415 PolarHBondContact O-N 3.12Å; E415-Q417 VanDerWaalsContact C-N 3.34Å; E415-Q417 PolarHBondContact O-N 3.47Å; E415-T419 WeakPolarHBondContact O-CB 3.45Å; E415-T419 PolarHBondContact O-N 3.45Å; E415-T419 PolarHBondContact O-OG1 3.2Å; E415-L420 PolarHBondContact O-N 2.95Å
416	I	95	Very high	94.3	Very high	1 Å²	1	51 Å²	51	1%	0.005	28%	0.283	C	S	.	.	I	π-helix	trans	-56.4	-50.4	174.8	-64.6	171.4	0	0	0	110.1	V408 M411 P412 A413 L420 L421 L446 K449 L450	V408-I416 HydrophobicContact CG1-CD1 3.74Å; V408-I416 HydrophobicContact CG1-CG1 4.38Å; M411-I416 HydrophobicContact CB-CD1 4.16Å; M411-I416 HydrophobicContact CB-CG1 3.86Å; P412-I416 PolarHBondContact O-N 3.1Å; P412-I416 VanDerWaalsContact O-N 3.13Å; A413-I416 WeakPolarHBondContact O-CB 3.44Å; A413-I416 PolarHBondContact O-N 3.23Å; I416-L420 PolarHBondContact O-N 2.94Å; I416-L421 VanDerWaalsContact O-CB 3.32Å; I416-L421 WeakPolarHBondContact O-CB 3.44Å; I416-L421 PolarHBondContact O-N 3.48Å; I416-L446 HydrophobicContact CG2-CB 4.2Å; I416-L446 HydrophobicContact CG2-CD1 4.01Å; I416-L446 HydrophobicContact CG2-CD2 3.83Å; I416-L446 HydrophobicContact CG2-CG 4.23Å; I416-K449 HydrophobicContact CD1-CB 3.97Å; I416-K449 HydrophobicContact CD1-CG 4Å; I416-L450 HydrophobicContact CG2-CD2 4.17Å
417	Q	95.3	Very high	94.2	Very high	63 Å²	63	47.4 Å²	47.4	29%	0.294	27%	0.266	S	S	.	.	I	π-helix	trans	-68.9	-45.8	-177.9	-174.2	-179.7	-0.2	0	0	113	A413 N414 E415 P422 L450	A413-Q417 PolarHBondContact O-N 2.92Å; N414-Q417 PolarHBondContact O-N 3.43Å; E415-Q417 VanDerWaalsContact C-N 3.34Å; E415-Q417 PolarHBondContact O-N 3.47Å; Q417-P422 VanDerWaalsContact O-CD 3.29Å; Q417-P422 WeakPolarHBondContact O-CD 3.49Å; Q417-L450 HydrophobicContact CB-CD2 3.81Å; Q417-L450 HydrophobicContact CG-CD2 4.11Å
418	L	94.6	Very high	94.2	Very high	126 Å²	126	48.2 Å²	48.2	66%	0.66	27%	0.27	S	S	*	.	I	π-helix	trans	-88.9	-20	-169.1	-63.1	178.3	0	0	0	114	N414	N414-L418 WeakPolarHBondContact O-CB 3.36Å; N414-L418 WeakPolarHBondContact O-CG 3.43Å; N414-L418 PolarHBondContact O-N 3.42Å
419	T	92.8	Very high	94.1	Very high	76 Å²	76	52 Å²	52	47%	0.466	29%	0.287	S	S	.	.	I	π-helix	trans	-126.6	-54.7	-173.5	69.6	0	0	0	0	113.2	E415 S423	E415-T419 WeakPolarHBondContact O-CB 3.45Å; E415-T419 PolarHBondContact O-N 3.45Å; E415-T419 PolarHBondContact O-OG1 3.2Å; T419-S423 WeakPolarHBondContact O-CB 3.19Å; T419-S423 PolarHBondContact O-N 3.2Å; T419-S423 PolarHBondContact O-OG 2.82Å
420	L	95.2	Very high	94.1	Very high	7 Å²	7	49.8 Å²	49.8	4%	0.037	26%	0.264	C	S	.	.	I	π-helix	trans	-70.4	-51.3	-173.3	-178.3	62.6	0	0	0	111.6	L386 L389 F404 V408 M411 E415 I416 S423 L424 L446	L386-L420 HydrophobicContact CD2-CD1 4.24Å; L389-L420 HydrophobicContact CD1-CD1 3.72Å; F404-L420 HydrophobicContact CE2-CD1 4.32Å; F404-L420 HydrophobicContact CE2-CD2 4.12Å; F404-L420 HydrophobicContact CZ-CD2 3.87Å; F404-L420 HydrophobicContact CZ-CG 4.48Å; V408-L420 HydrophobicContact CG2-CD2 3.64Å; M411-L420 HydrophobicContact CE-CB 4.41Å; M411-L420 HydrophobicContact SD-CD2 3.86Å; E415-L420 PolarHBondContact O-N 2.95Å; I416-L420 PolarHBondContact O-N 2.94Å; L420-S423 WeakPolarHBondContact O-CB 3.43Å; L420-S423 PolarHBondContact O-N 3.37Å; L420-S423 VanDerWaalsContact O-N 3.12Å; L420-L424 HydrophobicContact CD1-CD1 4.28Å; L420-L424 HydrophobicContact CD1-CG 4.3Å; L420-L424 HydrophobicContact CG-CD1 3.94Å; L420-L424 HydrophobicContact CG-CG 4.39Å; L420-L424 WeakPolarHBondContact O-CG 3.29Å; L420-L424 PolarHBondContact O-N 3.43Å; L420-L446 HydrophobicContact CD2-CD2 4.33Å
421	L	95.9	Very high	94.2	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-51.5	-178.8	174.8	69	0	0	0	111.8	I416 S423 L424 L425 V443 L446 L450 C454 V459	I416-L421 VanDerWaalsContact O-CB 3.32Å; I416-L421 WeakPolarHBondContact O-CB 3.44Å; I416-L421 PolarHBondContact O-N 3.48Å; L421-S423 PolarHBondContact O-N 3.3Å; L421-L424 PolarHBondContact O-N 3.29Å; L421-L424 VanDerWaalsContact O-N 3.13Å; L421-L425 HydrophobicContact CD1-CD1 4.21Å; L421-L425 HydrophobicContact CD1-CD2 4.15Å; L421-L425 HydrophobicContact CD1-CG 4.03Å; L421-L425 HydrophobicContact CG-CD1 4.18Å; L421-L425 HydrophobicContact CG-CG 4.34Å; L421-L425 WeakPolarHBondContact O-CG 3.41Å; L421-L425 PolarHBondContact O-N 2.88Å; L421-V443 HydrophobicContact CD1-CG1 4.34Å; L421-L446 HydrophobicContact CD1-CD1 4.37Å; L421-L450 HydrophobicContact CD2-CD1 3.89Å; L421-L450 HydrophobicContact CD2-CD2 4.07Å; L421-C454 VanDerWaalsContact CD2-SG 3.57Å; L421-V459 HydrophobicContact CD1-CG2 4.24Å; L421-V459 HydrophobicContact CD2-CG2 4.08Å
422	P	94.2	Very high	94.2	Very high	66 Å²	66	58.2 Å²	58.2	43%	0.429	30%	0.301	S	S	.	.	H	α-helix	trans	-54	-38.7	174.9	-28.6	35.7	0	0	0	113.6	Q417 R426	Q417-P422 VanDerWaalsContact O-CD 3.29Å; Q417-P422 WeakPolarHBondContact O-CD 3.49Å; P422-R426 PolarHBondContact O-N 3.36Å; P422-R426 VanDerWaalsContact O-N 3.12Å
423	S	94.2	Very high	94.3	Very high	31 Å²	31	59.4 Å²	59.4	22%	0.217	30%	0.298	C	S	.	.	H	α-helix	trans	-66	-44.3	178.1	-59.1	0	0	0	0	112	T419 L420 L421 R426 L427	T419-S423 WeakPolarHBondContact O-CB 3.19Å; T419-S423 PolarHBondContact O-N 3.2Å; T419-S423 PolarHBondContact O-OG 2.82Å; L420-S423 WeakPolarHBondContact O-CB 3.43Å; L420-S423 PolarHBondContact O-N 3.37Å; L420-S423 VanDerWaalsContact O-N 3.12Å; L421-S423 PolarHBondContact O-N 3.3Å; S423-R426 PolarHBondContact O-N 2.96Å; S423-L427 WeakPolarHBondContact O-CG 3.22Å; S423-L427 PolarHBondContact O-N 3.3Å
424	L	96.3	Very high	94.4	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-44.1	176	-69	170.1	0	0	0	112.2	L389 F401 F404 L420 L421 R426 L427 W428 V439 V443 L446	L389-L424 HydrophobicContact CD1-CD2 4.36Å; F401-L424 HydrophobicContact CE1-CD2 3.78Å; F404-L424 HydrophobicContact CE2-CD1 3.92Å; F404-L424 HydrophobicContact CE2-CD2 4.11Å; F404-L424 HydrophobicContact CZ-CD1 3.61Å; L420-L424 HydrophobicContact CD1-CD1 4.28Å; L420-L424 HydrophobicContact CD1-CG 4.3Å; L420-L424 HydrophobicContact CG-CD1 3.94Å; L420-L424 HydrophobicContact CG-CG 4.39Å; L420-L424 WeakPolarHBondContact O-CG 3.29Å; L420-L424 PolarHBondContact O-N 3.43Å; L421-L424 PolarHBondContact O-N 3.29Å; L421-L424 VanDerWaalsContact O-N 3.13Å; L424-R426 VanDerWaalsContact C-N 3.29Å; L424-R426 PolarHBondContact O-N 2.99Å; L424-L427 WeakPolarHBondContact O-CB 3.48Å; L424-L427 PolarHBondContact O-N 3.46Å; L424-W428 PolarHBondContact O-N 3.26Å; L424-W428 VanDerWaalsContact O-N 3.16Å; L424-V439 HydrophobicContact CB-CG1 4.31Å; L424-V439 HydrophobicContact CD2-CG2 4.45Å; L424-V439 WeakPolarHBondContact O-CG1 3.38Å; L424-V443 HydrophobicContact CB-CG2 4.13Å; L424-V443 HydrophobicContact CD1-CG2 3.95Å; L424-L446 HydrophobicContact CD1-CD1 3.79Å
425	L	95.1	Very high	94.5	Very high	35 Å²	35	52.8 Å²	52.8	18%	0.183	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-36.2	179.1	-62.5	-175.4	0	0	0	112	L421 T458 A462 W466	L421-L425 HydrophobicContact CD1-CD1 4.21Å; L421-L425 HydrophobicContact CD1-CD2 4.15Å; L421-L425 HydrophobicContact CD1-CG 4.03Å; L421-L425 HydrophobicContact CG-CD1 4.18Å; L421-L425 HydrophobicContact CG-CG 4.34Å; L421-L425 WeakPolarHBondContact O-CG 3.41Å; L421-L425 PolarHBondContact O-N 2.88Å; L425-T458 HydrophobicContact CD1-CG2 3.54Å; L425-A462 HydrophobicContact CD2-CB 3.73Å; L425-W466 HydrophobicContact CD2-CH2 4.32Å; L425-W466 HydrophobicContact CD2-CZ2 3.64Å
426	R	93.6	Very high	94.6	Very high	130 Å²	130	50.4 Å²	50.4	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-66	-40.2	171.2	-178.8	175.1	59.2	86.8	-0.1	111.8	N390 P422 S423 L424 W428 Q429	N390-R426 PolarHBondContact OD1-NH2 3.31Å; P422-R426 PolarHBondContact O-N 3.36Å; P422-R426 VanDerWaalsContact O-N 3.12Å; S423-R426 PolarHBondContact O-N 2.96Å; L424-R426 VanDerWaalsContact C-N 3.29Å; L424-R426 PolarHBondContact O-N 2.99Å; R426-W428 PolarHBondContact O-N 3.39Å; R426-Q429 WeakPolarHBondContact O-CB 3.4Å; R426-Q429 PolarHBondContact O-N 2.65Å; R426-Q429 VanDerWaalsContact O-N 3.08Å
427	L	95.8	Very high	94.6	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-20.1	179.7	-80	175.4	0	0	0	114.4	L389 K397 F401 S423 L424 Q429 D430 V435 V439	L389-L427 HydrophobicContact CB-CD1 3.91Å; L389-L427 HydrophobicContact CD2-CD1 3.75Å; L389-L427 HydrophobicContact CG-CD1 4.29Å; K397-L427 HydrophobicContact CD-CD2 3.89Å; F401-L427 HydrophobicContact CZ-CD1 4.37Å; S423-L427 WeakPolarHBondContact O-CG 3.22Å; S423-L427 PolarHBondContact O-N 3.3Å; L424-L427 WeakPolarHBondContact O-CB 3.48Å; L424-L427 PolarHBondContact O-N 3.46Å; L427-Q429 PolarHBondContact O-N 3.21Å; L427-Q429 VanDerWaalsContact O-N 3.07Å; L427-D430 WeakPolarHBondContact O-CB 3.25Å; L427-D430 PolarHBondContact O-N 3.31Å; L427-V435 HydrophobicContact CD2-CG1 4.43Å; L427-V439 HydrophobicContact CB-CG2 3.72Å
428	W	95.3	Very high	94.6	Very high	18 Å²	18	47.5 Å²	47.5	7%	0.068	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.7	170.7	-178.8	70.8	0	0	0	113	L424 R426 D430 R436 V439 A465 W466 D469 L577	L424-W428 PolarHBondContact O-N 3.26Å; L424-W428 VanDerWaalsContact O-N 3.16Å; R426-W428 PolarHBondContact O-N 3.39Å; W428-D430 VanDerWaalsContact C-N 3.28Å; W428-R436 WeakPolarHBondContact O-CD 3.23Å; W428-R436 VanDerWaalsContact O-CG 3.28Å; W428-R436 WeakPolarHBondContact O-CG 3.44Å; W428-V439 HydrophobicContact CB-CG1 4.22Å; W428-A465 HydrophobicContact CH2-CB 3.93Å; W428-A465 HydrophobicContact CZ3-CB 4.05Å; W428-W466 AromaticContact CD1-CD1 3.5Å; W428-W466 VanDerWaalsContact CD1-CD1 3.5Å; W428-W466 AromaticContact CD1-NE1 3.73Å; W428-W466 AromaticContact CD2-CD1 3.31Å; W428-W466 HydrophobicContact CD2-CG 4.48Å; W428-W466 AromaticContact CD2-NE1 3.6Å; W428-W466 AromaticContact CE2-CD1 3.27Å; W428-W466 AromaticContact CE3-CD1 3.93Å; W428-W466 AromaticContact CG-CD1 3.48Å; W428-W466 VanDerWaalsContact CG-CD1 3.48Å; W428-W466 AromaticContact CG-NE1 3.41Å; W428-W466 AromaticContact CZ2-CD1 3.83Å; W428-W466 AromaticContact NE1-CD1 3.41Å; W428-W466 AromaticContact NE1-CG 4Å; W428-D469 HydrophobicContact CZ2-CB 4.35Å; W428-D469 PolarHBondContact NE1-OD2 3.41Å; W428-D469 VanDerWaalsContact NE1-OD2 3.12Å; W428-L577 HydrophobicContact CH2-CD2 3.62Å; W428-L577 HydrophobicContact CZ3-CD2 3.91Å
429	Q	92.1	Very high	94.8	Very high	87 Å²	87	41.5 Å²	41.5	41%	0.407	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	3	172.9	-60	170.2	52.3	0	0	113.6	R426 L427 A574	R426-Q429 WeakPolarHBondContact O-CB 3.4Å; R426-Q429 PolarHBondContact O-N 2.65Å; R426-Q429 VanDerWaalsContact O-N 3.08Å; L427-Q429 PolarHBondContact O-N 3.21Å; L427-Q429 VanDerWaalsContact O-N 3.07Å; Q429-A574 HydrophobicContact CG-CB 3.78Å
430	D	94.5	Very high	95	Very high	26 Å²	26	37.9 Å²	37.9	14%	0.139	18%	0.175	C	C	.	.			trans	-62.9	142.4	-178.9	-160.7	-70.4	0	0	0	111.2	K397 L427 W428 N432 V435 R436	K397-D430 IonicContact NZ-OD2 3.52Å; K397-D430 PolarHBondContact NZ-OD2 3.03Å; L427-D430 WeakPolarHBondContact O-CB 3.25Å; L427-D430 PolarHBondContact O-N 3.31Å; W428-D430 VanDerWaalsContact C-N 3.28Å; D430-N432 PolarHBondContact O-N 2.92Å; D430-N432 WeakPolarHBondContact OD1-CB 3.41Å; D430-N432 PolarHBondContact OD1-N 3.12Å; D430-V435 HydrophobicContact CB-CB 3.89Å; D430-V435 HydrophobicContact CB-CG1 3.55Å; D430-R436 WeakPolarHBondContact O-CD 3.41Å; D430-R436 WeakPolarHBondContact O-CG 3.08Å; D430-R436 PolarHBondContact O-NH1 2.99Å
431	K	94.2	Very high	95.1	Very high	203 Å²	203	38.5 Å²	38.5	88%	0.883	18%	0.177	S	C	*	.	S	Bend	trans	-63.6	-35.5	179.2	-65	-179.6	-179.5	178	0	110.9	W433 R436	K431-W433 PolarHBondContact O-N 3.41Å; K431-R436 PolarHBondContact O-NH1 3.44Å
432	N	93.1	Very high	95.1	Very high	45 Å²	45	38.7 Å²	38.7	24%	0.241	18%	0.179	C	C	.	.	S	Bend	trans	-78	117.6	179.8	-171.5	-18.1	0	0	0	110.4	S394 D430 R434 V435 R436	S394-N432 VanDerWaalsContact CB-ND2 3.32Å; S394-N432 WeakPolarHBondContact CB-ND2 3.4Å; S394-N432 WeakPolarHBondContact OG-CB 3.47Å; D430-N432 PolarHBondContact O-N 2.92Å; D430-N432 WeakPolarHBondContact OD1-CB 3.41Å; D430-N432 PolarHBondContact OD1-N 3.12Å; N432-R434 PolarHBondContact O-N 2.75Å; N432-R434 WeakPolarHBondContact OD1-CB 3.22Å; N432-R434 PolarHBondContact OD1-N 3.02Å; N432-V435 HydrophobicContact CB-CG2 4.11Å; N432-V435 WeakPolarHBondContact O-CB 3.33Å; N432-V435 PolarHBondContact O-N 2.92Å; N432-V435 VanDerWaalsContact O-N 3.13Å; N432-R436 PolarHBondContact O-N 3.24Å
433	W	93.7	Very high	95.3	Very high	84 Å²	84	35.5 Å²	35.5	32%	0.318	16%	0.158	S	C	.	.	H	α-helix	trans	-63.7	-25.6	-179.7	72.4	-92.7	0	0	0	113	K431 V435 R436 L437 A471 C473 V474 I630	K431-W433 PolarHBondContact O-N 3.41Å; W433-V435 VanDerWaalsContact C-N 3.34Å; W433-R436 PolarHBondContact O-N 3.12Å; W433-L437 HydrophobicContact CE3-CB 4.3Å; W433-L437 HydrophobicContact CZ3-CB 4.37Å; W433-L437 HydrophobicContact CZ3-CD2 3.77Å; W433-L437 WeakPolarHBondContact O-CB 3.37Å; W433-L437 PolarHBondContact O-N 3.08Å; W433-A471 HydrophobicContact CB-CB 3.89Å; W433-A471 HydrophobicContact CG-CB 4.35Å; W433-C473 WeakPolarHBondContact CZ3-SG 3.46Å; W433-V474 HydrophobicContact CE3-CG2 4.4Å; W433-I630 HydrophobicContact CH2-CD1 3.8Å; W433-I630 HydrophobicContact CH2-CG1 4.5Å; W433-I630 HydrophobicContact CZ3-CD1 4.39Å
434	R	93.5	Very high	95.4	Very high	24 Å²	24	35 Å²	35	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-66.3	-37.3	175	-67.5	-170.8	79.1	88.2	-1.8	111.5	N432 L437 G438 Y619 S620 P626 A628	N432-R434 PolarHBondContact O-N 2.75Å; N432-R434 WeakPolarHBondContact OD1-CB 3.22Å; N432-R434 PolarHBondContact OD1-N 3.02Å; R434-L437 PolarHBondContact O-N 2.84Å; R434-G438 PolarHBondContact O-N 2.97Å; R434-Y619 VanDerWaalsContact C-OH 3.29Å; R434-Y619 PolarHBondContact O-OH 2.93Å; R434-S620 PolarHBondContact NH2-O 3.07Å; R434-P626 PolarHBondContact NH1-O 3.36Å; R434-P626 VanDerWaalsContact NH1-O 3.15Å; R434-A628 PolarHBondContact NH2-O 3.02Å
435	V	95.5	Very high	95.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.4	-45.2	173.1	174.4	0	0	0	0	109.9	K397 F401 L427 D430 N432 W433 L437 G438 V439	K397-V435 HydrophobicContact CB-CG2 4.34Å; K397-V435 HydrophobicContact CD-CG1 3.99Å; K397-V435 HydrophobicContact CD-CG2 4.13Å; F401-V435 HydrophobicContact CE2-CB 4.44Å; F401-V435 HydrophobicContact CE2-CG1 4Å; F401-V435 HydrophobicContact CZ-CG1 4.38Å; L427-V435 HydrophobicContact CD2-CG1 4.43Å; D430-V435 HydrophobicContact CB-CB 3.89Å; D430-V435 HydrophobicContact CB-CG1 3.55Å; N432-V435 HydrophobicContact CB-CG2 4.11Å; N432-V435 WeakPolarHBondContact O-CB 3.33Å; N432-V435 PolarHBondContact O-N 2.92Å; N432-V435 VanDerWaalsContact O-N 3.13Å; W433-V435 VanDerWaalsContact C-N 3.34Å; V435-L437 PolarHBondContact O-N 2.91Å; V435-G438 PolarHBondContact O-N 3.11Å; V435-V439 WeakPolarHBondContact O-CG2 3.39Å; V435-V439 PolarHBondContact O-N 2.95Å
436	R	96.3	Very high	95.5	Very high	27 Å²	27	36.1 Å²	36.1	10%	0.102	17%	0.165	C	C	.	.	H	α-helix	trans	-61.7	-42.9	175.7	-58.5	-162	-57.7	-82	1.4	112.3	W428 D430 K431 N432 W433 G438 V439 V440 D469 V474	W428-R436 WeakPolarHBondContact O-CD 3.23Å; W428-R436 VanDerWaalsContact O-CG 3.28Å; W428-R436 WeakPolarHBondContact O-CG 3.44Å; D430-R436 WeakPolarHBondContact O-CD 3.41Å; D430-R436 WeakPolarHBondContact O-CG 3.08Å; D430-R436 PolarHBondContact O-NH1 2.99Å; K431-R436 PolarHBondContact O-NH1 3.44Å; N432-R436 PolarHBondContact O-N 3.24Å; W433-R436 PolarHBondContact O-N 3.12Å; R436-G438 VanDerWaalsContact C-N 3.34Å; R436-V439 PolarHBondContact O-N 3.41Å; R436-V440 WeakPolarHBondContact O-CG2 3.27Å; R436-V440 PolarHBondContact O-N 3.24Å; R436-V440 VanDerWaalsContact O-N 3.09Å; R436-D469 WeakPolarHBondContact CD-OD2 3.23Å; R436-D469 IonicContact CZ-OD1 3.37Å; R436-D469 IonicContact CZ-OD2 3.45Å; R436-D469 IonicContact NE-OD1 2.82Å; R436-D469 PolarHBondContact NE-OD1 3.41Å; R436-D469 IonicContact NE-OD2 3.68Å; R436-D469 PolarHBondContact NE-OD2 3.14Å; R436-D469 IonicContact NH2-OD1 2.82Å; R436-D469 PolarHBondContact NH2-OD1 3.19Å; R436-D469 IonicContact NH2-OD2 2.68Å; R436-V474 HydrophobicContact CB-CG1 4.49Å; R436-V474 HydrophobicContact CB-CG2 4.42Å
437	L	95.7	Very high	95.7	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-59.3	-46.5	173.8	179.1	61.7	0	0	0	110.8	W433 R434 V435 V439 V440 Q441 V474 C477	W433-L437 HydrophobicContact CE3-CB 4.3Å; W433-L437 HydrophobicContact CZ3-CB 4.37Å; W433-L437 HydrophobicContact CZ3-CD2 3.77Å; W433-L437 WeakPolarHBondContact O-CB 3.37Å; W433-L437 PolarHBondContact O-N 3.08Å; R434-L437 PolarHBondContact O-N 2.84Å; V435-L437 PolarHBondContact O-N 2.91Å; L437-V439 VanDerWaalsContact C-N 3.3Å; L437-V439 PolarHBondContact O-N 3.17Å; L437-V440 PolarHBondContact O-N 3.37Å; L437-V440 VanDerWaalsContact O-N 3.11Å; L437-Q441 HydrophobicContact CD1-CG 3.97Å; L437-Q441 HydrophobicContact CG-CG 4.33Å; L437-Q441 WeakPolarHBondContact O-CB 3.26Å; L437-Q441 PolarHBondContact O-N 3.11Å; L437-V474 HydrophobicContact CB-CG2 3.96Å; L437-C477 HydrophobicContact CD1-CB 3.78Å
438	G	95.6	Very high	95.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.2	-42.2	177.9	0	0	0	0	0	112.3	R434 V435 R436 S442 Y619	R434-G438 PolarHBondContact O-N 2.97Å; V435-G438 PolarHBondContact O-N 3.11Å; R436-G438 VanDerWaalsContact C-N 3.34Å; G438-S442 WeakPolarHBondContact O-CB 3.5Å; G438-S442 PolarHBondContact O-N 3.37Å; G438-S442 PolarHBondContact O-OG 3.08Å; G438-Y619 VanDerWaalsContact CA-CE2 3.47Å
439	V	97.7	Very high	95.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.2	-52.5	172.2	172.7	0	0	0	0	111.3	F401 L424 L427 W428 V435 R436 L437 Q441 S442 V443 W466	F401-V439 HydrophobicContact CE1-CG2 4.12Å; F401-V439 HydrophobicContact CZ-CG2 3.74Å; L424-V439 HydrophobicContact CB-CG1 4.31Å; L424-V439 HydrophobicContact CD2-CG2 4.45Å; L424-V439 WeakPolarHBondContact O-CG1 3.38Å; L427-V439 HydrophobicContact CB-CG2 3.72Å; W428-V439 HydrophobicContact CB-CG1 4.22Å; V435-V439 WeakPolarHBondContact O-CG2 3.39Å; V435-V439 PolarHBondContact O-N 2.95Å; R436-V439 PolarHBondContact O-N 3.41Å; L437-V439 VanDerWaalsContact C-N 3.3Å; L437-V439 PolarHBondContact O-N 3.17Å; V439-Q441 VanDerWaalsContact C-N 3.3Å; V439-Q441 PolarHBondContact O-N 3.44Å; V439-S442 PolarHBondContact O-N 2.99Å; V439-V443 HydrophobicContact CG1-CG2 4.03Å; V439-V443 VanDerWaalsContact O-CG2 3.26Å; V439-V443 WeakPolarHBondContact O-CG2 3.36Å; V439-V443 PolarHBondContact O-N 3.49Å; V439-W466 HydrophobicContact CG1-CZ2 4.37Å
440	V	97.9	Very high	95.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-34	-175.1	-179.6	0	0	0	0	112.1	R436 L437 P444 W466 V474 C477 A478	R436-V440 WeakPolarHBondContact O-CG2 3.27Å; R436-V440 PolarHBondContact O-N 3.24Å; R436-V440 VanDerWaalsContact O-N 3.09Å; L437-V440 PolarHBondContact O-N 3.37Å; L437-V440 VanDerWaalsContact O-N 3.11Å; V440-P444 WeakPolarHBondContact O-CD 3.28Å; V440-W466 HydrophobicContact CB-CE3 4.33Å; V440-W466 HydrophobicContact CG1-CE3 3.93Å; V440-W466 HydrophobicContact CG2-CB 4.04Å; V440-W466 HydrophobicContact CG2-CD2 3.73Å; V440-W466 HydrophobicContact CG2-CE3 3.9Å; V440-W466 HydrophobicContact CG2-CG 3.81Å; V440-V474 HydrophobicContact CG2-CG1 3.83Å; V440-C477 HydrophobicContact CG1-CB 4.02Å; V440-A478 HydrophobicContact CG1-CB 3.97Å
441	Q	95.7	Very high	96	Very high	19 Å²	19	37.3 Å²	37.3	9%	0.089	18%	0.183	C	C	.	.	H	α-helix	trans	-75.3	-33.3	175.3	-76.9	-177.6	-45.1	0	0	113.2	L437 V439 C477 E616 Y619 G629	L437-Q441 HydrophobicContact CD1-CG 3.97Å; L437-Q441 HydrophobicContact CG-CG 4.33Å; L437-Q441 WeakPolarHBondContact O-CB 3.26Å; L437-Q441 PolarHBondContact O-N 3.11Å; V439-Q441 VanDerWaalsContact C-N 3.3Å; V439-Q441 PolarHBondContact O-N 3.44Å; Q441-C477 HydrophobicContact CG-CB 4.36Å; Q441-C477 WeakPolarHBondContact CG-SG 3.1Å; Q441-E616 HydrophobicContact CG-CG 4.36Å; Q441-E616 PolarHBondContact NE2-OE2 2.95Å; Q441-Y619 VanDerWaalsContact OE1-CD2 3.29Å; Q441-G629 PolarHBondContact NE2-O 3.14Å
442	S	97.1	Very high	96	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-83.4	-39.6	-174.7	-65.2	0	0	0	0	113.6	F401 F404 G438 V439 P444 C445	F401-S442 WeakPolarHBondContact CD1-OG 3.32Å; F404-S442 VanDerWaalsContact CD1-CB 3.48Å; F404-S442 VanDerWaalsContact CE1-O 3.26Å; F404-S442 WeakPolarHBondContact CE1-O 3.42Å; G438-S442 WeakPolarHBondContact O-CB 3.5Å; G438-S442 PolarHBondContact O-N 3.37Å; G438-S442 PolarHBondContact O-OG 3.08Å; V439-S442 PolarHBondContact O-N 2.99Å; S442-P444 VanDerWaalsContact C-CD 3.44Å; S442-P444 VanDerWaalsContact C-N 3.33Å; S442-C445 WeakPolarHBondContact O-CB 3.47Å; S442-C445 PolarHBondContact O-N 3.31Å
443	V	98	Very high	96.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-57.4	-35.5	-175.1	169.9	0	0	0	0	113.9	L421 L424 V439 C445 L446 Y447 V459 W466	L421-V443 HydrophobicContact CD1-CG1 4.34Å; L424-V443 HydrophobicContact CB-CG2 4.13Å; L424-V443 HydrophobicContact CD1-CG2 3.95Å; V439-V443 HydrophobicContact CG1-CG2 4.03Å; V439-V443 VanDerWaalsContact O-CG2 3.26Å; V439-V443 WeakPolarHBondContact O-CG2 3.36Å; V439-V443 PolarHBondContact O-N 3.49Å; V443-C445 PolarHBondContact O-N 3Å; V443-L446 VanDerWaalsContact O-CB 3.28Å; V443-L446 WeakPolarHBondContact O-CB 3.43Å; V443-L446 WeakPolarHBondContact O-CG 3.35Å; V443-L446 PolarHBondContact O-N 2.83Å; V443-Y447 HydrophobicContact CG1-CE1 3.69Å; V443-Y447 WeakPolarHBondContact O-CE1 3.48Å; V443-V459 HydrophobicContact CG1-CG1 4.29Å; V443-W466 HydrophobicContact CB-CH2 3.91Å; V443-W466 HydrophobicContact CB-CZ3 4.47Å; V443-W466 HydrophobicContact CG1-CH2 3.77Å; V443-W466 HydrophobicContact CG1-CZ3 4.42Å; V443-W466 HydrophobicContact CG2-CH2 4.04Å
444	P	97.5	Very high	96.2	Very high	19 Å²	19	32.6 Å²	32.6	12%	0.123	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-54.4	-29.9	173.4	-30.3	37.3	0	0	0	115.6	V440 S442 L446 Y447 S481	V440-P444 WeakPolarHBondContact O-CD 3.28Å; S442-P444 VanDerWaalsContact C-CD 3.44Å; S442-P444 VanDerWaalsContact C-N 3.33Å; P444-L446 PolarHBondContact O-N 2.83Å; P444-L446 VanDerWaalsContact O-N 3.13Å; P444-Y447 HydrophobicContact CB-CD2 4.25Å; P444-Y447 HydrophobicContact CB-CE2 3.89Å; P444-Y447 HydrophobicContact CG-CE2 4.16Å; P444-Y447 PolarHBondContact O-N 2.96Å; P444-S481 WeakPolarHBondContact CG-OG 3.41Å
445	C	95.7	Very high	96.4	Very high	60 Å²	60	31.7 Å²	31.7	41%	0.405	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-66.9	-9.5	175.5	-59.5	0	0	0	0	113.4	F404 S442 V443	F404-C445 HydrophobicContact CD1-CB 4.35Å; F404-C445 HydrophobicContact CE1-CB 4.36Å; S442-C445 WeakPolarHBondContact O-CB 3.47Å; S442-C445 PolarHBondContact O-N 3.31Å; V443-C445 PolarHBondContact O-N 3Å
446	L	97.6	Very high	96.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-95.3	-12.7	179.1	-50.8	-174.6	0	0	0	112.8	F404 V408 I416 L420 L421 L424 V443 P444 D448 K449 L450	F404-L446 HydrophobicContact CE1-CD2 3.72Å; F404-L446 HydrophobicContact CE1-CG 4.16Å; F404-L446 HydrophobicContact CZ-CD1 4.29Å; F404-L446 HydrophobicContact CZ-CD2 3.9Å; F404-L446 HydrophobicContact CZ-CG 4.3Å; V408-L446 HydrophobicContact CB-CD2 4.38Å; V408-L446 HydrophobicContact CG1-CD2 3.53Å; V408-L446 HydrophobicContact CG2-CD2 4.01Å; I416-L446 HydrophobicContact CG2-CB 4.2Å; I416-L446 HydrophobicContact CG2-CD1 4.01Å; I416-L446 HydrophobicContact CG2-CD2 3.83Å; I416-L446 HydrophobicContact CG2-CG 4.23Å; L420-L446 HydrophobicContact CD2-CD2 4.33Å; L421-L446 HydrophobicContact CD1-CD1 4.37Å; L424-L446 HydrophobicContact CD1-CD1 3.79Å; V443-L446 VanDerWaalsContact O-CB 3.28Å; V443-L446 WeakPolarHBondContact O-CB 3.43Å; V443-L446 WeakPolarHBondContact O-CG 3.35Å; V443-L446 PolarHBondContact O-N 2.83Å; P444-L446 PolarHBondContact O-N 2.83Å; P444-L446 VanDerWaalsContact O-N 3.13Å; L446-D448 VanDerWaalsContact C-N 3.32Å; L446-D448 PolarHBondContact O-N 3.32Å; L446-K449 PolarHBondContact O-N 2.99Å; L446-L450 HydrophobicContact CB-CD1 3.84Å; L446-L450 HydrophobicContact CB-CG 4.33Å; L446-L450 WeakPolarHBondContact O-CG 3.37Å; L446-L450 PolarHBondContact O-N 3.38Å
447	Y	97.5	Very high	96.1	Very high	10 Å²	10	36.6 Å²	36.6	4%	0.039	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-62.7	-36.5	-166.2	-67	-12.1	0	0	0	113.5	V443 P444 K449 L455 V459 N463 S481 R484 L485 A488	V443-Y447 HydrophobicContact CG1-CE1 3.69Å; V443-Y447 WeakPolarHBondContact O-CE1 3.48Å; P444-Y447 HydrophobicContact CB-CD2 4.25Å; P444-Y447 HydrophobicContact CB-CE2 3.89Å; P444-Y447 HydrophobicContact CG-CE2 4.16Å; P444-Y447 PolarHBondContact O-N 2.96Å; Y447-K449 PolarHBondContact O-N 2.76Å; Y447-L455 HydrophobicContact CD1-CD2 3.81Å; Y447-L455 HydrophobicContact CE1-CD2 4.48Å; Y447-L455 HydrophobicContact CG-CD2 4.32Å; Y447-V459 HydrophobicContact CD1-CG1 4.41Å; Y447-V459 HydrophobicContact CE1-CG1 3.51Å; Y447-N463 PolarHBondContact OH-ND2 2.82Å; Y447-S481 PolarHBondContact OH-OG 2.82Å; Y447-R484 HydrophobicContact CD2-CB 4.26Å; Y447-R484 HydrophobicContact CE2-CB 4.02Å; Y447-L485 HydrophobicContact CD1-CD1 4.42Å; Y447-L485 HydrophobicContact CD2-CB 4.35Å; Y447-L485 HydrophobicContact CD2-CD1 4.42Å; Y447-L485 HydrophobicContact CE1-CD1 4.24Å; Y447-L485 HydrophobicContact CE2-CB 3.68Å; Y447-L485 HydrophobicContact CE2-CD1 4.23Å; Y447-A488 HydrophobicContact CD2-CB 4.33Å; Y447-A488 HydrophobicContact CG-CB 4.41Å
448	D	95.1	Very high	96	Very high	113 Å²	113	39.3 Å²	39.3	60%	0.604	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-75.5	-11.9	177	73.7	-44.6	0	0	0	113.4	L446	L446-D448 VanDerWaalsContact C-N 3.32Å; L446-D448 PolarHBondContact O-N 3.32Å
449	K	95.4	Very high	96.1	Very high	96 Å²	96	39.3 Å²	39.3	42%	0.417	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-99.5	-10.6	178.5	-53.2	-51.4	-175.8	-145	0	113.5	I416 L446 Y447	I416-K449 HydrophobicContact CD1-CB 3.97Å; I416-K449 HydrophobicContact CD1-CG 4Å; L446-K449 PolarHBondContact O-N 2.99Å; Y447-K449 PolarHBondContact O-N 2.76Å
450	L	96.7	Very high	96	Very high	13 Å²	13	39.3 Å²	39.3	7%	0.068	21%	0.209	C	C	.	.	S	Bend	trans	-103.1	140.5	-173.3	-70.2	169.8	0	0	0	111.7	I416 Q417 L421 L446 L455 V459	I416-L450 HydrophobicContact CG2-CD2 4.17Å; Q417-L450 HydrophobicContact CB-CD2 3.81Å; Q417-L450 HydrophobicContact CG-CD2 4.11Å; L421-L450 HydrophobicContact CD2-CD1 3.89Å; L421-L450 HydrophobicContact CD2-CD2 4.07Å; L446-L450 HydrophobicContact CB-CD1 3.84Å; L446-L450 HydrophobicContact CB-CG 4.33Å; L446-L450 WeakPolarHBondContact O-CG 3.37Å; L446-L450 PolarHBondContact O-N 3.38Å; L450-L455 HydrophobicContact CB-CD2 3.88Å; L450-L455 HydrophobicContact CB-CG 4.2Å; L450-L455 HydrophobicContact CD1-CD2 3.99Å; L450-V459 HydrophobicContact CD1-CG2 4.17Å
451	P	96.2	Very high	95.9	Very high	60 Å²	60	40 Å²	40	39%	0.39	21%	0.213	S	C	.	.			trans	-61.6	148	172.3	-22	32.9	0	0	0	112.3	N453 C454 L455	P451-N453 VanDerWaalsContact C-N 3.28Å; P451-N453 PolarHBondContact O-N 3.12Å; P451-C454 WeakPolarHBondContact O-CA 3.42Å; P451-C454 VanDerWaalsContact O-CB 3.3Å; P451-C454 WeakPolarHBondContact O-CB 3.21Å; P451-C454 PolarHBondContact O-N 3.32Å; P451-L455 PolarHBondContact O-N 3.48Å; P451-L455 VanDerWaalsContact O-N 3.13Å
452	E	95.2	Very high	95.9	Very high	101 Å²	101	39.4 Å²	39.4	47%	0.472	21%	0.212	S	C	.	.	H	α-helix	trans	-55.7	-40.6	-178	-164.5	-175.7	163.9	0	0	113	C454 L455 Q456 C489	E452-C454 PolarHBondContact O-N 2.99Å; E452-L455 WeakPolarHBondContact O-CB 3.28Å; E452-L455 PolarHBondContact O-N 3.09Å; E452-L455 VanDerWaalsContact O-N 3.13Å; E452-Q456 HydrophobicContact CG-CG 4.48Å; E452-Q456 WeakPolarHBondContact O-CG 3.44Å; E452-Q456 PolarHBondContact O-N 3.21Å; E452-Q456 PolarHBondContact OE1-NE2 2.98Å; E452-C489 HydrophobicContact CG-CB 4.46Å; E452-C489 WeakPolarHBondContact CG-SG 3.46Å
453	N	94.7	Very high	95.8	Very high	122 Å²	122	39.1 Å²	39.1	65%	0.652	21%	0.21	S	C	*	.	H	α-helix	trans	-60.1	-35.6	176.8	-69.4	-34.3	0	0	0	112.3	P451 E457	P451-N453 VanDerWaalsContact C-N 3.28Å; P451-N453 PolarHBondContact O-N 3.12Å; N453-E457 VanDerWaalsContact O-CB 3.32Å; N453-E457 WeakPolarHBondContact O-CB 3.47Å; N453-E457 WeakPolarHBondContact O-CG 3.32Å; N453-E457 PolarHBondContact O-N 3.4Å
454	C	95.9	Very high	95.8	Very high	11 Å²	11	39.4 Å²	39.4	7%	0.074	21%	0.211	C	C	.	.	H	α-helix	trans	-70.7	-40.9	176.3	-175.2	0	0	0	0	111.1	L421 P451 E452 Q456 T458 V459	L421-C454 VanDerWaalsContact CD2-SG 3.57Å; P451-C454 WeakPolarHBondContact O-CA 3.42Å; P451-C454 VanDerWaalsContact O-CB 3.3Å; P451-C454 WeakPolarHBondContact O-CB 3.21Å; P451-C454 PolarHBondContact O-N 3.32Å; E452-C454 PolarHBondContact O-N 2.99Å; C454-Q456 VanDerWaalsContact C-N 3.32Å; C454-Q456 PolarHBondContact O-N 3.36Å; C454-T458 WeakPolarHBondContact O-CA 3.09Å; C454-T458 VanDerWaalsContact O-CB 3.27Å; C454-T458 WeakPolarHBondContact O-CB 3.25Å; C454-T458 PolarHBondContact O-N 3.43Å; C454-V459 PolarHBondContact O-N 3.4Å; C454-V459 VanDerWaalsContact O-N 3.11Å
455	L	96.8	Very high	95.7	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.021	21%	0.205	C	C	.	.	I	π-helix	trans	-59.1	-44	174	-64.9	-179.6	0	0	0	111.6	Y447 L450 P451 E452 V459 L460 L485 A488 C489	Y447-L455 HydrophobicContact CD1-CD2 3.81Å; Y447-L455 HydrophobicContact CE1-CD2 4.48Å; Y447-L455 HydrophobicContact CG-CD2 4.32Å; L450-L455 HydrophobicContact CB-CD2 3.88Å; L450-L455 HydrophobicContact CB-CG 4.2Å; L450-L455 HydrophobicContact CD1-CD2 3.99Å; P451-L455 PolarHBondContact O-N 3.48Å; P451-L455 VanDerWaalsContact O-N 3.13Å; E452-L455 WeakPolarHBondContact O-CB 3.28Å; E452-L455 PolarHBondContact O-N 3.09Å; E452-L455 VanDerWaalsContact O-N 3.13Å; L455-V459 HydrophobicContact CD2-CB 4.36Å; L455-V459 HydrophobicContact CD2-CG2 4.02Å; L455-V459 PolarHBondContact O-N 3.03Å; L455-L460 WeakPolarHBondContact O-CB 3.14Å; L455-L460 PolarHBondContact O-N 2.8Å; L455-L485 HydrophobicContact CB-CD1 3.99Å; L455-L485 HydrophobicContact CD2-CD1 3.93Å; L455-L485 HydrophobicContact CG-CD1 4.37Å; L455-A488 HydrophobicContact CD1-CB 4.43Å; L455-C489 HydrophobicContact CB-CB 4.11Å; L455-C489 HydrophobicContact CD1-CB 3.88Å
456	Q	94.5	Very high	95.7	Very high	26 Å²	26	35.8 Å²	35.8	12%	0.121	19%	0.186	C	C	.	.	I	π-helix	trans	-75.3	-43.6	-178.4	-67.6	-168.1	25.8	0	0	114.3	E452 C454 P461 C489 A492	E452-Q456 HydrophobicContact CG-CG 4.48Å; E452-Q456 WeakPolarHBondContact O-CG 3.44Å; E452-Q456 PolarHBondContact O-N 3.21Å; E452-Q456 PolarHBondContact OE1-NE2 2.98Å; C454-Q456 VanDerWaalsContact C-N 3.32Å; C454-Q456 PolarHBondContact O-N 3.36Å; Q456-P461 WeakPolarHBondContact O-CD 3.45Å; Q456-C489 WeakPolarHBondContact CG-SG 3.41Å; Q456-A492 HydrophobicContact CG-CB 4.26Å
457	E	92.2	Very high	95.7	Very high	104 Å²	104	35.8 Å²	35.8	49%	0.486	19%	0.186	S	C	.	.	I	π-helix	trans	-95.4	-14.1	-170.2	-60.4	-58	150.8	0	0	113.4	N453 K495	N453-E457 VanDerWaalsContact O-CB 3.32Å; N453-E457 WeakPolarHBondContact O-CB 3.47Å; N453-E457 WeakPolarHBondContact O-CG 3.32Å; N453-E457 PolarHBondContact O-N 3.4Å; E457-K495 IonicContact OE1-NZ 3.9Å; E457-K495 PolarHBondContact OE1-NZ 2.87Å
458	T	93.6	Very high	95.6	Very high	61 Å²	61	38.2 Å²	38.2	37%	0.374	20%	0.195	S	C	.	.	I	π-helix	trans	-123.7	-55.2	-176.7	-49.6	0	0	0	0	111.8	L425 C454 A462	L425-T458 HydrophobicContact CD1-CG2 3.54Å; C454-T458 WeakPolarHBondContact O-CA 3.09Å; C454-T458 VanDerWaalsContact O-CB 3.27Å; C454-T458 WeakPolarHBondContact O-CB 3.25Å; C454-T458 PolarHBondContact O-N 3.43Å; T458-A462 PolarHBondContact O-N 3.38Å
459	V	96.4	Very high	95.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	I	π-helix	trans	-71.7	-45.4	-175.7	-179.7	0	0	0	0	111.6	L421 V443 Y447 L450 C454 L455 A462 N463 L485	L421-V459 HydrophobicContact CD1-CG2 4.24Å; L421-V459 HydrophobicContact CD2-CG2 4.08Å; V443-V459 HydrophobicContact CG1-CG1 4.29Å; Y447-V459 HydrophobicContact CD1-CG1 4.41Å; Y447-V459 HydrophobicContact CE1-CG1 3.51Å; L450-V459 HydrophobicContact CD1-CG2 4.17Å; C454-V459 PolarHBondContact O-N 3.4Å; C454-V459 VanDerWaalsContact O-N 3.11Å; L455-V459 HydrophobicContact CD2-CB 4.36Å; L455-V459 HydrophobicContact CD2-CG2 4.02Å; L455-V459 PolarHBondContact O-N 3.03Å; V459-A462 PolarHBondContact O-N 2.91Å; V459-N463 WeakPolarHBondContact O-CB 3.39Å; V459-N463 PolarHBondContact O-N 3.33Å; V459-L485 HydrophobicContact CB-CD1 4.5Å; V459-L485 HydrophobicContact CG1-CD1 4.04Å; V459-L485 HydrophobicContact CG1-CD2 4.06Å
460	L	96.3	Very high	95.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-50.2	-179.4	171.8	71.3	0	0	0	112.7	L455 A462 N463 L464 L482 L485 A492 K495 A496	L455-L460 WeakPolarHBondContact O-CB 3.14Å; L455-L460 PolarHBondContact O-N 2.8Å; L460-A462 VanDerWaalsContact C-N 3.28Å; L460-A462 PolarHBondContact O-N 3.15Å; L460-N463 PolarHBondContact O-N 2.98Å; L460-L464 HydrophobicContact CD1-CD1 4.23Å; L460-L464 HydrophobicContact CD1-CG 4.19Å; L460-L464 HydrophobicContact CG-CD1 4.2Å; L460-L464 WeakPolarHBondContact O-CG 3.38Å; L460-L464 PolarHBondContact O-N 2.72Å; L460-L482 HydrophobicContact CD1-CD1 3.82Å; L460-L485 HydrophobicContact CB-CD2 3.89Å; L460-L485 HydrophobicContact CD1-CD2 4.03Å; L460-A492 HydrophobicContact CD2-CB 4.07Å; L460-K495 HydrophobicContact CD2-CB 3.53Å; L460-K495 HydrophobicContact CD2-CD 4.45Å; L460-A496 HydrophobicContact CD1-CB 3.81Å
461	P	95.3	Very high	95.4	Very high	15 Å²	15	33.8 Å²	33.8	10%	0.097	19%	0.185	C	C	.	.	H	α-helix	trans	-54.3	-43.5	174.1	-29.4	36.2	0	0	0	113.1	Q456 L464 A465 V500 T578 A582	Q456-P461 WeakPolarHBondContact O-CD 3.45Å; P461-L464 PolarHBondContact O-N 3.18Å; P461-A465 PolarHBondContact O-N 3.23Å; P461-V500 HydrophobicContact CG-CG2 4.43Å; P461-T578 HydrophobicContact CB-CG2 3.67Å; P461-A582 HydrophobicContact CB-CB 3.94Å; P461-A582 HydrophobicContact CG-CB 4.46Å
462	A	95.8	Very high	95.2	Very high	7 Å²	7	35.8 Å²	35.8	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-45.3	177.4	0	0	0	0	0	111.7	L425 T458 V459 L460 L464 A465 W466	L425-A462 HydrophobicContact CD2-CB 3.73Å; T458-A462 PolarHBondContact O-N 3.38Å; V459-A462 PolarHBondContact O-N 2.91Å; L460-A462 VanDerWaalsContact C-N 3.28Å; L460-A462 PolarHBondContact O-N 3.15Å; A462-L464 VanDerWaalsContact C-N 3.33Å; A462-L464 PolarHBondContact O-N 3.28Å; A462-A465 CarbonylContact O-C 3.59Å; A462-A465 WeakPolarHBondContact O-CA 3.46Å; A462-A465 VanDerWaalsContact O-CB 3.26Å; A462-A465 WeakPolarHBondContact O-CB 3.09Å; A462-A465 PolarHBondContact O-N 2.86Å; A462-W466 HydrophobicContact CB-CZ2 3.83Å; A462-W466 PolarHBondContact O-N 3.4Å; A462-W466 PolarHBondContact O-NE1 2.87Å
463	N	96.6	Very high	95.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.3	-42.5	179	-157.3	-50.5	0	0	0	112.1	Y447 V459 L460 A465 W466 L467 A478 S481 L482 L485	Y447-N463 PolarHBondContact OH-ND2 2.82Å; V459-N463 WeakPolarHBondContact O-CB 3.39Å; V459-N463 PolarHBondContact O-N 3.33Å; L460-N463 PolarHBondContact O-N 2.98Å; N463-A465 PolarHBondContact O-N 3.33Å; N463-W466 HydrophobicContact CB-CE3 3.95Å; N463-W466 HydrophobicContact CB-CZ3 4.1Å; N463-W466 WeakPolarHBondContact O-CB 3.44Å; N463-W466 PolarHBondContact O-N 3.45Å; N463-W466 VanDerWaalsContact O-N 3.09Å; N463-L467 PolarHBondContact O-N 3.37Å; N463-A478 PolarHBondContact OD1-O 3.28Å; N463-S481 PolarHBondContact ND2-OG 2.74Å; N463-L482 PolarHBondContact ND2-N 2.86Å; N463-L482 WeakPolarHBondContact OD1-CB 3.4Å; N463-L485 HydrophobicContact CB-CD2 4.34Å
464	L	96.4	Very high	95.1	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-32.3	173.1	-68.5	172.2	0	0	0	112.6	L460 P461 A462 L467 L482 A581 L586	L460-L464 HydrophobicContact CD1-CD1 4.23Å; L460-L464 HydrophobicContact CD1-CG 4.19Å; L460-L464 HydrophobicContact CG-CD1 4.2Å; L460-L464 WeakPolarHBondContact O-CG 3.38Å; L460-L464 PolarHBondContact O-N 2.72Å; P461-L464 PolarHBondContact O-N 3.18Å; A462-L464 VanDerWaalsContact C-N 3.33Å; A462-L464 PolarHBondContact O-N 3.28Å; L464-L467 HydrophobicContact CD2-CD1 4.16Å; L464-L482 HydrophobicContact CD2-CD2 4.42Å; L464-A581 HydrophobicContact CB-CB 4.46Å; L464-L586 HydrophobicContact CD2-CD2 4.42Å; L464-L586 HydrophobicContact CD2-CG 4.44Å
465	A	95.1	Very high	95.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-71.5	-38.5	172.9	0	0	0	0	0	112.2	W428 P461 A462 N463 L467 R468 A581	W428-A465 HydrophobicContact CH2-CB 3.93Å; W428-A465 HydrophobicContact CZ3-CB 4.05Å; P461-A465 PolarHBondContact O-N 3.23Å; A462-A465 CarbonylContact O-C 3.59Å; A462-A465 WeakPolarHBondContact O-CA 3.46Å; A462-A465 VanDerWaalsContact O-CB 3.26Å; A462-A465 WeakPolarHBondContact O-CB 3.09Å; A462-A465 PolarHBondContact O-N 2.86Å; N463-A465 PolarHBondContact O-N 3.33Å; A465-L467 PolarHBondContact O-N 3.11Å; A465-R468 WeakPolarHBondContact O-CA 3.31Å; A465-R468 WeakPolarHBondContact O-CB 3.43Å; A465-R468 PolarHBondContact O-N 2.7Å; A465-A581 HydrophobicContact CB-CB 4.12Å
466	W	97	Very high	94.9	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-30.1	178.9	-54.5	-18.4	0	0	0	113	L425 W428 V439 V440 V443 A462 N463 R468 D469 A478	L425-W466 HydrophobicContact CD2-CH2 4.32Å; L425-W466 HydrophobicContact CD2-CZ2 3.64Å; W428-W466 AromaticContact CD1-CD1 3.5Å; W428-W466 VanDerWaalsContact CD1-CD1 3.5Å; W428-W466 AromaticContact CD1-NE1 3.73Å; W428-W466 AromaticContact CD2-CD1 3.31Å; W428-W466 HydrophobicContact CD2-CG 4.48Å; W428-W466 AromaticContact CD2-NE1 3.6Å; W428-W466 AromaticContact CE2-CD1 3.27Å; W428-W466 AromaticContact CE3-CD1 3.93Å; W428-W466 AromaticContact CG-CD1 3.48Å; W428-W466 VanDerWaalsContact CG-CD1 3.48Å; W428-W466 AromaticContact CG-NE1 3.41Å; W428-W466 AromaticContact CZ2-CD1 3.83Å; W428-W466 AromaticContact NE1-CD1 3.41Å; W428-W466 AromaticContact NE1-CG 4Å; V439-W466 HydrophobicContact CG1-CZ2 4.37Å; V440-W466 HydrophobicContact CB-CE3 4.33Å; V440-W466 HydrophobicContact CG1-CE3 3.93Å; V440-W466 HydrophobicContact CG2-CB 4.04Å; V440-W466 HydrophobicContact CG2-CD2 3.73Å; V440-W466 HydrophobicContact CG2-CE3 3.9Å; V440-W466 HydrophobicContact CG2-CG 3.81Å; V443-W466 HydrophobicContact CB-CH2 3.91Å; V443-W466 HydrophobicContact CB-CZ3 4.47Å; V443-W466 HydrophobicContact CG1-CH2 3.77Å; V443-W466 HydrophobicContact CG1-CZ3 4.42Å; V443-W466 HydrophobicContact CG2-CH2 4.04Å; A462-W466 HydrophobicContact CB-CZ2 3.83Å; A462-W466 PolarHBondContact O-N 3.4Å; A462-W466 PolarHBondContact O-NE1 2.87Å; N463-W466 HydrophobicContact CB-CE3 3.95Å; N463-W466 HydrophobicContact CB-CZ3 4.1Å; N463-W466 WeakPolarHBondContact O-CB 3.44Å; N463-W466 PolarHBondContact O-N 3.45Å; N463-W466 VanDerWaalsContact O-N 3.09Å; W466-R468 PolarHBondContact O-N 2.94Å; W466-D469 WeakPolarHBondContact O-CB 3.49Å; W466-D469 PolarHBondContact O-N 3.23Å; W466-A478 HydrophobicContact CB-CB 3.62Å
467	L	96.8	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.1	171.5	-64.8	176.7	0	0	0	113.2	N463 L464 A465 R475 A478 C479 L482 L586 L589 I600 V604	N463-L467 PolarHBondContact O-N 3.37Å; L464-L467 HydrophobicContact CD2-CD1 4.16Å; A465-L467 PolarHBondContact O-N 3.11Å; L467-R475 VanDerWaalsContact O-CD 3.25Å; L467-R475 WeakPolarHBondContact O-CD 3.43Å; L467-R475 WeakPolarHBondContact O-CG 3.24Å; L467-A478 HydrophobicContact CD2-CB 3.8Å; L467-A478 HydrophobicContact CG-CB 4.36Å; L467-C479 HydrophobicContact CD2-CB 4.49Å; L467-L482 HydrophobicContact CD1-CD2 4.02Å; L467-L586 HydrophobicContact CD1-CD2 3.65Å; L467-L589 HydrophobicContact CB-CD1 4.05Å; L467-L589 HydrophobicContact CD1-CD1 3.83Å; L467-I600 HydrophobicContact CB-CG2 3.95Å; L467-I600 HydrophobicContact CD2-CG2 3.81Å; L467-I600 HydrophobicContact CG-CG2 4.38Å; L467-V604 HydrophobicContact CD1-CG2 4.1Å; L467-V604 HydrophobicContact CD2-CG2 3.76Å
468	R	95.2	Very high	95.2	Very high	61 Å²	61	20.5 Å²	20.5	23%	0.23	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	12.4	179.9	-56.2	179.9	120.6	-145.6	-2.2	113.1	A465 W466 L589 D592 L597	A465-R468 WeakPolarHBondContact O-CA 3.31Å; A465-R468 WeakPolarHBondContact O-CB 3.43Å; A465-R468 PolarHBondContact O-N 2.7Å; W466-R468 PolarHBondContact O-N 2.94Å; R468-L589 HydrophobicContact CG-CD2 3.87Å; R468-D592 IonicContact CZ-OD2 2.79Å; R468-D592 IonicContact NH2-OD2 2.58Å; R468-D592 PolarHBondContact NH2-OD2 3.31Å; R468-L597 HydrophobicContact CB-CD2 4.35Å; R468-L597 HydrophobicContact CG-CD2 4.23Å
469	D	95.7	Very high	95.3	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.011	9%	0.091	C	C	.	.			trans	-56.6	144.4	177.5	-164.7	-81.1	0	0	0	111.8	W428 R436 W466 A471 V474 R475	W428-D469 HydrophobicContact CZ2-CB 4.35Å; W428-D469 PolarHBondContact NE1-OD2 3.41Å; W428-D469 VanDerWaalsContact NE1-OD2 3.12Å; R436-D469 WeakPolarHBondContact CD-OD2 3.23Å; R436-D469 IonicContact CZ-OD1 3.37Å; R436-D469 IonicContact CZ-OD2 3.45Å; R436-D469 IonicContact NE-OD1 2.82Å; R436-D469 PolarHBondContact NE-OD1 3.41Å; R436-D469 IonicContact NE-OD2 3.68Å; R436-D469 PolarHBondContact NE-OD2 3.14Å; R436-D469 IonicContact NH2-OD1 2.82Å; R436-D469 PolarHBondContact NH2-OD1 3.19Å; R436-D469 IonicContact NH2-OD2 2.68Å; W466-D469 WeakPolarHBondContact O-CB 3.49Å; W466-D469 PolarHBondContact O-N 3.23Å; D469-A471 VanDerWaalsContact C-N 3.28Å; D469-A471 PolarHBondContact O-N 3.31Å; D469-A471 WeakPolarHBondContact OD1-CB 3.42Å; D469-A471 PolarHBondContact OD1-N 2.99Å; D469-V474 HydrophobicContact CB-CB 3.83Å; D469-V474 HydrophobicContact CB-CG1 3.62Å; D469-V474 VanDerWaalsContact CG-CG1 3.45Å; D469-R475 HydrophobicContact CB-CG 3.99Å; D469-R475 WeakPolarHBondContact O-CD 3.4Å; D469-R475 WeakPolarHBondContact O-CG 3.26Å; D469-R475 PolarHBondContact O-NH1 3.44Å
470	P	95	Very high	95.3	Very high	111 Å²	111	18.5 Å²	18.5	72%	0.721	9%	0.094	S	C	*	.	S	Bend	trans	-59.5	-33.5	175.1	-26.4	35.4	0	0	0	114.5	R475	P470-R475 PolarHBondContact O-NH1 2.97Å
471	A	93.3	Very high	95.3	Very high	17 Å²	17	18.5 Å²	18.5	14%	0.14	9%	0.094	C	C	.	.	S	Bend	trans	-85.6	129	-178.3	0	0	0	0	0	111.5	W433 D469 C473 V474 R475	W433-A471 HydrophobicContact CB-CB 3.89Å; W433-A471 HydrophobicContact CG-CB 4.35Å; D469-A471 VanDerWaalsContact C-N 3.28Å; D469-A471 PolarHBondContact O-N 3.31Å; D469-A471 WeakPolarHBondContact OD1-CB 3.42Å; D469-A471 PolarHBondContact OD1-N 2.99Å; A471-C473 VanDerWaalsContact C-N 3.34Å; A471-C473 PolarHBondContact O-N 3.29Å; A471-V474 HydrophobicContact CB-CB 4.32Å; A471-V474 HydrophobicContact CB-CG2 3.83Å; A471-V474 PolarHBondContact O-N 3.17Å; A471-R475 PolarHBondContact O-N 2.9Å
472	W	92.2	Very high	95.5	Very high	101 Å²	101	17.8 Å²	17.8	38%	0.383	9%	0.089	S	C	.	.	H	α-helix	trans	-61.4	-40.3	-176	74.8	-93.2	0	0	0	113	V474 R475 E476 I630 L631 F632 P633	W472-V474 VanDerWaalsContact C-N 3.32Å; W472-V474 PolarHBondContact O-N 3.49Å; W472-R475 PolarHBondContact O-N 3.29Å; W472-E476 HydrophobicContact CE3-CB 4.42Å; W472-E476 HydrophobicContact CZ3-CB 4.5Å; W472-E476 WeakPolarHBondContact CZ3-OE2 3.48Å; W472-E476 WeakPolarHBondContact O-CB 3.46Å; W472-E476 PolarHBondContact O-N 2.94Å; W472-I630 HydrophobicContact CH2-CG2 3.53Å; W472-I630 HydrophobicContact CZ2-CG2 3.83Å; W472-L631 WeakPolarHBondContact CH2-O 3.47Å; W472-L631 WeakPolarHBondContact CZ3-O 3.41Å; W472-F632 HydrophobicContact CH2-CD1 4.48Å; W472-P633 HydrophobicContact CE3-CG 4.46Å; W472-P633 HydrophobicContact CH2-CG 4.35Å; W472-P633 HydrophobicContact CZ3-CG 4Å
473	C	92	Very high	95.5	Very high	10 Å²	10	17.4 Å²	17.4	7%	0.068	9%	0.087	C	C	.	.	H	α-helix	trans	-66	-35.8	-178.4	51.3	0	0	0	0	111.7	W433 A471 E476 C477 I630	W433-C473 WeakPolarHBondContact CZ3-SG 3.46Å; A471-C473 VanDerWaalsContact C-N 3.34Å; A471-C473 PolarHBondContact O-N 3.29Å; C473-E476 PolarHBondContact O-N 2.71Å; C473-C477 PolarHBondContact O-N 3.01Å; C473-I630 HydrophobicContact CB-CG2 4.11Å
474	V	95.6	Very high	95.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-66	-45.9	173.8	-176.9	0	0	0	0	110.2	W433 R436 L437 V440 D469 A471 W472 E476 C477 A478	W433-V474 HydrophobicContact CE3-CG2 4.4Å; R436-V474 HydrophobicContact CB-CG1 4.49Å; R436-V474 HydrophobicContact CB-CG2 4.42Å; L437-V474 HydrophobicContact CB-CG2 3.96Å; V440-V474 HydrophobicContact CG2-CG1 3.83Å; D469-V474 HydrophobicContact CB-CB 3.83Å; D469-V474 HydrophobicContact CB-CG1 3.62Å; D469-V474 VanDerWaalsContact CG-CG1 3.45Å; A471-V474 HydrophobicContact CB-CB 4.32Å; A471-V474 HydrophobicContact CB-CG2 3.83Å; A471-V474 PolarHBondContact O-N 3.17Å; W472-V474 VanDerWaalsContact C-N 3.32Å; W472-V474 PolarHBondContact O-N 3.49Å; V474-E476 VanDerWaalsContact C-N 3.3Å; V474-E476 PolarHBondContact O-N 3.42Å; V474-C477 PolarHBondContact O-N 2.78Å; V474-A478 WeakPolarHBondContact O-CB 3.28Å; V474-A478 PolarHBondContact O-N 2.83Å
475	R	95.2	Very high	95.7	Very high	28 Å²	28	18 Å²	18	11%	0.106	9%	0.088	C	C	.	.	H	α-helix	trans	-60.9	-39.7	175.8	-62.6	-168.9	-60.6	-89.7	3.7	112.2	L467 D469 P470 A471 W472 A478 C479 I600	L467-R475 VanDerWaalsContact O-CD 3.25Å; L467-R475 WeakPolarHBondContact O-CD 3.43Å; L467-R475 WeakPolarHBondContact O-CG 3.24Å; D469-R475 HydrophobicContact CB-CG 3.99Å; D469-R475 WeakPolarHBondContact O-CD 3.4Å; D469-R475 WeakPolarHBondContact O-CG 3.26Å; D469-R475 PolarHBondContact O-NH1 3.44Å; P470-R475 PolarHBondContact O-NH1 2.97Å; A471-R475 PolarHBondContact O-N 2.9Å; W472-R475 PolarHBondContact O-N 3.29Å; R475-A478 WeakPolarHBondContact O-CB 3.26Å; R475-A478 PolarHBondContact O-N 3.27Å; R475-C479 PolarHBondContact O-N 3.39Å; R475-C479 VanDerWaalsContact O-N 3.08Å; R475-C479 PolarHBondContact O-SG 2.75Å; R475-I600 HydrophobicContact CB-CD1 3.58Å; R475-I600 HydrophobicContact CB-CG1 3.89Å; R475-I600 HydrophobicContact CG-CD1 4.5Å; R475-I600 HydrophobicContact CG-CG1 4.39Å
476	E	92.8	Very high	95.8	Very high	9 Å²	9	18.1 Å²	18.1	4%	0.042	9%	0.089	C	C	.	.	H	α-helix	trans	-65.9	-44.3	177.5	171.1	151.4	-157.4	0	0	112.6	W472 C473 V474 A478 C479 R636	W472-E476 HydrophobicContact CE3-CB 4.42Å; W472-E476 HydrophobicContact CZ3-CB 4.5Å; W472-E476 WeakPolarHBondContact CZ3-OE2 3.48Å; W472-E476 WeakPolarHBondContact O-CB 3.46Å; W472-E476 PolarHBondContact O-N 2.94Å; C473-E476 PolarHBondContact O-N 2.71Å; V474-E476 VanDerWaalsContact C-N 3.3Å; V474-E476 PolarHBondContact O-N 3.42Å; E476-A478 VanDerWaalsContact C-N 3.31Å; E476-A478 PolarHBondContact O-N 3.48Å; E476-C479 WeakPolarHBondContact O-CB 3.19Å; E476-C479 PolarHBondContact O-N 3.21Å; E476-R636 IonicContact OE1-CZ 3.19Å; E476-R636 IonicContact OE1-NE 2.95Å; E476-R636 PolarHBondContact OE1-NE 2.96Å; E476-R636 IonicContact OE1-NH2 2.64Å; E476-R636 PolarHBondContact OE1-NH2 2.73Å; E476-R636 IonicContact OE2-CZ 3.13Å; E476-R636 IonicContact OE2-NH2 2.71Å; E476-R636 PolarHBondContact OE2-NH2 3.33Å
477	C	95	Very high	95.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.4	-41.2	171.4	-176.2	0	0	0	0	111.6	L437 V440 Q441 C473 V474 C479 R480 S481 E616	L437-C477 HydrophobicContact CD1-CB 3.78Å; V440-C477 HydrophobicContact CG1-CB 4.02Å; Q441-C477 HydrophobicContact CG-CB 4.36Å; Q441-C477 WeakPolarHBondContact CG-SG 3.1Å; C473-C477 PolarHBondContact O-N 3.01Å; V474-C477 PolarHBondContact O-N 2.78Å; C477-C479 VanDerWaalsContact C-N 3.25Å; C477-C479 PolarHBondContact O-N 3.08Å; C477-R480 PolarHBondContact O-N 2.96Å; C477-S481 WeakPolarHBondContact O-CB 3.32Å; C477-S481 PolarHBondContact O-N 3.15Å; C477-E616 PolarHBondContact SG-OE1 2.85Å
478	A	97.4	Very high	95.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.7	-35.3	177	0	0	0	0	0	112.6	V440 N463 W466 L467 V474 R475 E476 R480 S481 L482	V440-A478 HydrophobicContact CG1-CB 3.97Å; N463-A478 PolarHBondContact OD1-O 3.28Å; W466-A478 HydrophobicContact CB-CB 3.62Å; L467-A478 HydrophobicContact CD2-CB 3.8Å; L467-A478 HydrophobicContact CG-CB 4.36Å; V474-A478 WeakPolarHBondContact O-CB 3.28Å; V474-A478 PolarHBondContact O-N 2.83Å; R475-A478 WeakPolarHBondContact O-CB 3.26Å; R475-A478 PolarHBondContact O-N 3.27Å; E476-A478 VanDerWaalsContact C-N 3.31Å; E476-A478 PolarHBondContact O-N 3.48Å; A478-R480 VanDerWaalsContact C-N 3.34Å; A478-R480 PolarHBondContact O-N 3.33Å; A478-S481 WeakPolarHBondContact O-CB 2.99Å; A478-S481 PolarHBondContact O-N 3.23Å; A478-L482 WeakPolarHBondContact O-CB 3.36Å; A478-L482 PolarHBondContact O-N 3.18Å
479	C	96.2	Very high	95.8	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.014	12%	0.117	C	C	.	.	H	α-helix	trans	-59.1	-45.2	174.8	-61.6	0	0	0	0	112.2	L467 R475 E476 C477 A483 N603 V604	L467-C479 HydrophobicContact CD2-CB 4.49Å; R475-C479 PolarHBondContact O-N 3.39Å; R475-C479 VanDerWaalsContact O-N 3.08Å; R475-C479 PolarHBondContact O-SG 2.75Å; E476-C479 WeakPolarHBondContact O-CB 3.19Å; E476-C479 PolarHBondContact O-N 3.21Å; C477-C479 VanDerWaalsContact C-N 3.25Å; C477-C479 PolarHBondContact O-N 3.08Å; C479-A483 PolarHBondContact O-N 2.81Å; C479-A483 VanDerWaalsContact O-N 3.14Å; C479-N603 HydrophobicContact CB-CB 4.32Å; C479-N603 VanDerWaalsContact SG-CB 3.6Å; C479-V604 HydrophobicContact CB-CG2 4.04Å
480	R	95.6	Very high	95.7	Very high	17 Å²	17	24.1 Å²	24.1	6%	0.064	14%	0.139	C	C	.	.	H	α-helix	trans	-76.8	-34.5	-179.2	-65.6	175.7	-68.7	116.4	9.4	111.4	C477 A478 A483 R484 A607 I613 L614 E616	C477-R480 PolarHBondContact O-N 2.96Å; A478-R480 VanDerWaalsContact C-N 3.34Å; A478-R480 PolarHBondContact O-N 3.33Å; R480-A483 PolarHBondContact O-N 3.39Å; R480-R484 WeakPolarHBondContact O-CG 3.3Å; R480-R484 PolarHBondContact O-N 2.82Å; R480-A607 HydrophobicContact CG-CB 4.42Å; R480-I613 HydrophobicContact CB-CG2 3.99Å; R480-I613 HydrophobicContact CG-CG2 4.33Å; R480-L614 PolarHBondContact NH1-O 3.4Å; R480-E616 IonicContact CZ-OE1 3.23Å; R480-E616 IonicContact CZ-OE2 2.66Å; R480-E616 VanDerWaalsContact CZ-OE2 3.23Å; R480-E616 IonicContact NH1-OE1 2.79Å; R480-E616 PolarHBondContact NH1-OE1 2.98Å; R480-E616 IonicContact NH1-OE2 3.78Å; R480-E616 PolarHBondContact NH1-OE2 3.33Å; R480-E616 IonicContact NH2-OE1 3.36Å; R480-E616 PolarHBondContact NH2-OE1 3.49Å; R480-E616 IonicContact NH2-OE2 2.88Å; R480-E616 PolarHBondContact NH2-OE2 3.29Å
481	S	97.6	Very high	95.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57.4	-46.9	169.4	-173	0	0	0	0	111.3	P444 Y447 N463 C477 A478 A483 R484 L485	P444-S481 WeakPolarHBondContact CG-OG 3.41Å; Y447-S481 PolarHBondContact OH-OG 2.82Å; N463-S481 PolarHBondContact ND2-OG 2.74Å; C477-S481 WeakPolarHBondContact O-CB 3.32Å; C477-S481 PolarHBondContact O-N 3.15Å; A478-S481 WeakPolarHBondContact O-CB 2.99Å; A478-S481 PolarHBondContact O-N 3.23Å; S481-A483 PolarHBondContact O-N 3.39Å; S481-R484 PolarHBondContact O-N 2.72Å; S481-L485 PolarHBondContact O-N 3.37Å
482	L	98.1	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.5	-43	175.3	-178.2	57.4	0	0	0	111.9	L460 N463 L464 L467 A478 R484 L485 L486 L586 V604	L460-L482 HydrophobicContact CD1-CD1 3.82Å; N463-L482 PolarHBondContact ND2-N 2.86Å; N463-L482 WeakPolarHBondContact OD1-CB 3.4Å; L464-L482 HydrophobicContact CD2-CD2 4.42Å; L467-L482 HydrophobicContact CD1-CD2 4.02Å; A478-L482 WeakPolarHBondContact O-CB 3.36Å; A478-L482 PolarHBondContact O-N 3.18Å; L482-R484 VanDerWaalsContact C-N 3.34Å; L482-R484 PolarHBondContact O-N 3.42Å; L482-L485 HydrophobicContact CD1-CD2 4.28Å; L482-L485 WeakPolarHBondContact O-CB 3.32Å; L482-L485 PolarHBondContact O-N 3.21Å; L482-L486 HydrophobicContact CD1-CD1 4.49Å; L482-L486 HydrophobicContact CD1-CG 4.34Å; L482-L486 HydrophobicContact CG-CD1 4.33Å; L482-L486 WeakPolarHBondContact O-CG 3.31Å; L482-L486 PolarHBondContact O-N 3.03Å; L482-L586 HydrophobicContact CD2-CD1 4.25Å; L482-L586 HydrophobicContact CD2-CD2 3.98Å; L482-L586 HydrophobicContact CD2-CG 4.41Å; L482-V604 HydrophobicContact CD2-CG1 3.89Å; L482-V604 HydrophobicContact CD2-CG2 4.41Å
483	A	97.4	Very high	95.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-58.3	-47.5	175.5	0	0	0	0	0	110.9	C479 R480 S481 L485 L486 V487 A607 V608 I613 P669	C479-A483 PolarHBondContact O-N 2.81Å; C479-A483 VanDerWaalsContact O-N 3.14Å; R480-A483 PolarHBondContact O-N 3.39Å; S481-A483 PolarHBondContact O-N 3.39Å; A483-L485 VanDerWaalsContact C-N 3.29Å; A483-L485 PolarHBondContact O-N 3.41Å; A483-L486 PolarHBondContact O-N 3.45Å; A483-V487 PolarHBondContact O-N 2.98Å; A483-A607 HydrophobicContact CB-CB 3.98Å; A483-V608 HydrophobicContact CB-CG2 4.35Å; A483-I613 HydrophobicContact CB-CD1 3.69Å; A483-I613 HydrophobicContact CB-CG1 3.86Å; A483-I613 HydrophobicContact CB-CG2 4.27Å; A483-P669 HydrophobicContact CB-CG 4.21Å; A483-P669 VanDerWaalsContact O-CG 3.24Å; A483-P669 WeakPolarHBondContact O-CG 3.36Å
484	R	97.8	Very high	95.5	Very high	18 Å²	18	21.8 Å²	21.8	7%	0.068	13%	0.128	C	C	.	.	H	α-helix	trans	-59.4	-38.7	175.2	-70.7	178.3	177.9	102.2	2.1	112.8	Y447 R480 S481 L482 L486 V487 A488 I613 L614 E616	Y447-R484 HydrophobicContact CD2-CB 4.26Å; Y447-R484 HydrophobicContact CE2-CB 4.02Å; R480-R484 WeakPolarHBondContact O-CG 3.3Å; R480-R484 PolarHBondContact O-N 2.82Å; S481-R484 PolarHBondContact O-N 2.72Å; L482-R484 VanDerWaalsContact C-N 3.34Å; L482-R484 PolarHBondContact O-N 3.42Å; R484-L486 VanDerWaalsContact C-N 3.3Å; R484-L486 PolarHBondContact O-N 3.46Å; R484-V487 WeakPolarHBondContact O-CB 3.32Å; R484-V487 PolarHBondContact O-N 3.27Å; R484-A488 PolarHBondContact O-N 3Å; R484-I613 HydrophobicContact CG-CD1 4.08Å; R484-I613 HydrophobicContact CG-CG2 4.18Å; R484-L614 PolarHBondContact NH2-O 2.82Å; R484-E616 IonicContact NH1-OE1 3.71Å; R484-E616 PolarHBondContact NH1-OE1 3Å
485	L	98.2	Very high	95.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.2	-39.3	175.7	-179.8	60.8	0	0	0	111.6	Y447 L455 V459 L460 N463 S481 L482 A483 V487 A488 C489	Y447-L485 HydrophobicContact CD1-CD1 4.42Å; Y447-L485 HydrophobicContact CD2-CB 4.35Å; Y447-L485 HydrophobicContact CD2-CD1 4.42Å; Y447-L485 HydrophobicContact CE1-CD1 4.24Å; Y447-L485 HydrophobicContact CE2-CB 3.68Å; Y447-L485 HydrophobicContact CE2-CD1 4.23Å; L455-L485 HydrophobicContact CB-CD1 3.99Å; L455-L485 HydrophobicContact CD2-CD1 3.93Å; L455-L485 HydrophobicContact CG-CD1 4.37Å; V459-L485 HydrophobicContact CB-CD1 4.5Å; V459-L485 HydrophobicContact CG1-CD1 4.04Å; V459-L485 HydrophobicContact CG1-CD2 4.06Å; L460-L485 HydrophobicContact CB-CD2 3.89Å; L460-L485 HydrophobicContact CD1-CD2 4.03Å; N463-L485 HydrophobicContact CB-CD2 4.34Å; S481-L485 PolarHBondContact O-N 3.37Å; L482-L485 HydrophobicContact CD1-CD2 4.28Å; L482-L485 WeakPolarHBondContact O-CB 3.32Å; L482-L485 PolarHBondContact O-N 3.21Å; A483-L485 VanDerWaalsContact C-N 3.29Å; A483-L485 PolarHBondContact O-N 3.41Å; L485-V487 VanDerWaalsContact C-N 3.34Å; L485-A488 PolarHBondContact O-N 3.17Å; L485-C489 PolarHBondContact O-N 3.15Å
486	L	97.5	Very high	95.3	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-74.1	-23.5	178	-63.4	176.4	0	0	0	113	L482 A483 R484 A492 A496 V608 P669 I671	L482-L486 HydrophobicContact CD1-CD1 4.49Å; L482-L486 HydrophobicContact CD1-CG 4.34Å; L482-L486 HydrophobicContact CG-CD1 4.33Å; L482-L486 WeakPolarHBondContact O-CG 3.31Å; L482-L486 PolarHBondContact O-N 3.03Å; A483-L486 PolarHBondContact O-N 3.45Å; R484-L486 VanDerWaalsContact C-N 3.3Å; R484-L486 PolarHBondContact O-N 3.46Å; L486-A492 HydrophobicContact CD2-CB 4.03Å; L486-A496 HydrophobicContact CD2-CB 4.12Å; L486-V608 HydrophobicContact CD1-CG2 4.16Å; L486-P669 HydrophobicContact CB-CB 3.91Å; L486-P669 HydrophobicContact CB-CG 4Å; L486-I671 HydrophobicContact CB-CD1 4.27Å; L486-I671 HydrophobicContact CD1-CD1 3.66Å; L486-I671 HydrophobicContact CG-CD1 4.5Å
487	V	96.7	Very high	95.2	Very high	69 Å²	69	23.3 Å²	23.3	42%	0.418	14%	0.136	S	C	.	.	H	α-helix	trans	-67.2	-49.4	165.5	179.3	0	0	0	0	110.2	A483 R484 L485 I613 P669	A483-V487 PolarHBondContact O-N 2.98Å; R484-V487 WeakPolarHBondContact O-CB 3.32Å; R484-V487 PolarHBondContact O-N 3.27Å; L485-V487 VanDerWaalsContact C-N 3.34Å; V487-I613 HydrophobicContact CG2-CD1 3.77Å; V487-P669 HydrophobicContact CG2-CB 4.23Å; V487-P669 HydrophobicContact CG2-CG 3.85Å
488	A	96.4	Very high	94.8	Very high	49 Å²	49	26.6 Å²	26.6	41%	0.405	16%	0.159	S	C	.	.	H	α-helix	trans	-72.6	-29.6	-176.6	0	0	0	0	0	113.6	Y447 L455 R484 L485	Y447-A488 HydrophobicContact CD2-CB 4.33Å; Y447-A488 HydrophobicContact CG-CB 4.41Å; L455-A488 HydrophobicContact CD1-CB 4.43Å; R484-A488 PolarHBondContact O-N 3Å; L485-A488 PolarHBondContact O-N 3.17Å
489	C	96.4	Very high	94.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.162	C	C	.	.			trans	-137.9	79	-178.3	-177.3	0	0	0	0	111.1	E452 L455 Q456 L485 G491 A492	E452-C489 HydrophobicContact CG-CB 4.46Å; E452-C489 WeakPolarHBondContact CG-SG 3.46Å; L455-C489 HydrophobicContact CB-CB 4.11Å; L455-C489 HydrophobicContact CD1-CB 3.88Å; Q456-C489 WeakPolarHBondContact CG-SG 3.41Å; L485-C489 PolarHBondContact O-N 3.15Å; C489-G491 PolarHBondContact O-N 2.89Å; C489-G491 VanDerWaalsContact O-N 3.15Å; C489-A492 HydrophobicContact CB-CB 4.35Å; C489-A492 VanDerWaalsContact O-CB 3.26Å; C489-A492 WeakPolarHBondContact O-CB 3.22Å; C489-A492 PolarHBondContact O-N 2.79Å
490	P	93.5	Very high	93.2	Very high	74 Å²	74	28.3 Å²	28.3	48%	0.481	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-58.3	-27.8	176.1	-26.1	35.8	0	0	0	113.3	A492 C493	P490-A492 PolarHBondContact O-N 3.45Å; P490-C493 WeakPolarHBondContact O-CB 3.35Å; P490-C493 PolarHBondContact O-N 2.89Å; P490-C493 VanDerWaalsContact O-N 3.15Å; P490-C493 PolarHBondContact O-SG 2.92Å
491	G	91.3	Very high	91.5	Very high	42 Å²	42	30.5 Å²	30.5	43%	0.433	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-60	-22.1	174.8	0	0	0	0	0	114.3	C489 C493	C489-G491 PolarHBondContact O-N 2.89Å; C489-G491 VanDerWaalsContact O-N 3.15Å; G491-C493 VanDerWaalsContact C-N 3.3Å; G491-C493 PolarHBondContact O-N 3.49Å
492	A	92.6	Very high	89	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-72.8	-17.2	177.3	0	0	0	0	0	114	Q456 L460 L486 C489 P490 K494 K495 A496	Q456-A492 HydrophobicContact CG-CB 4.26Å; L460-A492 HydrophobicContact CD2-CB 4.07Å; L486-A492 HydrophobicContact CD2-CB 4.03Å; C489-A492 HydrophobicContact CB-CB 4.35Å; C489-A492 VanDerWaalsContact O-CB 3.26Å; C489-A492 WeakPolarHBondContact O-CB 3.22Å; C489-A492 PolarHBondContact O-N 2.79Å; P490-A492 PolarHBondContact O-N 3.45Å; A492-K494 PolarHBondContact O-N 3.02Å; A492-K495 PolarHBondContact O-N 2.97Å; A492-K495 VanDerWaalsContact O-N 3.09Å; A492-A496 PolarHBondContact O-N 3.38Å
493	C	93.2	Very high	85.9	Confident	6 Å²	6	44.5 Å²	44.5	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-51.2	-50.4	-170.9	-71.1	0	0	0	0	112.8	P490 G491 K495 A496 F497 I671 Y675	P490-C493 WeakPolarHBondContact O-CB 3.35Å; P490-C493 PolarHBondContact O-N 2.89Å; P490-C493 VanDerWaalsContact O-N 3.15Å; P490-C493 PolarHBondContact O-SG 2.92Å; G491-C493 VanDerWaalsContact C-N 3.3Å; G491-C493 PolarHBondContact O-N 3.49Å; C493-K495 VanDerWaalsContact C-N 3.33Å; C493-K495 PolarHBondContact O-N 3.23Å; C493-A496 WeakPolarHBondContact O-CB 3.36Å; C493-A496 PolarHBondContact O-N 3.3Å; C493-A496 VanDerWaalsContact O-N 3.15Å; C493-F497 WeakPolarHBondContact O-CD2 3.43Å; C493-F497 PolarHBondContact O-N 3.47Å; C493-I671 HydrophobicContact CB-CG2 4.43Å; C493-Y675 HydrophobicContact CB-CE2 4.3Å
494	K	91.6	Very high	82.7	Confident	141 Å²	141	49.7 Å²	49.7	61%	0.613	30%	0.301	S	S	*	.	H	α-helix	trans	-56.6	-47.7	-178.3	-174.9	178	177.9	180	0	111.6	A492 S498 Y675	A492-K494 PolarHBondContact O-N 3.02Å; K494-S498 WeakPolarHBondContact O-CB 3.48Å; K494-S498 PolarHBondContact O-N 2.96Å; K494-S498 PolarHBondContact O-OG 3.27Å; K494-Y675 VanDerWaalsContact CA-OH 3.26Å; K494-Y675 WeakPolarHBondContact CA-OH 3.34Å; K494-Y675 WeakPolarHBondContact CB-OH 3.48Å
495	K	92.3	Very high	79.2	Confident	50 Å²	50	53.6 Å²	53.6	22%	0.217	33%	0.331	C	S	.	.	H	α-helix	trans	-67.2	-37.2	179.7	-70.5	175	-175.9	164.7	0	111.7	E457 L460 A492 C493 G499 V500	E457-K495 IonicContact OE1-NZ 3.9Å; E457-K495 PolarHBondContact OE1-NZ 2.87Å; L460-K495 HydrophobicContact CD2-CB 3.53Å; L460-K495 HydrophobicContact CD2-CD 4.45Å; A492-K495 PolarHBondContact O-N 2.97Å; A492-K495 VanDerWaalsContact O-N 3.09Å; C493-K495 VanDerWaalsContact C-N 3.33Å; C493-K495 PolarHBondContact O-N 3.23Å; K495-G499 CarbonylContact O-C 3.28Å; K495-G499 VanDerWaalsContact O-C 3.28Å; K495-G499 WeakPolarHBondContact O-CA 3.35Å; K495-G499 PolarHBondContact O-N 3.37Å; K495-V500 HydrophobicContact CB-CG2 4.24Å
496	A	93.6	Very high	75.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.8	-45.9	177.9	0	0	0	0	0	112	L460 L486 A492 C493 G585 L586	L460-A496 HydrophobicContact CD1-CB 3.81Å; L486-A496 HydrophobicContact CD2-CB 4.12Å; A492-A496 PolarHBondContact O-N 3.38Å; C493-A496 WeakPolarHBondContact O-CB 3.36Å; C493-A496 PolarHBondContact O-N 3.3Å; C493-A496 VanDerWaalsContact O-N 3.15Å; A496-G585 WeakPolarHBondContact O-CA 3.4Å; A496-L586 WeakPolarHBondContact O-CG 3.36Å; A496-L586 PolarHBondContact O-N 2.95Å
497	F	91.3	Very high	72.1	Confident	19 Å²	19	66.7 Å²	66.7	8%	0.083	41%	0.406	C	S	.	.	H	α-helix	trans	-82	-42	-177.8	-71.1	-78.1	0	0	0	113.7	C493 L586 K587 W609 I671 Y675	C493-F497 WeakPolarHBondContact O-CD2 3.43Å; C493-F497 PolarHBondContact O-N 3.47Å; F497-L586 HydrophobicContact CD1-CB 4.4Å; F497-L586 HydrophobicContact CD1-CD1 3.57Å; F497-L586 HydrophobicContact CE1-CD1 3.46Å; F497-L586 VanDerWaalsContact CE1-CD1 3.46Å; F497-L586 HydrophobicContact CG-CD1 4.25Å; F497-L586 HydrophobicContact CZ-CD1 4.05Å; F497-K587 PolarHBondContact O-N 3.24Å; F497-W609 AromaticContact CE1-CH2 3.57Å; F497-W609 HydrophobicContact CE1-CH2 3.57Å; F497-W609 AromaticContact CE1-CZ3 3.85Å; F497-W609 HydrophobicContact CE1-CZ3 3.85Å; F497-W609 HydrophobicContact CE2-CH2 4.17Å; F497-W609 AromaticContact CZ-CH2 3.29Å; F497-W609 HydrophobicContact CZ-CH2 3.29Å; F497-W609 HydrophobicContact CZ-CZ2 4.21Å; F497-W609 AromaticContact CZ-CZ3 3.76Å; F497-W609 HydrophobicContact CZ-CZ3 3.76Å; F497-I671 HydrophobicContact CE2-CD1 4.02Å; F497-I671 HydrophobicContact CE2-CG2 4.21Å; F497-I671 HydrophobicContact CZ-CD1 4.31Å; F497-Y675 HydrophobicContact CB-CD1 3.7Å; F497-Y675 HydrophobicContact CB-CE1 3.95Å; F497-Y675 AromaticContact CD2-CD1 3.64Å; F497-Y675 HydrophobicContact CD2-CD1 3.64Å; F497-Y675 HydrophobicContact CD2-CD2 4.41Å; F497-Y675 HydrophobicContact CD2-CE1 4.14Å; F497-Y675 AromaticContact CD2-CG 3.8Å; F497-Y675 HydrophobicContact CD2-CG 3.8Å; F497-Y675 HydrophobicContact CE2-CD1 4.48Å; F497-Y675 HydrophobicContact CE2-CG 4.21Å; F497-Y675 AromaticContact CG-CD1 3.69Å; F497-Y675 HydrophobicContact CG-CD1 3.69Å; F497-Y675 HydrophobicContact CG-CE1 4.3Å; F497-Y675 HydrophobicContact CG-CG 4.19Å
498	S	87.1	Confident	68.5	Low	70 Å²	70	69.1 Å²	69.1	49%	0.49	43%	0.426	S	S	.	.	H	α-helix	trans	-98.5	-9.2	-173	67.9	0	0	0	0	115.1	K494	K494-S498 WeakPolarHBondContact O-CB 3.48Å; K494-S498 PolarHBondContact O-N 2.96Å; K494-S498 PolarHBondContact O-OG 3.27Å
499	G	84.2	Confident	65.1	Low	6 Å²	6	70 Å²	70	6%	0.062	44%	0.44	C	S	.	.			trans	93.5	159.1	-174.6	0	0	0	0	0	113.5	K495 G501 A582	K495-G499 CarbonylContact O-C 3.28Å; K495-G499 VanDerWaalsContact O-C 3.28Å; K495-G499 WeakPolarHBondContact O-CA 3.35Å; K495-G499 PolarHBondContact O-N 3.37Å; G499-G501 PolarHBondContact O-N 3.44Å; G499-A582 CarbonylContact C-O 3.59Å; G499-A582 WeakPolarHBondContact CA-O 3.41Å
500	V	74.2	Confident	61.4	Low	31 Å²	31	76 Å²	76	19%	0.188	48%	0.482	C	S	.	.			trans	-83.2	96.6	169.9	-168.2	0	0	0	0	106	P461 K495 S502 A582	P461-V500 HydrophobicContact CG-CG2 4.43Å; K495-V500 HydrophobicContact CB-CG2 4.24Å; V500-S502 PolarHBondContact O-N 2.98Å; V500-A582 HydrophobicContact CB-CB 4.29Å; V500-A582 HydrophobicContact CG2-CB 3.96Å; V500-A582 PolarHBondContact N-O 2.92Å
501	G	59.7	Low	58.1	Low	63 Å²	63	75.5 Å²	75.5	65%	0.649	49%	0.49	S	S	*	.			trans	-51.3	119.6	-179.8	0	0	0	0	0	110.4	G499 K503	G499-G501 PolarHBondContact O-N 3.44Å; G501-K503 PolarHBondContact O-N 2.96Å
502	S	45.8	Very low	54.7	Low	83 Å²	83	78.7 Å²	78.7	58%	0.58	51%	0.506	S	S	*	.			trans	-60.9	106.8	170.7	-176.5	0	0	0	0	106.8	V500 T504	V500-S502 PolarHBondContact O-N 2.98Å; S502-T504 PolarHBondContact O-N 2.93Å; S502-T504 WeakPolarHBondContact OG-CG2 3.47Å; S502-T504 PolarHBondContact OG-N 3.2Å; S502-T504 PolarHBondContact OG-OG1 3.38Å
503	K	33.5	Very low	51.4	Low	212 Å²	212	85.3 Å²	85.3	92%	0.922	55%	0.546	S	S	*	.			trans	-69.1	56.4	161	-74.8	-175.2	177.5	177.7	0	108.7	G501 S505	G501-K503 PolarHBondContact O-N 2.96Å; K503-S505 VanDerWaalsContact C-N 3.26Å; K503-S505 PolarHBondContact O-N 3.46Å; K503-S505 VanDerWaalsContact O-N 3.1Å
504	T	29.8	Very low	48	Very low	108 Å²	108	90.7 Å²	90.7	66%	0.663	58%	0.578	S	S	*	*			trans	-71.4	99.9	150.5	38.2	0	0	0	0	104.8	S502 T506	S502-T504 PolarHBondContact O-N 2.93Å; S502-T504 WeakPolarHBondContact OG-CG2 3.47Å; S502-T504 PolarHBondContact OG-N 3.2Å; S502-T504 PolarHBondContact OG-OG1 3.38Å; T504-T506 PolarHBondContact O-N 2.85Å
505	S	24.9	Very low	44.7	Very low	101 Å²	101	89.3 Å²	89.3	71%	0.706	59%	0.587	S	S	*	*			trans	-29.8	113	171.5	-161.4	0	0	0	0	109.9	K503 N507	K503-S505 VanDerWaalsContact C-N 3.26Å; K503-S505 PolarHBondContact O-N 3.46Å; K503-S505 VanDerWaalsContact O-N 3.1Å; S505-N507 PolarHBondContact O-N 3.26Å
506	T	22.7	Very low	41.4	Very low	126 Å²	126	94.1 Å²	94.1	77%	0.773	62%	0.615	S	S	*	*			trans	-63.4	76.6	164.9	41.6	0	0	0	0	107.6	T504 S508	T504-T506 PolarHBondContact O-N 2.85Å; T506-S508 VanDerWaalsContact C-N 3.28Å; T506-S508 PolarHBondContact O-N 2.87Å
507	N	23	Very low	38.2	Very low	151 Å²	151	99.1 Å²	99.1	81%	0.807	65%	0.647	S	S	*	*			trans	-77.3	97.8	151.1	-103	9.8	0	0	0	105.3	S505 G509	S505-N507 PolarHBondContact O-N 3.26Å; N507-G509 PolarHBondContact O-N 3.35Å
508	S	22.4	Very low	35.1	Very low	119 Å²	119	105.9 Å²	105.9	83%	0.832	68%	0.684	S	S	*	*			trans	-54.8	77	166.4	-52.6	0	0	0	0	109.9	T506	T506-S508 VanDerWaalsContact C-N 3.28Å; T506-S508 PolarHBondContact O-N 2.87Å
509	G	23.2	Very low	32.1	Very low	67 Å²	67	108.2 Å²	108.2	69%	0.691	70%	0.701	S	S	*	*			trans	-93.9	94.1	167.2	0	0	0	0	0	107.9	N507 G511	N507-G509 PolarHBondContact O-N 3.35Å; G509-G511 VanDerWaalsContact C-N 3.3Å; G509-G511 PolarHBondContact O-N 3.14Å
510	S	20.7	Very low	29.5	Very low	128 Å²	128	112.4 Å²	112.4	90%	0.895	74%	0.735	S	S	*	*			trans	-55.5	92.4	167.3	179.7	0	0	0	0	109.4
511	G	22.3	Very low	27	Very low	62 Å²	62	116.4 Å²	116.4	64%	0.639	76%	0.764	S	S	*	*			trans	-108	90.2	174.8	0	0	0	0	0	108.8	G509 V513	G509-G511 VanDerWaalsContact C-N 3.3Å; G509-G511 PolarHBondContact O-N 3.14Å; G511-V513 PolarHBondContact O-N 3.31Å
512	S	20.5	Very low	25.6	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	77%	0.769	S	S	*	*			trans	-55.4	102.6	167.1	176.1	0	0	0	0	109.1
513	V	22.6	Very low	24.5	Very low	138 Å²	138	122.1 Å²	122.1	84%	0.836	78%	0.782	S	S	*	*			trans	-100.1	100.7	168.7	179.9	0	0	0	0	106.9	G511 S515	G511-V513 PolarHBondContact O-N 3.31Å; V513-S515 PolarHBondContact O-N 2.88Å
514	T	23.1	Very low	24.2	Very low	119 Å²	119	118.2 Å²	118.2	73%	0.73	78%	0.775	S	S	*	*			trans	-56.3	127.1	167.2	33.5	0	0	0	0	110	N516	T514-N516 PolarHBondContact O-N 3.33Å
515	S	21.4	Very low	24.1	Very low	113 Å²	113	119 Å²	119	79%	0.79	78%	0.78	S	S	*	*			trans	-49.8	128.1	165.5	49.4	0	0	0	0	111.5	V513	V513-S515 PolarHBondContact O-N 2.88Å
516	N	24	Very low	24	Very low	150 Å²	150	121.8 Å²	121.8	80%	0.802	79%	0.787	S	S	*	*			trans	-130.4	114.4	153.6	-146.8	17.5	0	0	0	108.9	T514	T514-N516 PolarHBondContact O-N 3.33Å
517	P	25.7	Very low	24.4	Very low	106 Å²	106	121.7 Å²	121.7	69%	0.688	79%	0.789	S	S	*	*			trans	-86.7	117.2	178.1	32.4	-26.3	0	0	0	108.4
518	N	27.4	Very low	24.5	Very low	160 Å²	160	120.5 Å²	120.5	86%	0.856	79%	0.787	S	S	*	*			trans	-126.2	104.4	162.4	-111.8	6.8	0	0	0	110
519	S	23.9	Very low	24.6	Very low	120 Å²	120	120.4 Å²	120.4	84%	0.839	79%	0.786	S	S	*	*			trans	-48.7	129.4	161.8	-51.3	0	0	0	0	111.4
520	A	28.1	Very low	24.8	Very low	94 Å²	94	120.7 Å²	120.7	78%	0.777	79%	0.789	S	S	*	*			trans	-151.1	91.6	151.4	0	0	0	0	0	108.5	S522	A520-S522 PolarHBondContact O-N 2.93Å
521	S	23.4	Very low	25.1	Very low	115 Å²	115	121.3 Å²	121.3	80%	0.804	79%	0.788	S	S	*	*			trans	-58.6	124.6	162	170.5	0	0	0	0	109.1
522	S	28.4	Very low	25.1	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	80%	0.801	S	S	*	*			trans	-141.4	96.4	156.3	48.4	0	0	0	0	109	A520 V524	A520-S522 PolarHBondContact O-N 2.93Å; S522-V524 PolarHBondContact O-N 3.49Å
523	N	23.5	Very low	25.4	Very low	160 Å²	160	125.4 Å²	125.4	86%	0.856	80%	0.798	S	S	*	*			trans	-60.1	116.7	159.6	-94.6	-16	0	0	0	108.5
524	V	28.1	Very low	25.5	Very low	129 Å²	129	124 Å²	124	78%	0.782	80%	0.795	S	S	*	*			trans	-130.2	115.7	154.1	-177.2	0	0	0	0	108.8	S522	S522-V524 PolarHBondContact O-N 3.49Å
525	T	26.5	Very low	25.5	Very low	126 Å²	126	125.4 Å²	125.4	77%	0.773	80%	0.798	S	S	*	*			trans	-36.8	136.6	173.5	37.9	0	0	0	0	117.3
526	N	22.8	Very low	25.6	Very low	158 Å²	158	126.9 Å²	126.9	85%	0.845	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-46.7	134.5	158.1	-92.4	-10.4	0	0	0	112.5
527	P	30.9	Very low	25.8	Very low	124 Å²	124	124.7 Å²	124.7	81%	0.805	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-87.5	125.7	154.1	24.5	-11.4	0	0	0	109.9
528	T	25.8	Very low	25.7	Very low	127 Å²	127	126.7 Å²	126.7	78%	0.779	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-65.6	135.2	170.7	39	0	0	0	0	112.6
529	S	24.4	Very low	25.7	Very low	117 Å²	117	122.3 Å²	122.3	82%	0.818	80%	0.802	S	S	*	*			trans	19.5	110.2	141.8	57.5	0	0	0	0	118.5
530	G	27.1	Very low	25.8	Very low	72 Å²	72	124.4 Å²	124.4	74%	0.742	80%	0.804	S	S	*	*			trans	-129.4	102.1	165.2	0	0	0	0	0	110.9
531	T	26.2	Very low	25.5	Very low	142 Å²	142	127.9 Å²	127.9	87%	0.871	81%	0.808	S	S	*	*			trans	11.2	130.3	151.9	31.1	0	0	0	0	121.6	A533	T531-A533 PolarHBondContact O-N 3.48Å
532	N	23	Very low	25.7	Very low	171 Å²	171	127.9 Å²	127.9	91%	0.914	81%	0.805	S	S	*	*			trans	-38.8	125.4	158.5	-77.9	-22.4	0	0	0	113.3
533	A	26.7	Very low	25.4	Very low	86 Å²	86	128.7 Å²	128.7	71%	0.711	81%	0.811	S	S	*	*			trans	-116.2	106.1	162.7	0	0	0	0	0	108.8	T531 N535	T531-A533 PolarHBondContact O-N 3.48Å; A533-N535 PolarHBondContact O-N 3.08Å
534	S	24.1	Very low	25.6	Very low	109 Å²	109	126.5 Å²	126.5	76%	0.762	81%	0.808	S	S	*	*			trans	-67.6	109.1	163.4	38.9	0	0	0	0	109.2
535	N	25.1	Very low	25.5	Very low	149 Å²	149	126.5 Å²	126.5	80%	0.797	81%	0.809	S	S	*	*			trans	-102.4	91.4	169.8	-86.5	-8.6	0	0	0	109.7	A533	A533-N535 PolarHBondContact O-N 3.08Å
536	T	22.4	Very low	25.3	Very low	144 Å²	144	128 Å²	128	88%	0.883	81%	0.812	S	S	*	*			trans	-82.2	106.1	152.8	30.5	0	0	0	0	107.6
537	S	27.8	Very low	25.5	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	81%	0.812	S	S	*	*			trans	-132.6	97.9	167.4	60.3	0	0	0	0	109.5	G539	S537-G539 PolarHBondContact O-N 3.08Å
538	T	23.4	Very low	25.2	Very low	149 Å²	149	128.6 Å²	128.6	91%	0.914	82%	0.816	S	S	*	*			trans	-56.7	103.2	159.3	42	0	0	0	0	109.3
539	G	27.8	Very low	24.9	Very low	68 Å²	68	128.9 Å²	128.9	70%	0.701	82%	0.818	S	S	*	*			trans	-100.9	109.7	173.8	0	0	0	0	0	110.5	S537	S537-G539 PolarHBondContact O-N 3.08Å
540	N	26.1	Very low	25	Very low	164 Å²	164	131 Å²	131	88%	0.877	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-50.8	133.7	173.7	-86.6	-21.4	0	0	0	112.6
541	L	23	Very low	24.8	Very low	166 Å²	166	134.2 Å²	134.2	87%	0.869	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-68.3	132.1	162.9	-84.3	93.7	0	0	0	110.5
542	P	27.1	Very low	24.8	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-90.4	128	155.8	15.9	1	0	0	0	110.2
543	S	22.3	Very low	24.8	Very low	123 Å²	123	131.7 Å²	131.7	86%	0.86	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60	125.5	164.5	50.2	0	0	0	0	111.5
544	S	27.9	Very low	24.7	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	81%	0.809	S	S	*	*			trans	-131.7	115.7	160.4	64.2	0	0	0	0	111
545	T	24.3	Very low	24.7	Very low	128 Å²	128	135.2 Å²	135.2	79%	0.785	81%	0.811	S	S	*	*			trans	-40.7	144.7	167	31.9	0	0	0	0	117.6
546	N	22.8	Very low	24.9	Very low	159 Å²	159	133.7 Å²	133.7	85%	0.85	81%	0.812	S	S	*	*			trans	47.4	109.9	140.3	-73.7	-11.7	0	0	0	119.9
547	A	27.1	Very low	25	Very low	101 Å²	101	129.6 Å²	129.6	84%	0.835	80%	0.798	S	S	*	*			trans	-155.3	107.9	140.5	0	0	0	0	0	111.5
548	Q	25	Very low	24.8	Very low	192 Å²	192	133.5 Å²	133.5	90%	0.897	81%	0.81	S	S	*	*			trans	22.2	119.5	142.5	-68.8	175.6	-34.4	0	0	120.5
549	V	20.4	Very low	24.9	Very low	134 Å²	134	130.9 Å²	130.9	81%	0.812	80%	0.798	S	S	*	*			trans	-16.3	121.1	139.3	-179.3	0	0	0	0	114.5
550	L	26.3	Very low	24.7	Very low	160 Å²	160	134 Å²	134	84%	0.838	80%	0.804	S	S	*	*			trans	-144.7	116.8	141.8	-130.9	103.8	0	0	0	109.7
551	D	21.3	Very low	24.8	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	81%	0.81	S	S	*	*			trans	-75.7	118.3	176.2	-170.1	8.9	0	0	0	109.4
552	Q	26.8	Very low	24.7	Very low	166 Å²	166	131.9 Å²	131.9	78%	0.776	80%	0.8	S	S	*	*			trans	-145.2	92.6	159.3	-78.3	-164.4	7.2	0	0	109	N554	Q552-N554 PolarHBondContact O-N 2.93Å
553	A	23.3	Very low	24.6	Very low	93 Å²	93	131.6 Å²	131.6	77%	0.769	80%	0.8	S	S	*	*			trans	-54.9	102.3	159.1	0	0	0	0	0	109.5
554	N	24.8	Very low	24.6	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	79%	0.794	S	S	*	*			trans	-111.4	95.5	170.3	-142	0.9	0	0	0	108.6	Q552 S556	Q552-N554 PolarHBondContact O-N 2.93Å; N554-S556 VanDerWaalsContact C-N 3.29Å; N554-S556 PolarHBondContact O-N 3.35Å
555	T	25	Very low	24.3	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	80%	0.798	S	S	*	*			trans	-63.3	85.1	168.5	42.5	0	0	0	0	109.7	G557	T555-G557 VanDerWaalsContact C-N 3.32Å; T555-G557 PolarHBondContact O-N 3.21Å; T555-G557 VanDerWaalsContact O-N 3.12Å
556	S	27.5	Very low	24.3	Very low	117 Å²	117	132.2 Å²	132.2	82%	0.818	80%	0.799	S	S	*	*			trans	-84.2	82.6	169.9	55	0	0	0	0	109.4	N554	N554-S556 VanDerWaalsContact C-N 3.29Å; N554-S556 PolarHBondContact O-N 3.35Å
557	G	25.7	Very low	24.3	Very low	57 Å²	57	132.2 Å²	132.2	59%	0.588	80%	0.799	S	S	*	*			trans	-61.1	137.1	160.1	0	0	0	0	0	109.9	T555 S559	T555-G557 VanDerWaalsContact C-N 3.32Å; T555-G557 PolarHBondContact O-N 3.21Å; T555-G557 VanDerWaalsContact O-N 3.12Å; G557-S559 VanDerWaalsContact C-N 3.26Å; G557-S559 PolarHBondContact O-N 3.27Å
558	L	24.2	Very low	24.2	Very low	186 Å²	186	133.7 Å²	133.7	97%	0.974	80%	0.798	S	S	*	*	S	Bend	trans	-68.8	77.4	179.9	-163	78.1	0	0	0	110.1
559	S	24	Very low	24.2	Very low	94 Å²	94	130 Å²	130	66%	0.657	79%	0.793	S	S	*	*			trans	-156.3	93.2	176	55	0	0	0	0	111.6	G557	G557-S559 VanDerWaalsContact C-N 3.26Å; G557-S559 PolarHBondContact O-N 3.27Å
560	T	25.1	Very low	24.5	Very low	134 Å²	134	127.9 Å²	127.9	82%	0.822	79%	0.79	S	S	*	*			trans	154.5	77.2	142.5	36.6	0	0	0	0	110.8	S562	T560-S562 VanDerWaalsContact C-N 3.3Å; T560-S562 PolarHBondContact O-N 3.11Å; T560-S562 VanDerWaalsContact O-N 3.15Å
561	L	27.5	Very low	24.5	Very low	191 Å²	191	125.6 Å²	125.6	100%	1	78%	0.782	S	S	*	*			trans	-79.4	85	159.1	-85.7	152.1	0	0	0	107.9
562	S	21.3	Very low	25.3	Very low	94 Å²	94	122.4 Å²	122.4	66%	0.657	77%	0.765	S	S	*	*			trans	-135.1	101.2	166.4	58.4	0	0	0	0	108.9	T560	T560-S562 VanDerWaalsContact C-N 3.3Å; T560-S562 PolarHBondContact O-N 3.11Å; T560-S562 VanDerWaalsContact O-N 3.15Å
563	S	23.5	Very low	25.8	Very low	108 Å²	108	119.3 Å²	119.3	76%	0.755	76%	0.759	S	S	*	*			trans	-165.8	114.4	155	44.2	0	0	0	0	111.8
564	T	22.3	Very low	27.2	Very low	120 Å²	120	115.3 Å²	115.3	74%	0.736	73%	0.726	S	S	*	*			trans	48.3	105.2	131.8	54.1	0	0	0	0	120
565	T	21.6	Very low	28.9	Very low	144 Å²	144	113.6 Å²	113.6	88%	0.883	72%	0.717	S	S	*	*			trans	2.4	115.1	132.5	43.8	0	0	0	0	118
566	S	25.1	Very low	30.9	Very low	115 Å²	115	109.5 Å²	109.5	80%	0.804	70%	0.697	S	S	*	*			trans	-152.7	122.8	141.5	50.8	0	0	0	0	110.6
567	N	22.3	Very low	32.9	Very low	159 Å²	159	106.9 Å²	106.9	85%	0.85	67%	0.673	S	S	*	*			trans	-75.3	115	177	-87.1	-25.2	0	0	0	110.4
568	T	25.9	Very low	35.6	Very low	133 Å²	133	105.7 Å²	105.7	82%	0.816	66%	0.655	S	S	*	*			trans	-154.6	102.8	146.4	33.8	0	0	0	0	108.1	A570	T568-A570 VanDerWaalsContact C-N 3.28Å; T568-A570 PolarHBondContact O-N 2.79Å
569	S	25.4	Very low	38.2	Very low	113 Å²	113	101.3 Å²	101.3	79%	0.79	64%	0.636	S	S	*	*			trans	-70.6	73.1	-175	-34	0	0	0	0	111.6	V571	S569-V571 PolarHBondContact O-N 3.22Å
570	A	25.5	Very low	40.9	Very low	91 Å²	91	102.8 Å²	102.8	75%	0.752	63%	0.632	S	S	*	*			trans	-66.1	103.3	159	0	0	0	0	0	106.6	T568 N572	T568-A570 VanDerWaalsContact C-N 3.28Å; T568-A570 PolarHBondContact O-N 2.79Å; A570-N572 PolarHBondContact O-N 3.13Å
571	V	27.2	Very low	43.6	Very low	112 Å²	112	96.6 Å²	96.6	68%	0.679	60%	0.595	S	S	*	*			trans	-59.9	103.5	175.5	177.7	0	0	0	0	106.9	S569 P573 A576	S569-V571 PolarHBondContact O-N 3.22Å; V571-P573 WeakPolarHBondContact O-CD 3.08Å; V571-A576 HydrophobicContact CG1-CB 4.39Å
572	N	36.4	Very low	46.1	Very low	73 Å²	73	87.8 Å²	87.8	39%	0.39	55%	0.55	S	S	.	.			trans	-58	121.7	-179.7	-165.4	-8.5	0	0	0	107.8	A570 A574 N575 A576	A570-N572 PolarHBondContact O-N 3.13Å; N572-A574 PolarHBondContact O-N 3.04Å; N572-N575 HydrophobicContact CB-CB 4.49Å; N572-N575 WeakPolarHBondContact O-CA 3.41Å; N572-N575 WeakPolarHBondContact O-CB 3.48Å; N572-N575 PolarHBondContact O-N 3.31Å; N572-A576 PolarHBondContact O-N 3.09Å
573	P	39	Very low	49.1	Very low	101 Å²	101	86 Å²	86	66%	0.656	54%	0.54	S	S	*	.	H	α-helix	trans	-54.7	-24.3	-176.3	15.1	-28.5	0	0	0	113.1	V571 A576 L577	V571-P573 WeakPolarHBondContact O-CD 3.08Å; P573-A576 WeakPolarHBondContact O-CB 3.4Å; P573-A576 PolarHBondContact O-N 3.35Å; P573-L577 PolarHBondContact O-N 3.08Å
574	A	52	Low	52	Low	9 Å²	9	82 Å²	82	7%	0.074	52%	0.516	C	S	.	.	H	α-helix	trans	-69.9	-37.9	172.5	0	0	0	0	0	114.6	Q429 N572 A576 L577 T578	Q429-A574 HydrophobicContact CG-CB 3.78Å; N572-A574 PolarHBondContact O-N 3.04Å; A574-A576 VanDerWaalsContact C-N 3.26Å; A574-A576 PolarHBondContact O-N 2.99Å; A574-L577 PolarHBondContact O-N 3.13Å; A574-T578 VanDerWaalsContact O-CB 3.27Å; A574-T578 WeakPolarHBondContact O-CB 3.27Å; A574-T578 PolarHBondContact O-N 3.32Å; A574-T578 PolarHBondContact O-OG1 2.85Å
575	N	60.3	Low	55.3	Low	103 Å²	103	76.4 Å²	76.4	55%	0.551	48%	0.483	S	S	*	.	H	α-helix	trans	-63.5	-39.6	170.7	-75.3	22.3	0	0	0	109	N572 T578 T579	N572-N575 HydrophobicContact CB-CB 4.49Å; N572-N575 WeakPolarHBondContact O-CA 3.41Å; N572-N575 WeakPolarHBondContact O-CB 3.48Å; N572-N575 PolarHBondContact O-N 3.31Å; N575-T578 PolarHBondContact O-N 3.37Å; N575-T579 VanDerWaalsContact O-CB 3.29Å; N575-T579 WeakPolarHBondContact O-CB 3.33Å; N575-T579 PolarHBondContact O-N 3.07Å; N575-T579 PolarHBondContact O-OG1 3.08Å
576	A	67.4	Low	58.7	Low	46 Å²	46	69.7 Å²	69.7	38%	0.38	44%	0.441	S	S	.	.	H	α-helix	trans	-63.9	-47.3	177	0	0	0	0	0	113.1	V571 N572 P573 A574 T578 T579 Q580	V571-A576 HydrophobicContact CG1-CB 4.39Å; N572-A576 PolarHBondContact O-N 3.09Å; P573-A576 WeakPolarHBondContact O-CB 3.4Å; P573-A576 PolarHBondContact O-N 3.35Å; A574-A576 VanDerWaalsContact C-N 3.26Å; A574-A576 PolarHBondContact O-N 2.99Å; A576-T578 VanDerWaalsContact C-N 3.35Å; A576-T578 PolarHBondContact O-N 3.29Å; A576-T579 PolarHBondContact O-N 3.16Å; A576-Q580 VanDerWaalsContact O-CB 3.31Å; A576-Q580 WeakPolarHBondContact O-CB 3.39Å; A576-Q580 PolarHBondContact O-N 3.06Å
577	L	69.7	Low	61.8	Low	61 Å²	61	71.5 Å²	71.5	32%	0.319	44%	0.435	S	S	.	.	H	α-helix	trans	-62.6	-42.7	177.6	-178.2	62.6	0	0	0	111.6	W428 P573 A574 Q580 A581	W428-L577 HydrophobicContact CH2-CD2 3.62Å; W428-L577 HydrophobicContact CZ3-CD2 3.91Å; P573-L577 PolarHBondContact O-N 3.08Å; A574-L577 PolarHBondContact O-N 3.13Å; L577-Q580 PolarHBondContact O-N 3.35Å; L577-A581 VanDerWaalsContact O-CB 3.29Å; L577-A581 WeakPolarHBondContact O-CB 2.88Å; L577-A581 PolarHBondContact O-N 2.66Å
578	T	81.3	Confident	65.1	Low	33 Å²	33	65.4 Å²	65.4	20%	0.202	41%	0.406	C	S	.	.	H	α-helix	trans	-63.4	-46.2	176.8	-55.2	0	0	0	0	110.9	P461 A574 N575 A576 A582	P461-T578 HydrophobicContact CB-CG2 3.67Å; A574-T578 VanDerWaalsContact O-CB 3.27Å; A574-T578 WeakPolarHBondContact O-CB 3.27Å; A574-T578 PolarHBondContact O-N 3.32Å; A574-T578 PolarHBondContact O-OG1 2.85Å; N575-T578 PolarHBondContact O-N 3.37Å; A576-T578 VanDerWaalsContact C-N 3.35Å; A576-T578 PolarHBondContact O-N 3.29Å; T578-A582 WeakPolarHBondContact O-CB 3.28Å; T578-A582 PolarHBondContact O-N 3Å
579	T	79.8	Confident	68.4	Low	93 Å²	93	59.2 Å²	59.2	57%	0.571	37%	0.368	S	S	*	.	H	α-helix	trans	-63.9	-42.7	176.9	-58.8	0	0	0	0	111.8	N575 A576 A582 A583	N575-T579 VanDerWaalsContact O-CB 3.29Å; N575-T579 WeakPolarHBondContact O-CB 3.33Å; N575-T579 PolarHBondContact O-N 3.07Å; N575-T579 PolarHBondContact O-OG1 3.08Å; A576-T579 PolarHBondContact O-N 3.16Å; T579-A582 PolarHBondContact O-N 3.13Å; T579-A583 WeakPolarHBondContact O-CB 3.43Å; T579-A583 PolarHBondContact O-N 2.94Å
580	Q	80.3	Confident	71.6	Confident	125 Å²	125	54 Å²	54	58%	0.584	33%	0.332	S	S	*	.	H	α-helix	trans	-65.4	-45	179.1	-174.3	-176.4	3.6	0	0	111.7	A576 L577 A583	A576-Q580 VanDerWaalsContact O-CB 3.31Å; A576-Q580 WeakPolarHBondContact O-CB 3.39Å; A576-Q580 PolarHBondContact O-N 3.06Å; L577-Q580 PolarHBondContact O-N 3.35Å; Q580-A583 PolarHBondContact O-N 2.82Å
581	A	80.8	Confident	74.7	Confident	5 Å²	5	54.3 Å²	54.3	4%	0.041	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-43.5	176.6	0	0	0	0	0	111.2	L464 A465 L577 A583 G585	L464-A581 HydrophobicContact CB-CB 4.46Å; A465-A581 HydrophobicContact CB-CB 4.12Å; L577-A581 VanDerWaalsContact O-CB 3.29Å; L577-A581 WeakPolarHBondContact O-CB 2.88Å; L577-A581 PolarHBondContact O-N 2.66Å; A581-A583 PolarHBondContact O-N 3.34Å; A581-G585 PolarHBondContact O-N 3.26Å
582	A	81.8	Confident	77.9	Confident	6 Å²	6	50.3 Å²	50.3	5%	0.05	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-38.3	178.8	0	0	0	0	0	112.7	P461 G499 V500 T578 T579 G584 G585	P461-A582 HydrophobicContact CB-CB 3.94Å; P461-A582 HydrophobicContact CG-CB 4.46Å; G499-A582 CarbonylContact C-O 3.59Å; G499-A582 WeakPolarHBondContact CA-O 3.41Å; V500-A582 HydrophobicContact CB-CB 4.29Å; V500-A582 HydrophobicContact CG2-CB 3.96Å; V500-A582 PolarHBondContact N-O 2.92Å; T578-A582 WeakPolarHBondContact O-CB 3.28Å; T578-A582 PolarHBondContact O-N 3Å; T579-A582 PolarHBondContact O-N 3.13Å; A582-G584 VanDerWaalsContact C-N 3.3Å; A582-G584 PolarHBondContact O-N 2.76Å; A582-G585 PolarHBondContact O-N 3.41Å
583	A	84.2	Confident	80.7	Confident	55 Å²	55	53.4 Å²	53.4	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-35.5	-176.6	0	0	0	0	0	113.4	T579 Q580 A581	T579-A583 WeakPolarHBondContact O-CB 3.43Å; T579-A583 PolarHBondContact O-N 2.94Å; Q580-A583 PolarHBondContact O-N 2.82Å; A581-A583 PolarHBondContact O-N 3.34Å
584	G	84.1	Confident	83.3	Confident	24 Å²	24	52 Å²	52	25%	0.247	31%	0.308	C	S	.	.	H	α-helix	trans	-97.3	-14.2	-177.6	0	0	0	0	0	115.4	A582 K587 A588	A582-G584 VanDerWaalsContact C-N 3.3Å; A582-G584 PolarHBondContact O-N 2.76Å; G584-K587 PolarHBondContact O-N 2.97Å; G584-A588 PolarHBondContact O-N 3.06Å
585	G	90.4	Very high	85.3	Confident	4 Å²	4	55.7 Å²	55.7	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	53.6	-155.3	-174.4	0	0	0	0	0	113	A496 A581 A582 K587 A588	A496-G585 WeakPolarHBondContact O-CA 3.4Å; A581-G585 PolarHBondContact O-N 3.26Å; A582-G585 PolarHBondContact O-N 3.41Å; G585-K587 PolarHBondContact O-N 3.44Å; G585-A588 PolarHBondContact O-N 2.94Å
586	L	93	Very high	86.9	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-28.9	175.5	-67.9	171.8	0	0	0	112.8	L464 L467 L482 A496 F497 A588 L589 A590 Y601 V604	L464-L586 HydrophobicContact CD2-CD2 4.42Å; L464-L586 HydrophobicContact CD2-CG 4.44Å; L467-L586 HydrophobicContact CD1-CD2 3.65Å; L482-L586 HydrophobicContact CD2-CD1 4.25Å; L482-L586 HydrophobicContact CD2-CD2 3.98Å; L482-L586 HydrophobicContact CD2-CG 4.41Å; A496-L586 WeakPolarHBondContact O-CG 3.36Å; A496-L586 PolarHBondContact O-N 2.95Å; F497-L586 HydrophobicContact CD1-CB 4.4Å; F497-L586 HydrophobicContact CD1-CD1 3.57Å; F497-L586 HydrophobicContact CE1-CD1 3.46Å; F497-L586 VanDerWaalsContact CE1-CD1 3.46Å; F497-L586 HydrophobicContact CG-CD1 4.25Å; F497-L586 HydrophobicContact CZ-CD1 4.05Å; L586-A588 PolarHBondContact O-N 3.04Å; L586-L589 HydrophobicContact CD2-CD1 4.03Å; L586-L589 WeakPolarHBondContact O-CB 3.34Å; L586-L589 PolarHBondContact O-N 3.22Å; L586-A590 PolarHBondContact O-N 3Å; L586-Y601 HydrophobicContact CB-CD2 4.14Å; L586-Y601 HydrophobicContact CB-CE2 4.15Å; L586-Y601 VanDerWaalsContact O-CD2 3.28Å; L586-Y601 WeakPolarHBondContact O-CD2 3.48Å; L586-V604 HydrophobicContact CD1-CG1 3.67Å; L586-V604 HydrophobicContact CD2-CB 4.15Å; L586-V604 HydrophobicContact CD2-CG1 3.83Å; L586-V604 HydrophobicContact CD2-CG2 3.95Å; L586-V604 HydrophobicContact CG-CG1 4.42Å
587	K	91	Very high	88.2	Confident	153 Å²	153	53 Å²	53	67%	0.665	30%	0.297	S	S	*	.	H	α-helix	trans	-57.5	-35.9	178.1	-173.4	179.5	178.6	-178	0	112.2	F497 G584 G585 L589 A590	F497-K587 PolarHBondContact O-N 3.24Å; G584-K587 PolarHBondContact O-N 2.97Å; G585-K587 PolarHBondContact O-N 3.44Å; K587-L589 VanDerWaalsContact C-N 3.32Å; K587-L589 PolarHBondContact O-N 3.31Å; K587-A590 PolarHBondContact O-N 3.04Å
588	A	92	Very high	89.5	Confident	31 Å²	31	51.1 Å²	51.1	26%	0.256	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-35.2	177.4	0	0	0	0	0	113.1	G584 G585 L586 A590 V591 D592	G584-A588 PolarHBondContact O-N 3.06Å; G585-A588 PolarHBondContact O-N 2.94Å; L586-A588 PolarHBondContact O-N 3.04Å; A588-A590 VanDerWaalsContact C-N 3.28Å; A588-A590 PolarHBondContact O-N 2.99Å; A588-V591 PolarHBondContact O-N 2.79Å; A588-D592 PolarHBondContact O-N 2.7Å
589	L	94.2	Very high	90.1	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-67	-32.7	176.4	-60.7	178.5	0	0	0	111.7	L467 R468 L586 K587 V591 D592 L597 R598 I600	L467-L589 HydrophobicContact CB-CD1 4.05Å; L467-L589 HydrophobicContact CD1-CD1 3.83Å; R468-L589 HydrophobicContact CG-CD2 3.87Å; L586-L589 HydrophobicContact CD2-CD1 4.03Å; L586-L589 WeakPolarHBondContact O-CB 3.34Å; L586-L589 PolarHBondContact O-N 3.22Å; K587-L589 VanDerWaalsContact C-N 3.32Å; K587-L589 PolarHBondContact O-N 3.31Å; L589-V591 VanDerWaalsContact C-N 3.29Å; L589-V591 PolarHBondContact O-N 2.82Å; L589-D592 PolarHBondContact O-N 2.88Å; L589-L597 HydrophobicContact CD2-CB 4.05Å; L589-L597 HydrophobicContact CD2-CD1 4.45Å; L589-L597 HydrophobicContact CD2-CD2 4.3Å; L589-L597 HydrophobicContact CD2-CG 4.49Å; L589-R598 WeakPolarHBondContact O-CA 3.26Å; L589-R598 WeakPolarHBondContact O-CG 3.43Å; L589-R598 PolarHBondContact O-N 2.84Å; L589-I600 HydrophobicContact CD1-CG2 4.12Å
590	A	92.9	Very high	90.9	Very high	3 Å²	3	46.4 Å²	46.4	3%	0.025	26%	0.255	C	S	.	.	H	α-helix	trans	-71.6	-23.2	-176.9	0	0	0	0	0	114.1	L586 K587 A588 Y601 Q682 R685 F686	L586-A590 PolarHBondContact O-N 3Å; K587-A590 PolarHBondContact O-N 3.04Å; A588-A590 VanDerWaalsContact C-N 3.28Å; A588-A590 PolarHBondContact O-N 2.99Å; A590-Y601 HydrophobicContact CB-CD1 4.33Å; A590-Y601 HydrophobicContact CB-CD2 3.81Å; A590-Y601 HydrophobicContact CB-CE1 4.4Å; A590-Y601 HydrophobicContact CB-CE2 3.9Å; A590-Y601 HydrophobicContact CB-CG 4.01Å; A590-Q682 HydrophobicContact CB-CG 3.85Å; A590-R685 PolarHBondContact O-NH2 3.23Å; A590-F686 HydrophobicContact CB-CZ 4.03Å; A590-F686 VanDerWaalsContact O-CE1 3.29Å; A590-F686 WeakPolarHBondContact O-CE1 3.28Å; A590-F686 VanDerWaalsContact O-CZ 3.23Å; A590-F686 WeakPolarHBondContact O-CZ 3.46Å
591	V	92	Very high	91.7	Very high	98 Å²	98	41.1 Å²	41.1	59%	0.594	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.1	7.9	-179.6	-60.7	0	0	0	0	112.4	A588 L589	A588-V591 PolarHBondContact O-N 2.79Å; L589-V591 VanDerWaalsContact C-N 3.29Å; L589-V591 PolarHBondContact O-N 2.82Å
592	D	94.2	Very high	92.4	Very high	27 Å²	27	40.9 Å²	40.9	14%	0.144	23%	0.228	C	C	.	.			trans	-70.3	142.1	-177.2	-154.1	-65	0	0	0	111.1	R468 A588 L589 N594 L597 R598	R468-D592 IonicContact CZ-OD2 2.79Å; R468-D592 IonicContact NH2-OD2 2.58Å; R468-D592 PolarHBondContact NH2-OD2 3.31Å; A588-D592 PolarHBondContact O-N 2.7Å; L589-D592 PolarHBondContact O-N 2.88Å; D592-N594 VanDerWaalsContact C-N 3.25Å; D592-N594 PolarHBondContact O-N 2.95Å; D592-N594 WeakPolarHBondContact OD1-CB 3.49Å; D592-N594 PolarHBondContact OD1-N 3.13Å; D592-L597 HydrophobicContact CB-CB 4.01Å; D592-L597 HydrophobicContact CB-CD1 4.37Å; D592-L597 VanDerWaalsContact OD2-CD1 3.31Å; D592-L597 WeakPolarHBondContact OD2-CD1 3.35Å; D592-R598 VanDerWaalsContact O-CD 3.28Å; D592-R598 WeakPolarHBondContact O-CD 3.43Å; D592-R598 WeakPolarHBondContact O-CG 3.44Å; D592-R598 PolarHBondContact O-NH1 3.32Å
593	T	93.5	Very high	92.9	Very high	139 Å²	139	41.2 Å²	41.2	85%	0.853	23%	0.229	S	C	*	.	S	Bend	trans	-67.8	-30.5	177.5	56.9	0	0	0	0	111.2	Y595 R598	T593-Y595 PolarHBondContact O-N 3.42Å; T593-R598 PolarHBondContact O-NH1 3.33Å
594	N	93.9	Very high	93.4	Very high	70 Å²	70	38.6 Å²	38.6	37%	0.374	21%	0.207	S	C	.	.	S	Bend	trans	-74.3	110.7	175.1	-173	-16.8	0	0	0	110.5	D592 H596 L597 R598	D592-N594 VanDerWaalsContact C-N 3.25Å; D592-N594 PolarHBondContact O-N 2.95Å; D592-N594 WeakPolarHBondContact OD1-CB 3.49Å; D592-N594 PolarHBondContact OD1-N 3.13Å; N594-H596 PolarHBondContact O-N 3.16Å; N594-H596 VanDerWaalsContact O-N 3.17Å; N594-H596 VanDerWaalsContact OD1-CB 3.32Å; N594-H596 WeakPolarHBondContact OD1-CB 3.43Å; N594-H596 PolarHBondContact OD1-CD2 3.24Å; N594-H596 PolarHBondContact OD1-N 3.5Å; N594-L597 HydrophobicContact CB-CD1 4.29Å; N594-L597 HydrophobicContact CB-CG 4.19Å; N594-L597 WeakPolarHBondContact O-CB 3.31Å; N594-L597 PolarHBondContact O-N 3Å; N594-R598 PolarHBondContact O-N 3.45Å
595	Y	94.6	Very high	93.9	Very high	87 Å²	87	37.5 Å²	37.5	34%	0.341	20%	0.195	S	C	.	.	H	α-helix	trans	-61.1	-26.6	-178.7	80.6	-89.9	0	0	0	113.2	T593 L597 R598 Q599 V692 V695	T593-Y595 PolarHBondContact O-N 3.42Å; Y595-L597 VanDerWaalsContact C-N 3.28Å; Y595-L597 PolarHBondContact O-N 3.02Å; Y595-R598 PolarHBondContact O-N 3.46Å; Y595-Q599 WeakPolarHBondContact O-CB 3.49Å; Y595-Q599 PolarHBondContact O-N 3.37Å; Y595-V692 HydrophobicContact CD1-CG2 4.45Å; Y595-V692 HydrophobicContact CD2-CG1 3.85Å; Y595-V692 HydrophobicContact CE2-CG1 4.29Å; Y595-V692 HydrophobicContact CG-CB 4.45Å; Y595-V692 HydrophobicContact CG-CG1 4.06Å; Y595-V692 HydrophobicContact CG-CG2 4.05Å; Y595-V695 HydrophobicContact CD2-CG2 4.12Å
596	H	93.3	Very high	94	Very high	78 Å²	78	38.6 Å²	38.6	36%	0.361	20%	0.199	S	C	.	.	H	α-helix	trans	-63.6	-35	173.6	-63.8	-65.6	0	0	0	111.8	N594 Q599 I600	N594-H596 PolarHBondContact O-N 3.16Å; N594-H596 VanDerWaalsContact O-N 3.17Å; N594-H596 VanDerWaalsContact OD1-CB 3.32Å; N594-H596 WeakPolarHBondContact OD1-CB 3.43Å; N594-H596 PolarHBondContact OD1-CD2 3.24Å; N594-H596 PolarHBondContact OD1-N 3.5Å; H596-Q599 WeakPolarHBondContact O-CB 3.43Å; H596-Q599 PolarHBondContact O-N 3.08Å; H596-I600 WeakPolarHBondContact O-CG1 3.16Å; H596-I600 PolarHBondContact O-N 2.78Å
597	L	94.9	Very high	93.9	Very high	16 Å²	16	39 Å²	39	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-74.2	-35.4	177.4	-64.6	-175.5	0	0	0	111.5	R468 L589 D592 N594 Y595 Q599 I600 Y601	R468-L597 HydrophobicContact CB-CD2 4.35Å; R468-L597 HydrophobicContact CG-CD2 4.23Å; L589-L597 HydrophobicContact CD2-CB 4.05Å; L589-L597 HydrophobicContact CD2-CD1 4.45Å; L589-L597 HydrophobicContact CD2-CD2 4.3Å; L589-L597 HydrophobicContact CD2-CG 4.49Å; D592-L597 HydrophobicContact CB-CB 4.01Å; D592-L597 HydrophobicContact CB-CD1 4.37Å; D592-L597 VanDerWaalsContact OD2-CD1 3.31Å; D592-L597 WeakPolarHBondContact OD2-CD1 3.35Å; N594-L597 HydrophobicContact CB-CD1 4.29Å; N594-L597 HydrophobicContact CB-CG 4.19Å; N594-L597 WeakPolarHBondContact O-CB 3.31Å; N594-L597 PolarHBondContact O-N 3Å; Y595-L597 VanDerWaalsContact C-N 3.28Å; Y595-L597 PolarHBondContact O-N 3.02Å; L597-Q599 VanDerWaalsContact C-N 3.29Å; L597-Q599 PolarHBondContact O-N 3.22Å; L597-I600 WeakPolarHBondContact O-CB 3.26Å; L597-I600 PolarHBondContact O-N 3.27Å; L597-I600 VanDerWaalsContact O-N 3.13Å; L597-Y601 PolarHBondContact O-N 3.42Å
598	R	97.2	Very high	94.1	Very high	21 Å²	21	31.8 Å²	31.8	8%	0.079	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-39	169.3	-56.6	-161.9	-59.5	-82.5	4.4	111.5	L589 D592 T593 N594 Y595 I600 Y601 I602 F686 D690 V695	L589-R598 WeakPolarHBondContact O-CA 3.26Å; L589-R598 WeakPolarHBondContact O-CG 3.43Å; L589-R598 PolarHBondContact O-N 2.84Å; D592-R598 VanDerWaalsContact O-CD 3.28Å; D592-R598 WeakPolarHBondContact O-CD 3.43Å; D592-R598 WeakPolarHBondContact O-CG 3.44Å; D592-R598 PolarHBondContact O-NH1 3.32Å; T593-R598 PolarHBondContact O-NH1 3.33Å; N594-R598 PolarHBondContact O-N 3.45Å; Y595-R598 PolarHBondContact O-N 3.46Å; R598-I600 VanDerWaalsContact C-N 3.32Å; R598-I600 PolarHBondContact O-N 3.19Å; R598-Y601 WeakPolarHBondContact O-CB 3.36Å; R598-Y601 PolarHBondContact O-N 3.37Å; R598-I602 WeakPolarHBondContact O-CG1 3.45Å; R598-I602 PolarHBondContact O-N 2.91Å; R598-F686 HydrophobicContact CB-CE1 4.29Å; R598-F686 HydrophobicContact CB-CZ 4.04Å; R598-F686 HydrophobicContact CG-CE1 4.4Å; R598-F686 HydrophobicContact CG-CZ 4.37Å; R598-D690 IonicContact CZ-OD1 3.41Å; R598-D690 IonicContact CZ-OD2 2.71Å; R598-D690 IonicContact NE-OD1 3.7Å; R598-D690 IonicContact NE-OD2 2.86Å; R598-D690 PolarHBondContact NE-OD2 3.39Å; R598-D690 IonicContact NH2-OD1 3.29Å; R598-D690 PolarHBondContact NH2-OD1 2.98Å; R598-D690 IonicContact NH2-OD2 2.69Å; R598-D690 PolarHBondContact NH2-OD2 3.15Å; R598-V695 HydrophobicContact CB-CG1 4.47Å
599	Q	95	Very high	94.1	Very high	20 Å²	20	31 Å²	31	9%	0.093	16%	0.163	C	C	.	.	H	α-helix	trans	-62.5	-37.5	172.3	-173.2	62.4	59.3	0	0	112.6	Y595 H596 L597 I602 N603 N694 C698	Y595-Q599 WeakPolarHBondContact O-CB 3.49Å; Y595-Q599 PolarHBondContact O-N 3.37Å; H596-Q599 WeakPolarHBondContact O-CB 3.43Å; H596-Q599 PolarHBondContact O-N 3.08Å; L597-Q599 VanDerWaalsContact C-N 3.29Å; L597-Q599 PolarHBondContact O-N 3.22Å; Q599-I602 WeakPolarHBondContact O-CB 3.32Å; Q599-I602 PolarHBondContact O-N 3.21Å; Q599-N603 PolarHBondContact NE2-OD1 3.06Å; Q599-N603 PolarHBondContact O-N 2.82Å; Q599-N603 PolarHBondContact O-OD1 3.29Å; Q599-N694 PolarHBondContact OE1-ND2 3.29Å; Q599-C698 PolarHBondContact NE2-SG 3.23Å; Q599-C698 VanDerWaalsContact OE1-CB 3.23Å; Q599-C698 PolarHBondContact OE1-SG 3.35Å
600	I	95.2	Very high	93.8	Very high	7 Å²	7	31 Å²	31	4%	0.036	16%	0.164	C	C	.	.	H	α-helix	trans	-65.5	-39.3	174.1	-66.7	-42	0	0	0	111.6	L467 R475 L589 H596 L597 R598 I602 N603 V604	L467-I600 HydrophobicContact CB-CG2 3.95Å; L467-I600 HydrophobicContact CD2-CG2 3.81Å; L467-I600 HydrophobicContact CG-CG2 4.38Å; R475-I600 HydrophobicContact CB-CD1 3.58Å; R475-I600 HydrophobicContact CB-CG1 3.89Å; R475-I600 HydrophobicContact CG-CD1 4.5Å; R475-I600 HydrophobicContact CG-CG1 4.39Å; L589-I600 HydrophobicContact CD1-CG2 4.12Å; H596-I600 WeakPolarHBondContact O-CG1 3.16Å; H596-I600 PolarHBondContact O-N 2.78Å; L597-I600 WeakPolarHBondContact O-CB 3.26Å; L597-I600 PolarHBondContact O-N 3.27Å; L597-I600 VanDerWaalsContact O-N 3.13Å; R598-I600 VanDerWaalsContact C-N 3.32Å; R598-I600 PolarHBondContact O-N 3.19Å; I600-I602 VanDerWaalsContact C-N 3.28Å; I600-I602 PolarHBondContact O-N 3.38Å; I600-N603 WeakPolarHBondContact O-CB 3.47Å; I600-N603 PolarHBondContact O-N 3.08Å; I600-N603 VanDerWaalsContact O-N 3.08Å; I600-V604 HydrophobicContact CG2-CG2 4.46Å; I600-V604 WeakPolarHBondContact O-CG2 3.5Å; I600-V604 PolarHBondContact O-N 2.81Å
601	Y	96.9	Very high	93.4	Very high	14 Å²	14	32.3 Å²	32.3	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-54.5	-47.7	171.4	176.8	-87.6	0	0	0	111.3	L586 A590 L597 R598 N603 V604 V605 C679 Q682 F686	L586-Y601 HydrophobicContact CB-CD2 4.14Å; L586-Y601 HydrophobicContact CB-CE2 4.15Å; L586-Y601 VanDerWaalsContact O-CD2 3.28Å; L586-Y601 WeakPolarHBondContact O-CD2 3.48Å; A590-Y601 HydrophobicContact CB-CD1 4.33Å; A590-Y601 HydrophobicContact CB-CD2 3.81Å; A590-Y601 HydrophobicContact CB-CE1 4.4Å; A590-Y601 HydrophobicContact CB-CE2 3.9Å; A590-Y601 HydrophobicContact CB-CG 4.01Å; L597-Y601 PolarHBondContact O-N 3.42Å; R598-Y601 WeakPolarHBondContact O-CB 3.36Å; R598-Y601 PolarHBondContact O-N 3.37Å; Y601-N603 VanDerWaalsContact C-N 3.27Å; Y601-N603 PolarHBondContact O-N 3.34Å; Y601-V604 PolarHBondContact O-N 3.04Å; Y601-V605 HydrophobicContact CD1-CG2 4.16Å; Y601-V605 HydrophobicContact CE1-CG2 3.8Å; Y601-V605 WeakPolarHBondContact O-CG2 3.45Å; Y601-V605 PolarHBondContact O-N 3.22Å; Y601-C679 WeakPolarHBondContact OH-CA 3.33Å; Y601-C679 PolarHBondContact OH-SG 2.99Å; Y601-C679 VanDerWaalsContact OH-SG 3.37Å; Y601-Q682 HydrophobicContact CE1-CB 4.16Å; Y601-Q682 HydrophobicContact CE1-CG 3.71Å; Y601-F686 AromaticContact CD1-CE2 3.74Å; Y601-F686 HydrophobicContact CD1-CE2 3.74Å; Y601-F686 HydrophobicContact CE1-CE2 4.21Å
602	I	95.6	Very high	93.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.4	-39.5	177	-61.6	172	0	0	0	111.1	R598 Q599 I600 V605 Q606 L683 F686 V695 C698 A699 A702	R598-I602 WeakPolarHBondContact O-CG1 3.45Å; R598-I602 PolarHBondContact O-N 2.91Å; Q599-I602 WeakPolarHBondContact O-CB 3.32Å; Q599-I602 PolarHBondContact O-N 3.21Å; I600-I602 VanDerWaalsContact C-N 3.28Å; I600-I602 PolarHBondContact O-N 3.38Å; I602-V605 PolarHBondContact O-N 2.92Å; I602-Q606 WeakPolarHBondContact O-CG 3.35Å; I602-Q606 PolarHBondContact O-N 3.45Å; I602-Q606 VanDerWaalsContact O-N 3.1Å; I602-Q606 PolarHBondContact O-NE2 2.84Å; I602-L683 HydrophobicContact CB-CD2 4.35Å; I602-L683 HydrophobicContact CG1-CD2 3.83Å; I602-L683 HydrophobicContact CG2-CD2 4.12Å; I602-F686 HydrophobicContact CD1-CD2 3.95Å; I602-F686 HydrophobicContact CD1-CE2 4.43Å; I602-F686 HydrophobicContact CG1-CD2 3.91Å; I602-F686 HydrophobicContact CG1-CE2 4.09Å; I602-V695 HydrophobicContact CD1-CG1 3.8Å; I602-C698 HydrophobicContact CD1-CB 4.25Å; I602-C698 HydrophobicContact CG2-CB 4.25Å; I602-C698 WeakPolarHBondContact CG2-O 3.42Å; I602-A699 HydrophobicContact CD1-CB 4.15Å; I602-A702 HydrophobicContact CG2-CB 3.45Å; I602-A702 VanDerWaalsContact CG2-CB 3.45Å
603	N	93.1	Very high	93.1	Very high	12 Å²	12	26.7 Å²	26.7	6%	0.064	14%	0.14	C	C	.	.	H	α-helix	trans	-67.7	-38.7	178.2	-63.2	-10.6	0	0	0	112.6	C479 Q599 I600 Y601 Q606 A607 R636	C479-N603 HydrophobicContact CB-CB 4.32Å; C479-N603 VanDerWaalsContact SG-CB 3.6Å; Q599-N603 PolarHBondContact NE2-OD1 3.06Å; Q599-N603 PolarHBondContact O-N 2.82Å; Q599-N603 PolarHBondContact O-OD1 3.29Å; I600-N603 WeakPolarHBondContact O-CB 3.47Å; I600-N603 PolarHBondContact O-N 3.08Å; I600-N603 VanDerWaalsContact O-N 3.08Å; Y601-N603 VanDerWaalsContact C-N 3.27Å; Y601-N603 PolarHBondContact O-N 3.34Å; N603-Q606 PolarHBondContact O-N 3.14Å; N603-A607 WeakPolarHBondContact O-CB 3.45Å; N603-A607 PolarHBondContact O-N 2.95Å; N603-R636 PolarHBondContact ND2-NH1 2.9Å; N603-R636 PolarHBondContact ND2-NH2 3.5Å; N603-R636 PolarHBondContact OD1-NH1 3.31Å
604	V	95.5	Very high	92.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-44.5	174.2	173.8	0	0	0	0	110.5	L467 C479 L482 L586 I600 Y601 Q606 A607 V608	L467-V604 HydrophobicContact CD1-CG2 4.1Å; L467-V604 HydrophobicContact CD2-CG2 3.76Å; C479-V604 HydrophobicContact CB-CG2 4.04Å; L482-V604 HydrophobicContact CD2-CG1 3.89Å; L482-V604 HydrophobicContact CD2-CG2 4.41Å; L586-V604 HydrophobicContact CD1-CG1 3.67Å; L586-V604 HydrophobicContact CD2-CB 4.15Å; L586-V604 HydrophobicContact CD2-CG1 3.83Å; L586-V604 HydrophobicContact CD2-CG2 3.95Å; L586-V604 HydrophobicContact CG-CG1 4.42Å; I600-V604 HydrophobicContact CG2-CG2 4.46Å; I600-V604 WeakPolarHBondContact O-CG2 3.5Å; I600-V604 PolarHBondContact O-N 2.81Å; Y601-V604 PolarHBondContact O-N 3.04Å; V604-Q606 VanDerWaalsContact C-N 3.29Å; V604-Q606 PolarHBondContact O-N 2.9Å; V604-A607 PolarHBondContact O-N 3.4Å; V604-A607 VanDerWaalsContact O-N 3.13Å; V604-V608 HydrophobicContact CG1-CG2 4.09Å; V604-V608 WeakPolarHBondContact O-CB 3.5Å; V604-V608 VanDerWaalsContact O-CG2 3.27Å; V604-V608 WeakPolarHBondContact O-CG2 3.16Å; V604-V608 PolarHBondContact O-N 3.3Å
605	V	94.7	Very high	92.6	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-58.3	-43.9	177.4	175.7	0	0	0	0	111	Y601 I602 V608 W609 C679 L683 I706	Y601-V605 HydrophobicContact CD1-CG2 4.16Å; Y601-V605 HydrophobicContact CE1-CG2 3.8Å; Y601-V605 WeakPolarHBondContact O-CG2 3.45Å; Y601-V605 PolarHBondContact O-N 3.22Å; I602-V605 PolarHBondContact O-N 2.92Å; V605-V608 PolarHBondContact O-N 3.31Å; V605-W609 HydrophobicContact CB-CE3 4.48Å; V605-W609 HydrophobicContact CG1-CE3 3.95Å; V605-W609 HydrophobicContact CG1-CZ3 4.38Å; V605-W609 HydrophobicContact CG2-CZ3 4.47Å; V605-W609 PolarHBondContact O-N 2.88Å; V605-C679 HydrophobicContact CG1-CB 4.18Å; V605-C679 HydrophobicContact CG2-CB 3.89Å; V605-L683 HydrophobicContact CG1-CD1 3.93Å; V605-I706 HydrophobicContact CG1-CD1 3.95Å; V605-I706 HydrophobicContact CG1-CG2 4.4Å
606	Q	91.8	Very high	92.4	Very high	27 Å²	27	19.7 Å²	19.7	13%	0.126	10%	0.101	C	C	.	.	H	α-helix	trans	-63.8	-42	174.7	-71.6	174.2	95.3	0	0	112.8	I602 N603 V604 V608 G610 A702 V705	I602-Q606 WeakPolarHBondContact O-CG 3.35Å; I602-Q606 PolarHBondContact O-N 3.45Å; I602-Q606 VanDerWaalsContact O-N 3.1Å; I602-Q606 PolarHBondContact O-NE2 2.84Å; N603-Q606 PolarHBondContact O-N 3.14Å; V604-Q606 VanDerWaalsContact C-N 3.29Å; V604-Q606 PolarHBondContact O-N 2.9Å; Q606-V608 VanDerWaalsContact C-N 3.27Å; Q606-V608 PolarHBondContact O-N 3.5Å; Q606-G610 WeakPolarHBondContact O-CA 3.44Å; Q606-G610 PolarHBondContact O-N 3.46Å; Q606-A702 HydrophobicContact CG-CB 3.6Å; Q606-V705 HydrophobicContact CB-CG1 4.33Å; Q606-V705 HydrophobicContact CG-CB 4.35Å; Q606-V705 HydrophobicContact CG-CG1 4.19Å
607	A	91.5	Very high	92.1	Very high	12 Å²	12	17.7 Å²	17.7	10%	0.099	10%	0.096	C	C	.	.	H	α-helix	trans	-67.1	-29.5	179.3	0	0	0	0	0	112.8	R480 A483 N603 V604	R480-A607 HydrophobicContact CG-CB 4.42Å; A483-A607 HydrophobicContact CB-CB 3.98Å; N603-A607 WeakPolarHBondContact O-CB 3.45Å; N603-A607 PolarHBondContact O-N 2.95Å; V604-A607 PolarHBondContact O-N 3.4Å; V604-A607 VanDerWaalsContact O-N 3.13Å
608	V	93.9	Very high	91.8	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-86.5	-42.6	-177.8	171.5	0	0	0	0	112.6	A483 L486 V604 V605 Q606 P669 I671	A483-V608 HydrophobicContact CB-CG2 4.35Å; L486-V608 HydrophobicContact CD1-CG2 4.16Å; V604-V608 HydrophobicContact CG1-CG2 4.09Å; V604-V608 WeakPolarHBondContact O-CB 3.5Å; V604-V608 VanDerWaalsContact O-CG2 3.27Å; V604-V608 WeakPolarHBondContact O-CG2 3.16Å; V604-V608 PolarHBondContact O-N 3.3Å; V605-V608 PolarHBondContact O-N 3.31Å; Q606-V608 VanDerWaalsContact C-N 3.27Å; Q606-V608 PolarHBondContact O-N 3.5Å; V608-P669 HydrophobicContact CG1-CG 4.47Å; V608-P669 WeakPolarHBondContact O-CD 3.28Å; V608-I671 HydrophobicContact CG1-CD1 3.31Å; V608-I671 HydrophobicContact CG1-CG1 4.16Å
609	W	91.6	Very high	91.5	Very high	15 Å²	15	22.4 Å²	22.4	6%	0.057	13%	0.127	C	C	.	.	H	α-helix	trans	-115.5	2.3	-174.5	-72.3	-76.3	0	0	0	114.6	F497 V605 I671 L676 C679 I706 S709	F497-W609 AromaticContact CE1-CH2 3.57Å; F497-W609 HydrophobicContact CE1-CH2 3.57Å; F497-W609 AromaticContact CE1-CZ3 3.85Å; F497-W609 HydrophobicContact CE1-CZ3 3.85Å; F497-W609 HydrophobicContact CE2-CH2 4.17Å; F497-W609 AromaticContact CZ-CH2 3.29Å; F497-W609 HydrophobicContact CZ-CH2 3.29Å; F497-W609 HydrophobicContact CZ-CZ2 4.21Å; F497-W609 AromaticContact CZ-CZ3 3.76Å; F497-W609 HydrophobicContact CZ-CZ3 3.76Å; V605-W609 HydrophobicContact CB-CE3 4.48Å; V605-W609 HydrophobicContact CG1-CE3 3.95Å; V605-W609 HydrophobicContact CG1-CZ3 4.38Å; V605-W609 HydrophobicContact CG2-CZ3 4.47Å; V605-W609 PolarHBondContact O-N 2.88Å; W609-I671 HydrophobicContact CZ2-CB 4.22Å; W609-I671 HydrophobicContact CZ2-CG2 3.95Å; W609-L676 HydrophobicContact CB-CD1 4.27Å; W609-L676 HydrophobicContact CD2-CB 4.46Å; W609-L676 HydrophobicContact CD2-CD1 3.79Å; W609-L676 HydrophobicContact CE3-CD1 4.32Å; W609-L676 HydrophobicContact CG-CD1 3.77Å; W609-L676 HydrophobicContact CZ2-CB 3.92Å; W609-C679 HydrophobicContact CZ3-CB 4.15Å; W609-C679 VanDerWaalsContact CZ3-SG 3.58Å; W609-I706 HydrophobicContact CB-CB 4.11Å; W609-I706 HydrophobicContact CB-CG2 3.93Å; W609-S709 PolarHBondContact O-OG 3.24Å
610	G	88.8	Confident	91.1	Very high	4 Å²	4	22.8 Å²	22.8	4%	0.041	13%	0.132	C	C	.	.	S	Bend	trans	-68	176.3	168.1	0	0	0	0	0	111.8	Q606 G612	Q606-G610 WeakPolarHBondContact O-CA 3.44Å; Q606-G610 PolarHBondContact O-N 3.46Å; G610-G612 PolarHBondContact O-N 3.1Å; G610-G612 VanDerWaalsContact O-N 3.11Å
611	P	85.4	Confident	90.7	Very high	30 Å²	30	22.5 Å²	22.5	20%	0.195	13%	0.13	C	C	.	.	S	Bend	trans	-68.1	-12.3	-173.4	28.6	-37.2	0	0	0	114.4	Y639 P662	P611-Y639 HydrophobicContact CG-CD1 3.64Å; P611-Y639 HydrophobicContact CG-CE1 3.93Å; P611-P662 HydrophobicContact CB-CG 3.98Å; P611-P662 HydrophobicContact CG-CG 4.23Å; P611-P662 WeakPolarHBondContact O-CD 3.43Å
612	G	87.9	Confident	90	Very high	6 Å²	6	24.3 Å²	24.3	6%	0.062	14%	0.141	C	C	.	.			trans	173.1	162.2	175	0	0	0	0	0	112.5	G610 Y639 Q666	G610-G612 PolarHBondContact O-N 3.1Å; G610-G612 VanDerWaalsContact O-N 3.11Å; G612-Y639 PolarHBondContact O-OH 3.49Å; G612-Q666 CarbonylContact C-O 3.59Å; G612-Q666 VanDerWaalsContact CA-O 3.29Å; G612-Q666 WeakPolarHBondContact CA-O 3.29Å
613	I	91.2	Very high	88.6	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	118.3	179.6	-48.7	168	0	0	0	109.1	R480 A483 R484 V487 D615 C665 Q666 A667 P669	R480-I613 HydrophobicContact CB-CG2 3.99Å; R480-I613 HydrophobicContact CG-CG2 4.33Å; A483-I613 HydrophobicContact CB-CD1 3.69Å; A483-I613 HydrophobicContact CB-CG1 3.86Å; A483-I613 HydrophobicContact CB-CG2 4.27Å; R484-I613 HydrophobicContact CG-CD1 4.08Å; R484-I613 HydrophobicContact CG-CG2 4.18Å; V487-I613 HydrophobicContact CG2-CD1 3.77Å; I613-D615 PolarHBondContact O-N 3.41Å; I613-C665 CarbonylContact O-C 3.53Å; I613-C665 VanDerWaalsContact O-CA 3.26Å; I613-C665 WeakPolarHBondContact O-CA 3.46Å; I613-Q666 HydrophobicContact CB-CB 4.33Å; I613-Q666 PolarHBondContact N-O 3.37Å; I613-Q666 PolarHBondContact O-N 3.13Å; I613-A667 WeakPolarHBondContact CD1-O 3.44Å; I613-P669 HydrophobicContact CD1-CG 4.48Å
614	L	87.9	Confident	87.5	Confident	36 Å²	36	30.2 Å²	30.2	19%	0.188	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	133.8	-176.9	-166.9	68.6	0	0	0	112.6	R480 R484 L631 Y639 G664	R480-L614 PolarHBondContact NH1-O 3.4Å; R484-L614 PolarHBondContact NH2-O 2.82Å; L614-L631 HydrophobicContact CD2-CD1 3.25Å; L614-L631 HydrophobicContact CD2-CD2 3.34Å; L614-L631 HydrophobicContact CD2-CG 3.89Å; L614-Y639 VanDerWaalsContact CA-OH 3.24Å; L614-Y639 WeakPolarHBondContact CA-OH 3.49Å; L614-Y639 HydrophobicContact CB-CE2 3.92Å; L614-Y639 VanDerWaalsContact CB-OH 3.28Å; L614-Y639 WeakPolarHBondContact CB-OH 3.35Å; L614-Y639 HydrophobicContact CD1-CE2 3.49Å; L614-Y639 VanDerWaalsContact CD1-CE2 3.49Å; L614-Y639 HydrophobicContact CD2-CE2 4.21Å; L614-Y639 HydrophobicContact CG-CE2 4.05Å; L614-Y639 PolarHBondContact N-OH 3.19Å; L614-Y639 VanDerWaalsContact N-OH 3.17Å; L614-G664 WeakPolarHBondContact CD1-O 3.33Å
615	D	89.2	Confident	86.3	Confident	67 Å²	67	33.9 Å²	33.9	36%	0.358	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-56	143.2	173.3	-70.2	-33.7	0	0	0	112.1	I613 G664 Q666	I613-D615 PolarHBondContact O-N 3.41Å; D615-G664 PolarHBondContact N-O 2.97Å; D615-G664 WeakPolarHBondContact OD2-CA 3.45Å; D615-Q666 WeakPolarHBondContact OD1-CG 3.46Å; D615-Q666 PolarHBondContact OD1-NE2 3.31Å
616	E	89.4	Confident	84.9	Confident	45 Å²	45	38.2 Å²	38.2	21%	0.21	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-71.7	133.2	174.1	-62.1	-62.3	151.8	0	0	109.4	Q441 C477 R480 R484	Q441-E616 HydrophobicContact CG-CG 4.36Å; Q441-E616 PolarHBondContact NE2-OE2 2.95Å; C477-E616 PolarHBondContact SG-OE1 2.85Å; R480-E616 IonicContact CZ-OE1 3.23Å; R480-E616 IonicContact CZ-OE2 2.66Å; R480-E616 VanDerWaalsContact CZ-OE2 3.23Å; R480-E616 IonicContact NH1-OE1 2.79Å; R480-E616 PolarHBondContact NH1-OE1 2.98Å; R480-E616 IonicContact NH1-OE2 3.78Å; R480-E616 PolarHBondContact NH1-OE2 3.33Å; R480-E616 IonicContact NH2-OE1 3.36Å; R480-E616 PolarHBondContact NH2-OE1 3.49Å; R480-E616 IonicContact NH2-OE2 2.88Å; R480-E616 PolarHBondContact NH2-OE2 3.29Å; R484-E616 IonicContact NH1-OE1 3.71Å; R484-E616 PolarHBondContact NH1-OE1 3Å
617	P	87.8	Confident	84	Confident	37 Å²	37	38.8 Å²	38.8	24%	0.24	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-61.8	153	165.4	28.7	-34.9	0	0	0	110.1	Y619 G629	P617-Y619 PolarHBondContact O-N 3.35Å; P617-G629 VanDerWaalsContact CG-C 3.43Å; P617-G629 WeakPolarHBondContact CG-O 3.25Å
618	P	87.9	Confident	83.1	Confident	112 Å²	112	39.3 Å²	39.3	73%	0.727	24%	0.237	S	C	*	.	P	Polyproline II helix	trans	-59.7	136.7	179.1	25.6	-34.1	0	0	0	110.8	G629	P618-G629 VanDerWaalsContact O-CA 3.22Å; P618-G629 WeakPolarHBondContact O-CA 3.36Å; P618-G629 PolarHBondContact O-N 3Å
619	Y	90.8	Very high	82.2	Confident	23 Å²	23	39.5 Å²	39.5	9%	0.09	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-70.3	142.7	174.3	-167.1	-88	0	0	0	109.9	Q398 F401 E402 R434 G438 Q441 P617	Q398-Y619 HydrophobicContact CB-CE1 3.99Å; Q398-Y619 HydrophobicContact CG-CE1 4.2Å; Q398-Y619 WeakPolarHBondContact CG-OH 3.44Å; F401-Y619 HydrophobicContact CB-CD1 3.84Å; F401-Y619 HydrophobicContact CB-CD2 4.41Å; F401-Y619 HydrophobicContact CB-CE1 3.82Å; F401-Y619 HydrophobicContact CB-CE2 4.4Å; F401-Y619 HydrophobicContact CB-CG 4.14Å; F401-Y619 HydrophobicContact CD2-CE1 4.5Å; E402-Y619 HydrophobicContact CB-CD1 4.26Å; R434-Y619 VanDerWaalsContact C-OH 3.29Å; R434-Y619 PolarHBondContact O-OH 2.93Å; G438-Y619 VanDerWaalsContact CA-CE2 3.47Å; Q441-Y619 VanDerWaalsContact OE1-CD2 3.29Å; P617-Y619 PolarHBondContact O-N 3.35Å
620	S	87.9	Confident	81.7	Confident	29 Å²	29	40 Å²	40	20%	0.203	24%	0.242	C	C	.	.			trans	-125.9	122.9	174.8	175.1	0	0	0	0	109.8	R434 A628	R434-S620 PolarHBondContact NH2-O 3.07Å; S620-A628 VanDerWaalsContact CB-CB 3.48Å
621	A	86.3	Confident	81.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-76.2	-49	-176.9	0	0	0	0	0	112.8	Q395 Q398 Y399 E402 G623	Q395-A621 PolarHBondContact NE2-O 3.17Å; Q395-A621 PolarHBondContact OE1-O 3.45Å; Q398-A621 HydrophobicContact CB-CB 3.7Å; Q398-A621 PolarHBondContact OE1-O 3.46Å; Q398-A621 VanDerWaalsContact OE1-O 3.13Å; Y399-A621 HydrophobicContact CD1-CB 3.56Å; Y399-A621 HydrophobicContact CE1-CB 4.04Å; Y399-A621 HydrophobicContact CG-CB 4.48Å; E402-A621 HydrophobicContact CB-CB 4.32Å; E402-A621 WeakPolarHBondContact OE2-CB 3.46Å; E402-A621 PolarHBondContact OE2-N 3.37Å; A621-G623 PolarHBondContact O-N 3.11Å; A621-G623 VanDerWaalsContact O-N 3.16Å
622	L	80.9	Confident	81.1	Confident	52 Å²	52	44.2 Å²	44.2	27%	0.272	26%	0.257	S	S	.	.	S	Bend	trans	-63.7	-23.2	-175	-68.8	176	0	0	0	112.8	R357 Y399 D624	R357-L622 HydrophobicContact CG-CD2 4.38Å; Y399-L622 HydrophobicContact CE1-CD2 4.22Å; L622-D624 PolarHBondContact O-N 3.36Å; L622-D624 VanDerWaalsContact O-N 3.09Å
623	G	67.4	Low	80.2	Confident	22 Å²	22	47.2 Å²	47.2	23%	0.227	28%	0.276	C	S	.	.			trans	63.1	16.3	175.9	0	0	0	0	0	113.6	A621 D625	A621-G623 PolarHBondContact O-N 3.11Å; A621-G623 VanDerWaalsContact O-N 3.16Å; G623-D625 CarbonylContact O-C 3.52Å; G623-D625 PolarHBondContact O-N 3.04Å; G623-D625 VanDerWaalsContact O-N 3.17Å
624	D	70.3	Confident	79.1	Confident	114 Å²	114	50.2 Å²	50.2	61%	0.61	30%	0.3	S	S	*	.	S	Bend	trans	-53.4	-34	174.4	-66	-42.9	0	0	0	110.4	R357 L622	R357-D624 IonicContact NH2-OD1 3.23Å; L622-D624 PolarHBondContact O-N 3.36Å; L622-D624 VanDerWaalsContact O-N 3.09Å
625	D	69.8	Low	78.1	Confident	78 Å²	78	50.3 Å²	50.3	42%	0.417	30%	0.304	S	S	.	.	S	Bend	trans	-101.9	106.8	159	179	3.8	0	0	0	109.8	G623 S627 A628	G623-D625 CarbonylContact O-C 3.52Å; G623-D625 PolarHBondContact O-N 3.04Å; G623-D625 VanDerWaalsContact O-N 3.17Å; D625-S627 VanDerWaalsContact CG-OG 3.23Å; D625-S627 PolarHBondContact O-N 3.49Å; D625-S627 VanDerWaalsContact O-N 3.12Å; D625-S627 WeakPolarHBondContact OD1-CA 3.36Å; D625-S627 VanDerWaalsContact OD1-CB 3.3Å; D625-S627 WeakPolarHBondContact OD1-CB 3.42Å; D625-S627 PolarHBondContact OD1-N 3.24Å; D625-S627 PolarHBondContact OD1-OG 2.93Å; D625-S627 PolarHBondContact OD2-OG 3.44Å; D625-S627 VanDerWaalsContact OD2-OG 3.13Å; D625-A628 HydrophobicContact CB-CB 4.01Å; D625-A628 VanDerWaalsContact O-CB 3.31Å; D625-A628 WeakPolarHBondContact O-CB 3.42Å; D625-A628 PolarHBondContact O-N 3.25Å
626	P	66.2	Low	76.8	Confident	91 Å²	91	50 Å²	50	59%	0.591	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.4	179.3	24.5	-32.8	0	0	0	112.6	R434 I630	R434-P626 PolarHBondContact NH1-O 3.36Å; R434-P626 VanDerWaalsContact NH1-O 3.15Å; P626-I630 VanDerWaalsContact O-CD1 3.28Å; P626-I630 WeakPolarHBondContact O-CD1 3.44Å
627	S	71.1	Confident	75.3	Confident	40 Å²	40	52.3 Å²	52.3	28%	0.28	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-12.3	177	76.5	0	0	0	0	114.6	D625 G629 I630 F632	D625-S627 VanDerWaalsContact CG-OG 3.23Å; D625-S627 PolarHBondContact O-N 3.49Å; D625-S627 VanDerWaalsContact O-N 3.12Å; D625-S627 WeakPolarHBondContact OD1-CA 3.36Å; D625-S627 VanDerWaalsContact OD1-CB 3.3Å; D625-S627 WeakPolarHBondContact OD1-CB 3.42Å; D625-S627 PolarHBondContact OD1-N 3.24Å; D625-S627 PolarHBondContact OD1-OG 2.93Å; D625-S627 PolarHBondContact OD2-OG 3.44Å; D625-S627 VanDerWaalsContact OD2-OG 3.13Å; S627-G629 PolarHBondContact O-N 3.32Å; S627-I630 VanDerWaalsContact O-CB 3.31Å; S627-I630 WeakPolarHBondContact O-CB 3.47Å; S627-I630 PolarHBondContact O-N 3.47Å; S627-F632 VanDerWaalsContact CB-CZ 3.44Å
628	A	73.5	Confident	73.8	Confident	23 Å²	23	55.2 Å²	55.2	19%	0.19	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	133.9	176.8	0	0	0	0	0	111.1	R434 S620 D625 I630	R434-A628 PolarHBondContact NH2-O 3.02Å; S620-A628 VanDerWaalsContact CB-CB 3.48Å; D625-A628 HydrophobicContact CB-CB 4.01Å; D625-A628 VanDerWaalsContact O-CB 3.31Å; D625-A628 WeakPolarHBondContact O-CB 3.42Å; D625-A628 PolarHBondContact O-N 3.25Å; A628-I630 VanDerWaalsContact C-N 3.25Å; A628-I630 PolarHBondContact O-N 3.32Å
629	G	74.6	Confident	72.3	Confident	4 Å²	4	51.2 Å²	51.2	4%	0.041	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-0.1	-173.7	0	0	0	0	0	114.8	Q441 P617 P618 S627	Q441-G629 PolarHBondContact NE2-O 3.14Å; P617-G629 VanDerWaalsContact CG-C 3.43Å; P617-G629 WeakPolarHBondContact CG-O 3.25Å; P618-G629 VanDerWaalsContact O-CA 3.22Å; P618-G629 WeakPolarHBondContact O-CA 3.36Å; P618-G629 PolarHBondContact O-N 3Å; S627-G629 PolarHBondContact O-N 3.32Å
630	I	81.5	Confident	70.5	Confident	27 Å²	27	51.3 Å²	51.3	14%	0.138	30%	0.301	C	S	.	.			trans	-103.4	130.5	-180	-52.2	-178.2	0	0	0	110.8	W433 W472 C473 P626 S627 A628	W433-I630 HydrophobicContact CH2-CD1 3.8Å; W433-I630 HydrophobicContact CH2-CG1 4.5Å; W433-I630 HydrophobicContact CZ3-CD1 4.39Å; W472-I630 HydrophobicContact CH2-CG2 3.53Å; W472-I630 HydrophobicContact CZ2-CG2 3.83Å; C473-I630 HydrophobicContact CB-CG2 4.11Å; P626-I630 VanDerWaalsContact O-CD1 3.28Å; P626-I630 WeakPolarHBondContact O-CD1 3.44Å; S627-I630 VanDerWaalsContact O-CB 3.31Å; S627-I630 WeakPolarHBondContact O-CB 3.47Å; S627-I630 PolarHBondContact O-N 3.47Å; A628-I630 VanDerWaalsContact C-N 3.25Å; A628-I630 PolarHBondContact O-N 3.32Å
631	L	81.6	Confident	68.8	Low	22 Å²	22	56.1 Å²	56.1	12%	0.115	32%	0.315	C	S	.	.			trans	-90.9	115.1	165.7	-174.7	72.2	0	0	0	109.8	W472 L614	W472-L631 WeakPolarHBondContact CH2-O 3.47Å; W472-L631 WeakPolarHBondContact CZ3-O 3.41Å; L614-L631 HydrophobicContact CD2-CD1 3.25Å; L614-L631 HydrophobicContact CD2-CD2 3.34Å; L614-L631 HydrophobicContact CD2-CG 3.89Å
632	F	79.2	Confident	67.2	Low	99 Å²	99	59.5 Å²	59.5	43%	0.434	33%	0.333	S	S	.	.			trans	-73.6	148.1	177.6	-69.8	-76.5	0	0	0	112.4	W472 S627 A634 S635	W472-F632 HydrophobicContact CH2-CD1 4.48Å; S627-F632 VanDerWaalsContact CB-CZ 3.44Å; F632-A634 PolarHBondContact O-N 3.16Å; F632-A634 VanDerWaalsContact O-N 3.1Å; F632-S635 VanDerWaalsContact O-CB 3.23Å; F632-S635 WeakPolarHBondContact O-CB 3.17Å; F632-S635 PolarHBondContact O-N 3.12Å; F632-S635 PolarHBondContact O-OG 2.86Å
633	P	69.9	Low	65.8	Low	69 Å²	69	58.1 Å²	58.1	45%	0.448	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-54.8	-33.7	177.8	-28	35.9	0	0	0	113.4	W472 S635 R636	W472-P633 HydrophobicContact CE3-CG 4.46Å; W472-P633 HydrophobicContact CH2-CG 4.35Å; W472-P633 HydrophobicContact CZ3-CG 4Å; P633-S635 PolarHBondContact O-N 3.48Å; P633-R636 VanDerWaalsContact O-CB 3.29Å; P633-R636 WeakPolarHBondContact O-CB 3.39Å; P633-R636 WeakPolarHBondContact O-CG 3.47Å; P633-R636 PolarHBondContact O-N 3.15Å; P633-R636 VanDerWaalsContact O-N 3.12Å
634	A	69	Low	65.1	Low	64 Å²	64	58.6 Å²	58.6	53%	0.529	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-62.5	-29	177.1	0	0	0	0	0	113.3	F632 R636 N637	F632-A634 PolarHBondContact O-N 3.16Å; F632-A634 VanDerWaalsContact O-N 3.1Å; A634-R636 PolarHBondContact O-N 2.97Å; A634-R636 VanDerWaalsContact O-N 3.11Å; A634-N637 WeakPolarHBondContact O-CB 3.29Å; A634-N637 PolarHBondContact O-N 3.15Å
635	S	66.3	Low	64	Low	38 Å²	38	58.6 Å²	58.6	27%	0.266	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-62.1	-18.8	176.5	-53.9	0	0	0	0	112.4	F632 P633 I638	F632-S635 VanDerWaalsContact O-CB 3.23Å; F632-S635 WeakPolarHBondContact O-CB 3.17Å; F632-S635 PolarHBondContact O-N 3.12Å; F632-S635 PolarHBondContact O-OG 2.86Å; P633-S635 PolarHBondContact O-N 3.48Å; S635-I638 WeakPolarHBondContact O-CB 3.42Å
636	R	61.2	Low	62.8	Low	60 Å²	60	58.8 Å²	58.8	23%	0.226	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-75.1	-28.4	173.1	-57.9	176	-178.6	-174.3	-2.9	113.4	E476 N603 P633 A634 I638 Y639	E476-R636 IonicContact OE1-CZ 3.19Å; E476-R636 IonicContact OE1-NE 2.95Å; E476-R636 PolarHBondContact OE1-NE 2.96Å; E476-R636 IonicContact OE1-NH2 2.64Å; E476-R636 PolarHBondContact OE1-NH2 2.73Å; E476-R636 IonicContact OE2-CZ 3.13Å; E476-R636 IonicContact OE2-NH2 2.71Å; E476-R636 PolarHBondContact OE2-NH2 3.33Å; N603-R636 PolarHBondContact ND2-NH1 2.9Å; N603-R636 PolarHBondContact ND2-NH2 3.5Å; N603-R636 PolarHBondContact OD1-NH1 3.31Å; P633-R636 VanDerWaalsContact O-CB 3.29Å; P633-R636 WeakPolarHBondContact O-CB 3.39Å; P633-R636 WeakPolarHBondContact O-CG 3.47Å; P633-R636 PolarHBondContact O-N 3.15Å; P633-R636 VanDerWaalsContact O-N 3.12Å; A634-R636 PolarHBondContact O-N 2.97Å; A634-R636 VanDerWaalsContact O-N 3.11Å; R636-I638 PolarHBondContact O-N 3.12Å; R636-Y639 VanDerWaalsContact O-CB 3.25Å; R636-Y639 WeakPolarHBondContact O-CB 3.35Å; R636-Y639 PolarHBondContact O-N 3.31Å
637	N	59.2	Low	61.8	Low	94 Å²	94	58 Å²	58	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-66.3	-27.7	178.4	-69.2	-23.2	0	0	0	111.4	A634 Y639 A640 Y641	A634-N637 WeakPolarHBondContact O-CB 3.29Å; A634-N637 PolarHBondContact O-N 3.15Å; N637-Y639 PolarHBondContact O-N 3.49Å; N637-A640 PolarHBondContact O-N 2.98Å; N637-Y641 PolarHBondContact O-N 3.38Å
638	I	56.4	Low	60.4	Low	98 Å²	98	64 Å²	64	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-59.2	-33.1	171.8	-57	174.4	0	0	0	110.3	S635 R636 Y641 L642	S635-I638 WeakPolarHBondContact O-CB 3.42Å; R636-I638 PolarHBondContact O-N 3.12Å; I638-Y641 PolarHBondContact O-N 3.21Å; I638-L642 HydrophobicContact CG2-CD1 3.76Å; I638-L642 HydrophobicContact CG2-CG 4.08Å; I638-L642 WeakPolarHBondContact O-CB 3.27Å; I638-L642 VanDerWaalsContact O-CG 3.23Å; I638-L642 WeakPolarHBondContact O-CG 3.39Å; I638-L642 PolarHBondContact O-N 3.12Å
639	Y	55.1	Low	58.4	Low	29 Å²	29	69.3 Å²	69.3	11%	0.114	37%	0.369	C	S	.	.	H	α-helix	trans	-69.6	-46.1	177.6	-96.6	-91.9	0	0	0	114.1	P611 G612 L614 R636 N637 Y641 L642 S643 P662 C665	P611-Y639 HydrophobicContact CG-CD1 3.64Å; P611-Y639 HydrophobicContact CG-CE1 3.93Å; G612-Y639 PolarHBondContact O-OH 3.49Å; L614-Y639 VanDerWaalsContact CA-OH 3.24Å; L614-Y639 WeakPolarHBondContact CA-OH 3.49Å; L614-Y639 HydrophobicContact CB-CE2 3.92Å; L614-Y639 VanDerWaalsContact CB-OH 3.28Å; L614-Y639 WeakPolarHBondContact CB-OH 3.35Å; L614-Y639 HydrophobicContact CD1-CE2 3.49Å; L614-Y639 VanDerWaalsContact CD1-CE2 3.49Å; L614-Y639 HydrophobicContact CD2-CE2 4.21Å; L614-Y639 HydrophobicContact CG-CE2 4.05Å; L614-Y639 PolarHBondContact N-OH 3.19Å; L614-Y639 VanDerWaalsContact N-OH 3.17Å; R636-Y639 VanDerWaalsContact O-CB 3.25Å; R636-Y639 WeakPolarHBondContact O-CB 3.35Å; R636-Y639 PolarHBondContact O-N 3.31Å; N637-Y639 PolarHBondContact O-N 3.49Å; Y639-Y641 PolarHBondContact O-N 2.97Å; Y639-L642 PolarHBondContact O-N 3.03Å; Y639-S643 WeakPolarHBondContact O-CB 3.44Å; Y639-S643 PolarHBondContact O-N 2.94Å; Y639-P662 HydrophobicContact CE1-CG 4.32Å; Y639-C665 PolarHBondContact OH-SG 2.92Å
640	A	53.3	Low	56.4	Low	25 Å²	25	74.4 Å²	74.4	21%	0.207	40%	0.401	C	S	.	.	H	α-helix	trans	-57.1	-40.2	175.3	0	0	0	0	0	109.9	N637 S644	N637-A640 PolarHBondContact O-N 2.98Å; A640-S644 PolarHBondContact O-N 2.64Å
641	Y	53.3	Low	54.2	Low	129 Å²	129	78.9 Å²	78.9	51%	0.506	43%	0.43	S	S	.	.	H	α-helix	trans	-67.1	-46.7	174.7	-176.7	-99.2	0	0	0	113.5	N637 I638 Y639 S644 K645	N637-Y641 PolarHBondContact O-N 3.38Å; I638-Y641 PolarHBondContact O-N 3.21Å; Y639-Y641 PolarHBondContact O-N 2.97Å; Y641-S644 PolarHBondContact O-N 2.89Å; Y641-S644 PolarHBondContact O-OG 3.13Å; Y641-K645 HydrophobicContact CE1-CD 4.16Å; Y641-K645 PolarHBondContact O-N 3.31Å; Y641-K645 WeakPolarHBondContact OH-CE 3.47Å; Y641-K645 PolarHBondContact OH-NZ 3.44Å
642	L	52	Low	51.9	Low	72 Å²	72	84.7 Å²	84.7	38%	0.377	46%	0.461	S	S	.	.	H	α-helix	trans	-67.2	-41.2	-178.6	-73.5	173.9	0	0	0	112.6	I638 Y639 S644 K645 T646	I638-L642 HydrophobicContact CG2-CD1 3.76Å; I638-L642 HydrophobicContact CG2-CG 4.08Å; I638-L642 WeakPolarHBondContact O-CB 3.27Å; I638-L642 VanDerWaalsContact O-CG 3.23Å; I638-L642 WeakPolarHBondContact O-CG 3.39Å; I638-L642 PolarHBondContact O-N 3.12Å; Y639-L642 PolarHBondContact O-N 3.03Å; L642-S644 PolarHBondContact O-N 3.15Å; L642-K645 PolarHBondContact O-N 2.79Å; L642-K645 VanDerWaalsContact O-N 3.14Å; L642-T646 PolarHBondContact O-N 3.09Å
643	S	51	Low	49.6	Very low	23 Å²	23	85.7 Å²	85.7	16%	0.161	48%	0.48	C	S	.	.	H	α-helix	trans	-61.5	-33.6	174.7	-168.6	0	0	0	0	111.7	Y639 K645 T646	Y639-S643 WeakPolarHBondContact O-CB 3.44Å; Y639-S643 PolarHBondContact O-N 2.94Å; S643-K645 VanDerWaalsContact C-N 3.31Å; S643-K645 PolarHBondContact O-N 2.97Å; S643-T646 PolarHBondContact O-OG1 3.31Å; S643-T646 VanDerWaalsContact O-OG1 3.08Å
644	S	52.7	Low	48	Very low	31 Å²	31	88.7 Å²	88.7	22%	0.217	49%	0.493	C	S	.	.	H	α-helix	trans	-69.7	-25.7	177.2	80.6	0	0	0	0	113.7	A640 Y641 L642	A640-S644 PolarHBondContact O-N 2.64Å; Y641-S644 PolarHBondContact O-N 2.89Å; Y641-S644 PolarHBondContact O-OG 3.13Å; L642-S644 PolarHBondContact O-N 3.15Å
645	K	47	Very low	46.2	Very low	115 Å²	115	94.2 Å²	94.2	50%	0.5	51%	0.513	S	S	.	.	H	α-helix	trans	-82.2	-37.5	178.4	-86	-171.4	175.8	176.1	0	112.9	Y641 L642 S643 S647 K648	Y641-K645 HydrophobicContact CE1-CD 4.16Å; Y641-K645 PolarHBondContact O-N 3.31Å; Y641-K645 WeakPolarHBondContact OH-CE 3.47Å; Y641-K645 PolarHBondContact OH-NZ 3.44Å; L642-K645 PolarHBondContact O-N 2.79Å; L642-K645 VanDerWaalsContact O-N 3.14Å; S643-K645 VanDerWaalsContact C-N 3.31Å; S643-K645 PolarHBondContact O-N 2.97Å; K645-S647 PolarHBondContact O-N 3.39Å; K645-K648 PolarHBondContact O-N 3.17Å
646	T	45.8	Very low	44.9	Very low	81 Å²	81	96 Å²	96	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-64.5	-30.9	179.2	48.3	0	0	0	0	111.8	L642 S643 K648	L642-T646 PolarHBondContact O-N 3.09Å; S643-T646 PolarHBondContact O-OG1 3.31Å; S643-T646 VanDerWaalsContact O-OG1 3.08Å; T646-K648 VanDerWaalsContact C-N 3.25Å; T646-K648 PolarHBondContact O-N 3.48Å
647	S	44.6	Very low	43.9	Very low	74 Å²	74	101.4 Å²	101.4	52%	0.517	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.7	-11.5	173.6	-167	0	0	0	0	114.6	K645	K645-S647 PolarHBondContact O-N 3.39Å
648	K	40.5	Very low	43.2	Very low	167 Å²	167	101.7 Å²	101.7	73%	0.726	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-2.5	-174	-79.1	-171.5	179.3	-176.3	0	115.8	K645 T646 P650	K645-K648 PolarHBondContact O-N 3.17Å; T646-K648 VanDerWaalsContact C-N 3.25Å; T646-K648 PolarHBondContact O-N 3.48Å; K648-P650 WeakPolarHBondContact O-CD 3.23Å
649	N	31.5	Very low	43.1	Very low	134 Å²	134	102.2 Å²	102.2	72%	0.717	57%	0.572	S	S	*	*			trans	-107.9	93.7	174.9	-84.9	-4.6	0	0	0	110.5	T651	N649-T651 VanDerWaalsContact C-N 3.32Å
650	P	32.9	Very low	43.8	Very low	112 Å²	112	105.4 Å²	105.4	73%	0.727	60%	0.595	S	S	*	*			trans	-89.7	8.5	-179.7	5.9	15.6	0	0	0	112.9	K648 N652	K648-P650 WeakPolarHBondContact O-CD 3.23Å; P650-N652 PolarHBondContact O-N 2.97Å; P650-N652 VanDerWaalsContact O-N 3.15Å
651	T	36.4	Very low	45.1	Very low	121 Å²	121	107 Å²	107	74%	0.742	60%	0.602	S	S	*	*			trans	-77.9	3.8	-169.2	56	0	0	0	0	115.2	N649	N649-T651 VanDerWaalsContact C-N 3.32Å
652	N	33	Very low	46.4	Very low	143 Å²	143	101.8 Å²	101.8	77%	0.765	58%	0.583	S	S	*	*			trans	-110.7	104	169.7	-84.9	-6.7	0	0	0	109.9	P650 D654	P650-N652 PolarHBondContact O-N 2.97Å; P650-N652 VanDerWaalsContact O-N 3.15Å; N652-D654 PolarHBondContact O-N 3.2Å
653	S	31.3	Very low	47.9	Very low	120 Å²	120	108.1 Å²	108.1	84%	0.839	61%	0.608	S	S	*	*			trans	-73.1	33.5	178.6	55.4	0	0	0	0	114.2
654	D	34.7	Very low	49.4	Very low	133 Å²	133	109 Å²	109	71%	0.711	62%	0.62	S	S	*	*			trans	-93	114.1	174.5	-83	-23.2	0	0	0	110.2	N652 S656	N652-D654 PolarHBondContact O-N 3.2Å; D654-S656 PolarHBondContact O-N 2.83Å
655	N	31.9	Very low	51.1	Low	180 Å²	180	108.5 Å²	108.5	96%	0.963	62%	0.617	S	S	*	*			trans	-74.6	39.9	-165.5	-133.4	0.5	0	0	0	113.9
656	S	39.1	Very low	53.2	Low	75 Å²	75	106.9 Å²	106.9	52%	0.524	61%	0.611	S	S	.	*			trans	-123.3	117.7	173.5	62.9	0	0	0	0	108.1	D654 V658	D654-S656 PolarHBondContact O-N 2.83Å; S656-V658 PolarHBondContact O-N 3.17Å; S656-V658 WeakPolarHBondContact OG-CG2 3.47Å
657	N	39.4	Very low	55.3	Low	173 Å²	173	105.8 Å²	105.8	93%	0.925	61%	0.61	S	S	*	*			trans	-64.4	52	167.9	-82.9	-19.2	0	0	0	110.9	T659	N657-T659 VanDerWaalsContact C-N 3.25Å; N657-T659 PolarHBondContact O-N 2.94Å
658	V	45.2	Very low	57.4	Low	101 Å²	101	104.3 Å²	104.3	61%	0.612	60%	0.599	S	S	*	*			trans	-76.5	91.3	169	-177.9	0	0	0	0	104.6	S656 T660	S656-V658 PolarHBondContact O-N 3.17Å; S656-V658 WeakPolarHBondContact OG-CG2 3.47Å; V658-T660 VanDerWaalsContact C-N 3.29Å; V658-T660 PolarHBondContact O-N 3.24Å
659	T	54.7	Low	59.9	Low	109 Å²	109	96.8 Å²	96.8	67%	0.669	57%	0.567	S	S	*	*			trans	-51.6	103	159.8	27.2	0	0	0	0	106.6	N657 V661	N657-T659 VanDerWaalsContact C-N 3.25Å; N657-T659 PolarHBondContact O-N 2.94Å; T659-V661 PolarHBondContact O-N 3.29Å; T659-V661 VanDerWaalsContact O-N 3.12Å
660	T	69.8	Low	62.7	Low	95 Å²	95	99.1 Å²	99.1	58%	0.583	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-65.7	116.8	178.3	43.5	0	0	0	0	107.2	V658	V658-T660 VanDerWaalsContact C-N 3.29Å; V658-T660 PolarHBondContact O-N 3.24Å
661	V	81.3	Confident	65.3	Low	59 Å²	59	94.7 Å²	94.7	36%	0.358	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-56.9	126.3	177	177.2	0	0	0	0	107.6	T659 C665 A667	T659-V661 PolarHBondContact O-N 3.29Å; T659-V661 VanDerWaalsContact O-N 3.12Å; V661-C665 HydrophobicContact CG1-CB 3.76Å; V661-C665 VanDerWaalsContact CG1-O 3.32Å; V661-C665 WeakPolarHBondContact CG1-O 3.27Å; V661-A667 HydrophobicContact CG2-CB 4.4Å
662	P	80.7	Confident	67.6	Low	19 Å²	19	92.5 Å²	92.5	12%	0.123	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-60	157.5	-177.9	-22	31.7	0	0	0	112.3	P611 Y639 C665	P611-P662 HydrophobicContact CB-CG 3.98Å; P611-P662 HydrophobicContact CG-CG 4.23Å; P611-P662 WeakPolarHBondContact O-CD 3.43Å; Y639-P662 HydrophobicContact CE1-CG 4.32Å; P662-C665 VanDerWaalsContact O-CB 3.32Å; P662-C665 WeakPolarHBondContact O-CB 3.46Å; P662-C665 PolarHBondContact O-N 3.13Å; P662-C665 PolarHBondContact O-SG 3.46Å; P662-C665 VanDerWaalsContact O-SG 3.38Å
663	K	82.3	Confident	70.1	Confident	206 Å²	206	90.2 Å²	90.2	90%	0.896	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	138	176	-67.2	-174.2	178.7	-176.4	0	110.6
664	G	83.1	Confident	72.9	Confident	40 Å²	40	90.1 Å²	90.1	41%	0.412	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	20.3	-176.2	0	0	0	0	0	113.6	L614 D615	L614-G664 WeakPolarHBondContact CD1-O 3.33Å; D615-G664 PolarHBondContact N-O 2.97Å; D615-G664 WeakPolarHBondContact OD2-CA 3.45Å
665	C	88	Confident	75.6	Confident	21 Å²	21	86.7 Å²	86.7	14%	0.142	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.6	-178.7	-40.4	0	0	0	0	110.9	I613 Y639 V661 P662	I613-C665 CarbonylContact O-C 3.53Å; I613-C665 VanDerWaalsContact O-CA 3.26Å; I613-C665 WeakPolarHBondContact O-CA 3.46Å; Y639-C665 PolarHBondContact OH-SG 2.92Å; V661-C665 HydrophobicContact CG1-CB 3.76Å; V661-C665 VanDerWaalsContact CG1-O 3.32Å; V661-C665 WeakPolarHBondContact CG1-O 3.27Å; P662-C665 VanDerWaalsContact O-CB 3.32Å; P662-C665 WeakPolarHBondContact O-CB 3.46Å; P662-C665 PolarHBondContact O-N 3.13Å; P662-C665 PolarHBondContact O-SG 3.46Å; P662-C665 VanDerWaalsContact O-SG 3.38Å
666	Q	90.3	Very high	78.5	Confident	81 Å²	81	78.5 Å²	78.5	38%	0.379	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	159.1	168.8	-65.3	163.8	31.9	0	0	110.2	G612 I613 D615	G612-Q666 CarbonylContact C-O 3.59Å; G612-Q666 VanDerWaalsContact CA-O 3.29Å; G612-Q666 WeakPolarHBondContact CA-O 3.29Å; I613-Q666 HydrophobicContact CB-CB 4.33Å; I613-Q666 PolarHBondContact N-O 3.37Å; I613-Q666 PolarHBondContact O-N 3.13Å; D615-Q666 WeakPolarHBondContact OD1-CG 3.46Å; D615-Q666 PolarHBondContact OD1-NE2 3.31Å
667	A	90.2	Very high	81	Confident	58 Å²	58	79 Å²	79	48%	0.479	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-59.1	137.6	177.6	0	0	0	0	0	111.3	I613 V661	I613-A667 WeakPolarHBondContact CD1-O 3.44Å; V661-A667 HydrophobicContact CG2-CB 4.4Å
668	P	90.2	Very high	83.5	Confident	43 Å²	43	72.8 Å²	72.8	28%	0.279	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-70.8	158	177	30.1	-33.5	0	0	0	111.5
669	P	92.8	Very high	85.9	Confident	9 Å²	9	68.1 Å²	68.1	6%	0.058	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-60.7	139.3	175.4	-22.1	34.3	0	0	0	113.1	A483 L486 V487 V608 I613 I671	A483-P669 HydrophobicContact CB-CG 4.21Å; A483-P669 VanDerWaalsContact O-CG 3.24Å; A483-P669 WeakPolarHBondContact O-CG 3.36Å; L486-P669 HydrophobicContact CB-CB 3.91Å; L486-P669 HydrophobicContact CB-CG 4Å; V487-P669 HydrophobicContact CG2-CB 4.23Å; V487-P669 HydrophobicContact CG2-CG 3.85Å; V608-P669 HydrophobicContact CG1-CG 4.47Å; V608-P669 WeakPolarHBondContact O-CD 3.28Å; I613-P669 HydrophobicContact CD1-CG 4.48Å; P669-I671 HydrophobicContact CB-CD1 3.88Å; P669-I671 HydrophobicContact CB-CG1 3.7Å; P669-I671 PolarHBondContact O-N 3.4Å
670	Q	88.9	Confident	87.9	Confident	183 Å²	183	63.2 Å²	63.2	86%	0.855	37%	0.365	S	S	*	.			trans	-89	90.3	172	-66.2	-171.8	-6	0	0	110.4
671	I	87.4	Confident	89.1	Confident	20 Å²	20	61.5 Å²	61.5	10%	0.103	36%	0.361	C	S	.	.			trans	-106.5	141.8	-174	-55.3	-165.6	0	0	0	111.1	L486 C493 F497 V608 W609 P669 N673 Y675	L486-I671 HydrophobicContact CB-CD1 4.27Å; L486-I671 HydrophobicContact CD1-CD1 3.66Å; L486-I671 HydrophobicContact CG-CD1 4.5Å; C493-I671 HydrophobicContact CB-CG2 4.43Å; F497-I671 HydrophobicContact CE2-CD1 4.02Å; F497-I671 HydrophobicContact CE2-CG2 4.21Å; F497-I671 HydrophobicContact CZ-CD1 4.31Å; V608-I671 HydrophobicContact CG1-CD1 3.31Å; V608-I671 HydrophobicContact CG1-CG1 4.16Å; W609-I671 HydrophobicContact CZ2-CB 4.22Å; W609-I671 HydrophobicContact CZ2-CG2 3.95Å; P669-I671 HydrophobicContact CB-CD1 3.88Å; P669-I671 HydrophobicContact CB-CG1 3.7Å; P669-I671 PolarHBondContact O-N 3.4Å; I671-N673 PolarHBondContact O-N 3.49Å; I671-Y675 HydrophobicContact CG2-CD2 3.62Å; I671-Y675 HydrophobicContact CG2-CE2 4.45Å; I671-Y675 HydrophobicContact CG2-CG 4.25Å
672	P	86	Confident	89.9	Confident	75 Å²	75	60.1 Å²	60.1	49%	0.487	35%	0.35	S	S	.	.			trans	-53.8	135.7	174.1	-27.6	35.3	0	0	0	113.5	V674 Y675	P672-V674 PolarHBondContact O-N 3.45Å; P672-Y675 HydrophobicContact CB-CD2 4.16Å; P672-Y675 HydrophobicContact CB-CE2 4.22Å; P672-Y675 HydrophobicContact CG-CD2 4.48Å; P672-Y675 HydrophobicContact CG-CE2 4.25Å; P672-Y675 WeakPolarHBondContact O-CD2 3.4Å; P672-Y675 PolarHBondContact O-N 3.22Å; P672-Y675 VanDerWaalsContact O-N 3.13Å
673	N	85.7	Confident	90.7	Very high	95 Å²	95	59.2 Å²	59.2	51%	0.508	34%	0.344	S	S	.	.	H	α-helix	trans	-59.2	-22.7	-174.4	-159.8	14.1	0	0	0	114	I671 Y675 L676 T677	I671-N673 PolarHBondContact O-N 3.49Å; N673-Y675 PolarHBondContact O-N 3.39Å; N673-L676 WeakPolarHBondContact O-CB 3.26Å; N673-L676 PolarHBondContact O-N 3.07Å; N673-L676 WeakPolarHBondContact OD1-CD2 3.33Å; N673-T677 PolarHBondContact O-N 3.33Å; N673-T677 PolarHBondContact O-OG1 2.92Å
674	V	89	Confident	91.4	Very high	117 Å²	117	50.3 Å²	50.3	71%	0.709	31%	0.306	S	S	*	.	H	α-helix	trans	-55.3	-37.3	176.4	-180	0	0	0	0	112.1	P672 G678	P672-V674 PolarHBondContact O-N 3.45Å; V674-G678 PolarHBondContact O-N 3.28Å
675	Y	91.4	Very high	92.1	Very high	62 Å²	62	52.4 Å²	52.4	24%	0.243	30%	0.302	C	S	.	.	H	α-helix	trans	-74.6	-34.5	178	-59.9	-73	0	0	0	112.1	C493 K494 F497 I671 P672 N673 G678 C679	C493-Y675 HydrophobicContact CB-CE2 4.3Å; K494-Y675 VanDerWaalsContact CA-OH 3.26Å; K494-Y675 WeakPolarHBondContact CA-OH 3.34Å; K494-Y675 WeakPolarHBondContact CB-OH 3.48Å; F497-Y675 HydrophobicContact CB-CD1 3.7Å; F497-Y675 HydrophobicContact CB-CE1 3.95Å; F497-Y675 AromaticContact CD2-CD1 3.64Å; F497-Y675 HydrophobicContact CD2-CD1 3.64Å; F497-Y675 HydrophobicContact CD2-CD2 4.41Å; F497-Y675 HydrophobicContact CD2-CE1 4.14Å; F497-Y675 AromaticContact CD2-CG 3.8Å; F497-Y675 HydrophobicContact CD2-CG 3.8Å; F497-Y675 HydrophobicContact CE2-CD1 4.48Å; F497-Y675 HydrophobicContact CE2-CG 4.21Å; F497-Y675 AromaticContact CG-CD1 3.69Å; F497-Y675 HydrophobicContact CG-CD1 3.69Å; F497-Y675 HydrophobicContact CG-CE1 4.3Å; F497-Y675 HydrophobicContact CG-CG 4.19Å; I671-Y675 HydrophobicContact CG2-CD2 3.62Å; I671-Y675 HydrophobicContact CG2-CE2 4.45Å; I671-Y675 HydrophobicContact CG2-CG 4.25Å; P672-Y675 HydrophobicContact CB-CD2 4.16Å; P672-Y675 HydrophobicContact CB-CE2 4.22Å; P672-Y675 HydrophobicContact CG-CD2 4.48Å; P672-Y675 HydrophobicContact CG-CE2 4.25Å; P672-Y675 WeakPolarHBondContact O-CD2 3.4Å; P672-Y675 PolarHBondContact O-N 3.22Å; P672-Y675 VanDerWaalsContact O-N 3.13Å; N673-Y675 PolarHBondContact O-N 3.39Å; Y675-G678 PolarHBondContact O-N 3.45Å; Y675-C679 PolarHBondContact O-N 3.36Å; Y675-C679 PolarHBondContact O-SG 3.33Å
676	L	93	Very high	92.6	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-47.5	176.6	178.1	55.8	0	0	0	110.6	W609 N673 G678 C679 V680 I706 S709 L710	W609-L676 HydrophobicContact CB-CD1 4.27Å; W609-L676 HydrophobicContact CD2-CB 4.46Å; W609-L676 HydrophobicContact CD2-CD1 3.79Å; W609-L676 HydrophobicContact CE3-CD1 4.32Å; W609-L676 HydrophobicContact CG-CD1 3.77Å; W609-L676 HydrophobicContact CZ2-CB 3.92Å; N673-L676 WeakPolarHBondContact O-CB 3.26Å; N673-L676 PolarHBondContact O-N 3.07Å; N673-L676 WeakPolarHBondContact OD1-CD2 3.33Å; L676-G678 VanDerWaalsContact C-N 3.29Å; L676-G678 PolarHBondContact O-N 3.49Å; L676-C679 PolarHBondContact O-N 3.41Å; L676-V680 HydrophobicContact CD1-CG2 3.9Å; L676-V680 HydrophobicContact CG-CG2 4.26Å; L676-V680 WeakPolarHBondContact O-CG2 3.48Å; L676-V680 PolarHBondContact O-N 3.18Å; L676-I706 HydrophobicContact CD1-CD1 4.25Å; L676-S709 VanDerWaalsContact CD2-O 3.26Å; L676-S709 WeakPolarHBondContact CD2-O 3.32Å; L676-L710 HydrophobicContact CD1-CD2 3.99Å; L676-L710 HydrophobicContact CD2-CD2 4.11Å; L676-L710 HydrophobicContact CG-CD2 4.14Å
677	T	92.4	Very high	92.9	Very high	87 Å²	87	47.6 Å²	47.6	53%	0.534	28%	0.278	S	S	.	.	H	α-helix	trans	-55	-45	177	-50.5	0	0	0	0	111.8	N673 C679 V680 A681	N673-T677 PolarHBondContact O-N 3.33Å; N673-T677 PolarHBondContact O-OG1 2.92Å; T677-C679 PolarHBondContact O-N 3.5Å; T677-V680 PolarHBondContact O-N 3.45Å; T677-A681 PolarHBondContact O-N 3.07Å
678	G	92.1	Very high	93.1	Very high	42 Å²	42	47.3 Å²	47.3	43%	0.433	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-38.5	176.2	0	0	0	0	0	113.4	V674 Y675 L676 Q682	V674-G678 PolarHBondContact O-N 3.28Å; Y675-G678 PolarHBondContact O-N 3.45Å; L676-G678 VanDerWaalsContact C-N 3.29Å; L676-G678 PolarHBondContact O-N 3.49Å; G678-Q682 WeakPolarHBondContact O-CB 3.4Å; G678-Q682 PolarHBondContact O-N 3.05Å; G678-Q682 VanDerWaalsContact O-N 3.15Å
679	C	94.8	Very high	93.4	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.014	29%	0.287	C	S	.	.	H	α-helix	trans	-69.4	-40.3	177	-65.1	0	0	0	0	112.2	Y601 V605 W609 Y675 L676 T677 Q682 L683	Y601-C679 WeakPolarHBondContact OH-CA 3.33Å; Y601-C679 PolarHBondContact OH-SG 2.99Å; Y601-C679 VanDerWaalsContact OH-SG 3.37Å; V605-C679 HydrophobicContact CG1-CB 4.18Å; V605-C679 HydrophobicContact CG2-CB 3.89Å; W609-C679 HydrophobicContact CZ3-CB 4.15Å; W609-C679 VanDerWaalsContact CZ3-SG 3.58Å; Y675-C679 PolarHBondContact O-N 3.36Å; Y675-C679 PolarHBondContact O-SG 3.33Å; L676-C679 PolarHBondContact O-N 3.41Å; T677-C679 PolarHBondContact O-N 3.5Å; C679-Q682 CarbonylContact O-C 3.46Å; C679-Q682 PolarHBondContact O-N 3.05Å; C679-L683 WeakPolarHBondContact O-CG 3.47Å; C679-L683 PolarHBondContact O-N 3.02Å
680	V	96	Very high	93.6	Very high	6 Å²	6	51.5 Å²	51.5	4%	0.036	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-47.4	176.4	173.7	0	0	0	0	110.7	L676 T677 Q682 L683 L684 L703 I706 L710 T714	L676-V680 HydrophobicContact CD1-CG2 3.9Å; L676-V680 HydrophobicContact CG-CG2 4.26Å; L676-V680 WeakPolarHBondContact O-CG2 3.48Å; L676-V680 PolarHBondContact O-N 3.18Å; T677-V680 PolarHBondContact O-N 3.45Å; V680-Q682 PolarHBondContact O-N 2.99Å; V680-L683 PolarHBondContact O-N 3.24Å; V680-L683 VanDerWaalsContact O-N 3.14Å; V680-L684 HydrophobicContact CG1-CD1 3.98Å; V680-L684 HydrophobicContact CG1-CG 4.36Å; V680-L684 WeakPolarHBondContact O-CG 3.47Å; V680-L684 PolarHBondContact O-N 3.44Å; V680-L703 HydrophobicContact CG1-CD2 4.34Å; V680-I706 HydrophobicContact CG2-CD1 4.36Å; V680-L710 HydrophobicContact CG2-CD2 3.39Å; V680-T714 HydrophobicContact CG1-CG2 3.93Å
681	A	95.8	Very high	93.9	Very high	59 Å²	59	48.7 Å²	48.7	49%	0.488	28%	0.282	S	S	.	.	H	α-helix	trans	-56.1	-40.4	175.1	0	0	0	0	0	111.5	T677 R685	T677-A681 PolarHBondContact O-N 3.07Å; A681-R685 PolarHBondContact O-N 2.86Å
682	Q	96.9	Very high	94.3	Very high	30 Å²	30	49.3 Å²	49.3	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-71.6	-36.7	178.2	-172.8	46.5	61.8	0	0	113.1	A590 Y601 G678 C679 V680 R685 F686	A590-Q682 HydrophobicContact CB-CG 3.85Å; Y601-Q682 HydrophobicContact CE1-CB 4.16Å; Y601-Q682 HydrophobicContact CE1-CG 3.71Å; G678-Q682 WeakPolarHBondContact O-CB 3.4Å; G678-Q682 PolarHBondContact O-N 3.05Å; G678-Q682 VanDerWaalsContact O-N 3.15Å; C679-Q682 CarbonylContact O-C 3.46Å; C679-Q682 PolarHBondContact O-N 3.05Å; V680-Q682 PolarHBondContact O-N 2.99Å; Q682-R685 VanDerWaalsContact NE2-CZ 3.28Å; Q682-R685 PolarHBondContact O-N 3.28Å; Q682-R685 VanDerWaalsContact OE1-NH2 3.15Å; Q682-F686 HydrophobicContact CG-CE2 4.06Å; Q682-F686 HydrophobicContact CG-CZ 4.2Å; Q682-F686 WeakPolarHBondContact O-CD2 3.33Å; Q682-F686 WeakPolarHBondContact O-CG 3.28Å; Q682-F686 PolarHBondContact O-N 3.45Å
683	L	97.7	Very high	94.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-42.8	172.5	-71.4	-179.8	0	0	0	111.7	I602 V605 C679 V680 R685 F686 L687 A699 A702 L703 I706	I602-L683 HydrophobicContact CB-CD2 4.35Å; I602-L683 HydrophobicContact CG1-CD2 3.83Å; I602-L683 HydrophobicContact CG2-CD2 4.12Å; V605-L683 HydrophobicContact CG1-CD1 3.93Å; C679-L683 WeakPolarHBondContact O-CG 3.47Å; C679-L683 PolarHBondContact O-N 3.02Å; V680-L683 PolarHBondContact O-N 3.24Å; V680-L683 VanDerWaalsContact O-N 3.14Å; L683-R685 VanDerWaalsContact C-N 3.3Å; L683-R685 PolarHBondContact O-N 3.21Å; L683-F686 PolarHBondContact O-N 3.4Å; L683-L687 WeakPolarHBondContact O-CB 3.4Å; L683-L687 PolarHBondContact O-N 3.14Å; L683-A699 HydrophobicContact CD2-CB 4.45Å; L683-A702 HydrophobicContact CD1-CB 4.11Å; L683-A702 HydrophobicContact CD2-CB 4.2Å; L683-L703 HydrophobicContact CB-CD2 4.04Å; L683-L703 HydrophobicContact CB-CG 4.16Å; L683-L703 HydrophobicContact CD1-CD2 3.99Å; L683-L703 HydrophobicContact CD1-CG 4.18Å; L683-I706 HydrophobicContact CD1-CD1 3.78Å
684	L	98.1	Very high	95.2	Very high	19 Å²	19	47 Å²	47	10%	0.099	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-37	176.4	-66.6	171.2	0	0	0	111.7	V680 L687 S688 L703 D718 V719 V722	V680-L684 HydrophobicContact CG1-CD1 3.98Å; V680-L684 HydrophobicContact CG1-CG 4.36Å; V680-L684 WeakPolarHBondContact O-CG 3.47Å; V680-L684 PolarHBondContact O-N 3.44Å; L684-L687 PolarHBondContact O-N 2.83Å; L684-S688 WeakPolarHBondContact O-CB 3.42Å; L684-S688 PolarHBondContact O-N 2.95Å; L684-S688 PolarHBondContact O-OG 3.39Å; L684-L703 HydrophobicContact CD2-CD1 3.79Å; L684-L703 HydrophobicContact CD2-CD2 4.4Å; L684-D718 HydrophobicContact CD1-CB 3.74Å; L684-V719 HydrophobicContact CD2-CG2 4.35Å; L684-V722 HydrophobicContact CD2-CB 3.97Å; L684-V722 HydrophobicContact CD2-CG1 4.09Å; L684-V722 HydrophobicContact CD2-CG2 4.1Å
685	R	97.4	Very high	95.5	Very high	85 Å²	85	41.5 Å²	41.5	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-63.3	-45.2	172	-165.8	179	68.8	78.9	-4.6	111.6	A590 A681 Q682 L683 L687 S688 E689	A590-R685 PolarHBondContact O-NH2 3.23Å; A681-R685 PolarHBondContact O-N 2.86Å; Q682-R685 VanDerWaalsContact NE2-CZ 3.28Å; Q682-R685 PolarHBondContact O-N 3.28Å; Q682-R685 VanDerWaalsContact OE1-NH2 3.15Å; L683-R685 VanDerWaalsContact C-N 3.3Å; L683-R685 PolarHBondContact O-N 3.21Å; R685-L687 PolarHBondContact O-N 3.2Å; R685-S688 PolarHBondContact O-N 2.97Å; R685-E689 HydrophobicContact CG-CB 4.49Å; R685-E689 HydrophobicContact CG-CG 4.45Å; R685-E689 WeakPolarHBondContact CG-OE2 3.23Å; R685-E689 WeakPolarHBondContact O-CB 3.4Å; R685-E689 PolarHBondContact O-N 2.94Å
686	F	97.9	Very high	95.8	Very high	1 Å²	1	39.7 Å²	39.7	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-47.5	175.2	-72.3	-34.6	0	0	0	112.3	A590 R598 Y601 I602 Q682 L683 S688 D690 V695 R696 A699	A590-F686 HydrophobicContact CB-CZ 4.03Å; A590-F686 VanDerWaalsContact O-CE1 3.29Å; A590-F686 WeakPolarHBondContact O-CE1 3.28Å; A590-F686 VanDerWaalsContact O-CZ 3.23Å; A590-F686 WeakPolarHBondContact O-CZ 3.46Å; R598-F686 HydrophobicContact CB-CE1 4.29Å; R598-F686 HydrophobicContact CB-CZ 4.04Å; R598-F686 HydrophobicContact CG-CE1 4.4Å; R598-F686 HydrophobicContact CG-CZ 4.37Å; Y601-F686 AromaticContact CD1-CE2 3.74Å; Y601-F686 HydrophobicContact CD1-CE2 3.74Å; Y601-F686 HydrophobicContact CE1-CE2 4.21Å; I602-F686 HydrophobicContact CD1-CD2 3.95Å; I602-F686 HydrophobicContact CD1-CE2 4.43Å; I602-F686 HydrophobicContact CG1-CD2 3.91Å; I602-F686 HydrophobicContact CG1-CE2 4.09Å; Q682-F686 HydrophobicContact CG-CE2 4.06Å; Q682-F686 HydrophobicContact CG-CZ 4.2Å; Q682-F686 WeakPolarHBondContact O-CD2 3.33Å; Q682-F686 WeakPolarHBondContact O-CG 3.28Å; Q682-F686 PolarHBondContact O-N 3.45Å; L683-F686 PolarHBondContact O-N 3.4Å; F686-S688 VanDerWaalsContact C-N 3.26Å; F686-S688 PolarHBondContact O-N 3.02Å; F686-D690 HydrophobicContact CB-CB 4.45Å; F686-D690 HydrophobicContact CD1-CB 4.36Å; F686-D690 WeakPolarHBondContact CD1-OD2 3.41Å; F686-D690 WeakPolarHBondContact O-CB 3.29Å; F686-D690 PolarHBondContact O-N 2.91Å; F686-V695 HydrophobicContact CB-CG1 4.15Å; F686-V695 HydrophobicContact CD1-CG1 4.27Å; F686-V695 HydrophobicContact CG-CG1 4.09Å; F686-R696 WeakPolarHBondContact O-CG 3.48Å; F686-A699 HydrophobicContact CB-CB 3.86Å
687	L	97.2	Very high	95.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.8	-36.6	177.8	175.6	52.4	0	0	0	112.6	L683 L684 R685 R696 A699 T700 L703 V722 L723 V726	L683-L687 WeakPolarHBondContact O-CB 3.4Å; L683-L687 PolarHBondContact O-N 3.14Å; L684-L687 PolarHBondContact O-N 2.83Å; R685-L687 PolarHBondContact O-N 3.2Å; L687-R696 HydrophobicContact CD1-CB 4.49Å; L687-R696 WeakPolarHBondContact O-CD 3.42Å; L687-A699 HydrophobicContact CB-CB 4.16Å; L687-T700 WeakPolarHBondContact CD1-OG1 3.26Å; L687-L703 HydrophobicContact CD2-CD1 3.89Å; L687-V722 HydrophobicContact CD2-CG1 3.79Å; L687-V722 HydrophobicContact CG-CG1 3.97Å; L687-L723 HydrophobicContact CD2-CD2 3.84Å; L687-L723 HydrophobicContact CD2-CG 4.45Å; L687-V726 HydrophobicContact CD1-CB 4.37Å; L687-V726 HydrophobicContact CD1-CG1 4.01Å; L687-V726 HydrophobicContact CD1-CG2 3.83Å; L687-V726 HydrophobicContact CG-CG2 3.88Å
688	S	94.9	Very high	95.9	Very high	52 Å²	52	36.9 Å²	36.9	36%	0.364	22%	0.215	S	C	.	.	H	α-helix	trans	-90.1	-31.7	-175.6	-55.6	0	0	0	0	114.5	L684 R685 F686 V722	L684-S688 WeakPolarHBondContact O-CB 3.42Å; L684-S688 PolarHBondContact O-N 2.95Å; L684-S688 PolarHBondContact O-OG 3.39Å; R685-S688 PolarHBondContact O-N 2.97Å; F686-S688 VanDerWaalsContact C-N 3.26Å; F686-S688 PolarHBondContact O-N 3.02Å; S688-V722 VanDerWaalsContact OG-CG1 3.25Å; S688-V722 WeakPolarHBondContact OG-CG1 3.44Å
689	E	95.3	Very high	96.1	Very high	127 Å²	127	34.9 Å²	34.9	59%	0.593	19%	0.194	S	C	*	.	H	α-helix	trans	-128.6	-13.5	-162.6	-60.2	172.2	-168.6	0	0	114.1	R685 V691	R685-E689 HydrophobicContact CG-CB 4.49Å; R685-E689 HydrophobicContact CG-CG 4.45Å; R685-E689 WeakPolarHBondContact CG-OE2 3.23Å; R685-E689 WeakPolarHBondContact O-CB 3.4Å; R685-E689 PolarHBondContact O-N 2.94Å; E689-V691 PolarHBondContact O-N 2.89Å
690	D	97.4	Very high	96	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.064	19%	0.194	C	C	.	.			trans	-68.2	130.5	-177.6	-156.7	-71.9	0	0	0	110.9	R598 F686 V692 V695 R696	R598-D690 IonicContact CZ-OD1 3.41Å; R598-D690 IonicContact CZ-OD2 2.71Å; R598-D690 IonicContact NE-OD1 3.7Å; R598-D690 IonicContact NE-OD2 2.86Å; R598-D690 PolarHBondContact NE-OD2 3.39Å; R598-D690 IonicContact NH2-OD1 3.29Å; R598-D690 PolarHBondContact NH2-OD1 2.98Å; R598-D690 IonicContact NH2-OD2 2.69Å; R598-D690 PolarHBondContact NH2-OD2 3.15Å; F686-D690 HydrophobicContact CB-CB 4.45Å; F686-D690 HydrophobicContact CD1-CB 4.36Å; F686-D690 WeakPolarHBondContact CD1-OD2 3.41Å; F686-D690 WeakPolarHBondContact O-CB 3.29Å; F686-D690 PolarHBondContact O-N 2.91Å; D690-V692 PolarHBondContact O-N 3.32Å; D690-V692 PolarHBondContact OD1-N 3.38Å; D690-V695 HydrophobicContact CB-CB 4.27Å; D690-V695 HydrophobicContact CB-CG1 4.06Å; D690-R696 HydrophobicContact CB-CG 4.11Å; D690-R696 VanDerWaalsContact O-CD 3.28Å; D690-R696 WeakPolarHBondContact O-CD 3.47Å; D690-R696 PolarHBondContact O-NH1 2.81Å
691	V	95.4	Very high	95.6	Very high	124 Å²	124	36.6 Å²	36.6	75%	0.752	20%	0.202	S	C	*	.	S	Bend	trans	-67.1	-22.9	-178.4	-60.6	0	0	0	0	112.8	E689 P693 R696	E689-V691 PolarHBondContact O-N 2.89Å; V691-P693 WeakPolarHBondContact O-CD 3.24Å; V691-R696 PolarHBondContact O-NH1 3.43Å
692	V	96.9	Very high	95.4	Very high	33 Å²	33	33.8 Å²	33.8	20%	0.2	18%	0.179	C	C	.	.			trans	-94.5	116.2	-176.8	-178.4	0	0	0	0	110.7	Y595 D690 N694 V695 R696	Y595-V692 HydrophobicContact CD1-CG2 4.45Å; Y595-V692 HydrophobicContact CD2-CG1 3.85Å; Y595-V692 HydrophobicContact CE2-CG1 4.29Å; Y595-V692 HydrophobicContact CG-CB 4.45Å; Y595-V692 HydrophobicContact CG-CG1 4.06Å; Y595-V692 HydrophobicContact CG-CG2 4.05Å; D690-V692 PolarHBondContact O-N 3.32Å; D690-V692 PolarHBondContact OD1-N 3.38Å; V692-N694 VanDerWaalsContact C-N 3.29Å; V692-N694 HydrophobicContact CG1-CB 4.24Å; V692-N694 PolarHBondContact O-N 3.08Å; V692-V695 HydrophobicContact CB-CB 4.39Å; V692-V695 HydrophobicContact CB-CG2 3.93Å; V692-V695 HydrophobicContact CG1-CG2 4.12Å; V692-V695 WeakPolarHBondContact O-CB 3.37Å; V692-V695 PolarHBondContact O-N 3.15Å; V692-R696 PolarHBondContact O-N 3.12Å
693	P	95.8	Very high	95.2	Very high	45 Å²	45	32.4 Å²	32.4	29%	0.292	17%	0.172	S	C	.	.	H	α-helix	trans	-54.7	-40.4	-178.6	-27.4	34.9	0	0	0	113.9	V691 V695 R696 I697 D732 V735	V691-P693 WeakPolarHBondContact O-CD 3.24Å; P693-V695 VanDerWaalsContact C-N 3.28Å; P693-V695 PolarHBondContact O-N 3.07Å; P693-R696 WeakPolarHBondContact O-CA 3.45Å; P693-R696 WeakPolarHBondContact O-CB 3.19Å; P693-R696 PolarHBondContact O-N 3.27Å; P693-I697 WeakPolarHBondContact O-CG1 3.27Å; P693-I697 PolarHBondContact O-N 2.88Å; P693-D732 HydrophobicContact CB-CB 4.25Å; P693-D732 WeakPolarHBondContact CB-OD2 3.16Å; P693-D732 HydrophobicContact CG-CB 4.43Å; P693-D732 WeakPolarHBondContact CG-OD2 3.35Å; P693-V735 HydrophobicContact CB-CG2 3.87Å
694	N	93.4	Very high	94.8	Very high	78 Å²	78	33.5 Å²	33.5	42%	0.417	18%	0.177	S	C	.	.	H	α-helix	trans	-60.1	-36.4	178.3	-171.3	81	0	0	0	113	Q599 V692 R696 I697 C698	Q599-N694 PolarHBondContact OE1-ND2 3.29Å; V692-N694 VanDerWaalsContact C-N 3.29Å; V692-N694 HydrophobicContact CG1-CB 4.24Å; V692-N694 PolarHBondContact O-N 3.08Å; N694-R696 VanDerWaalsContact C-N 3.34Å; N694-I697 PolarHBondContact O-N 2.84Å; N694-C698 PolarHBondContact O-N 3.35Å; N694-C698 PolarHBondContact O-SG 2.94Å; N694-C698 VanDerWaalsContact O-SG 3.41Å
695	V	96.6	Very high	94.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67	-39.7	176	179.5	0	0	0	0	110	Y595 R598 I602 F686 D690 V692 P693 C698 A699	Y595-V695 HydrophobicContact CD2-CG2 4.12Å; R598-V695 HydrophobicContact CB-CG1 4.47Å; I602-V695 HydrophobicContact CD1-CG1 3.8Å; F686-V695 HydrophobicContact CB-CG1 4.15Å; F686-V695 HydrophobicContact CD1-CG1 4.27Å; F686-V695 HydrophobicContact CG-CG1 4.09Å; D690-V695 HydrophobicContact CB-CB 4.27Å; D690-V695 HydrophobicContact CB-CG1 4.06Å; V692-V695 HydrophobicContact CB-CB 4.39Å; V692-V695 HydrophobicContact CB-CG2 3.93Å; V692-V695 HydrophobicContact CG1-CG2 4.12Å; V692-V695 WeakPolarHBondContact O-CB 3.37Å; V692-V695 PolarHBondContact O-N 3.15Å; P693-V695 VanDerWaalsContact C-N 3.28Å; P693-V695 PolarHBondContact O-N 3.07Å; V695-C698 PolarHBondContact O-N 3.48Å; V695-A699 WeakPolarHBondContact O-CB 3.42Å; V695-A699 PolarHBondContact O-N 3.49Å
696	R	97.7	Very high	93.9	Very high	24 Å²	24	29.5 Å²	29.5	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-45.2	175.1	-53.2	-157.4	-66.8	-78.1	1.4	111.8	F686 L687 D690 V691 V692 P693 N694 C698 A699 T700 D730 V735	F686-R696 WeakPolarHBondContact O-CG 3.48Å; L687-R696 HydrophobicContact CD1-CB 4.49Å; L687-R696 WeakPolarHBondContact O-CD 3.42Å; D690-R696 HydrophobicContact CB-CG 4.11Å; D690-R696 VanDerWaalsContact O-CD 3.28Å; D690-R696 WeakPolarHBondContact O-CD 3.47Å; D690-R696 PolarHBondContact O-NH1 2.81Å; V691-R696 PolarHBondContact O-NH1 3.43Å; V692-R696 PolarHBondContact O-N 3.12Å; P693-R696 WeakPolarHBondContact O-CA 3.45Å; P693-R696 WeakPolarHBondContact O-CB 3.19Å; P693-R696 PolarHBondContact O-N 3.27Å; N694-R696 VanDerWaalsContact C-N 3.34Å; R696-C698 PolarHBondContact O-N 2.82Å; R696-A699 PolarHBondContact O-N 2.99Å; R696-T700 PolarHBondContact O-N 2.69Å; R696-T700 PolarHBondContact O-OG1 2.83Å; R696-D730 IonicContact CZ-OD1 3.75Å; R696-D730 IonicContact CZ-OD2 2.85Å; R696-D730 IonicContact NE-OD1 3.24Å; R696-D730 IonicContact NE-OD2 3.77Å; R696-D730 PolarHBondContact NE-OD2 2.86Å; R696-D730 IonicContact NH2-OD1 3.9Å; R696-D730 PolarHBondContact NH2-OD1 3.04Å; R696-D730 IonicContact NH2-OD2 2.91Å; R696-D730 PolarHBondContact NH2-OD2 2.87Å; R696-V735 HydrophobicContact CB-CG1 3.92Å; R696-V735 HydrophobicContact CB-CG2 4.1Å
697	I	93.8	Very high	93.5	Very high	20 Å²	20	30 Å²	30	10%	0.103	17%	0.167	C	C	.	.	H	α-helix	trans	-56.3	-50.2	174.5	-68.8	170.1	0	0	0	110.4	P693 N694 A699 T700 Q701 D734 V735 F738	P693-I697 WeakPolarHBondContact O-CG1 3.27Å; P693-I697 PolarHBondContact O-N 2.88Å; N694-I697 PolarHBondContact O-N 2.84Å; I697-A699 VanDerWaalsContact C-N 3.35Å; I697-A699 PolarHBondContact O-N 2.91Å; I697-T700 VanDerWaalsContact O-CB 3.32Å; I697-T700 WeakPolarHBondContact O-CB 3.25Å; I697-T700 PolarHBondContact O-N 3.2Å; I697-Q701 WeakPolarHBondContact O-CG 3.37Å; I697-Q701 PolarHBondContact O-N 2.83Å; I697-D734 HydrophobicContact CD1-CB 3.88Å; I697-V735 HydrophobicContact CD1-CG2 4.34Å; I697-V735 HydrophobicContact CG1-CB 4.4Å; I697-V735 HydrophobicContact CG1-CG2 3.79Å; I697-F738 HydrophobicContact CB-CD2 4.38Å; I697-F738 HydrophobicContact CD1-CD2 4.17Å; I697-F738 HydrophobicContact CD1-CE2 4.39Å; I697-F738 HydrophobicContact CG1-CD2 4.03Å; I697-F738 HydrophobicContact CG2-CB 4.38Å; I697-F738 HydrophobicContact CG2-CD2 3.51Å; I697-F738 HydrophobicContact CG2-CE2 3.87Å; I697-F738 HydrophobicContact CG2-CG 3.91Å
698	C	92.4	Very high	92.9	Very high	15 Å²	15	33.1 Å²	33.1	10%	0.101	20%	0.198	C	C	.	.	H	α-helix	trans	-70.3	-30.9	-178.5	-69.8	0	0	0	0	113.5	Q599 I602 N694 V695 R696 T700 Q701 A702	Q599-C698 PolarHBondContact NE2-SG 3.23Å; Q599-C698 VanDerWaalsContact OE1-CB 3.23Å; Q599-C698 PolarHBondContact OE1-SG 3.35Å; I602-C698 HydrophobicContact CD1-CB 4.25Å; I602-C698 HydrophobicContact CG2-CB 4.25Å; I602-C698 WeakPolarHBondContact CG2-O 3.42Å; N694-C698 PolarHBondContact O-N 3.35Å; N694-C698 PolarHBondContact O-SG 2.94Å; N694-C698 VanDerWaalsContact O-SG 3.41Å; V695-C698 PolarHBondContact O-N 3.48Å; R696-C698 PolarHBondContact O-N 2.82Å; C698-T700 VanDerWaalsContact C-N 3.34Å; C698-Q701 PolarHBondContact O-N 2.84Å; C698-A702 VanDerWaalsContact O-CB 3.25Å; C698-A702 WeakPolarHBondContact O-CB 3.34Å; C698-A702 PolarHBondContact O-N 3.47Å
699	A	95.6	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-42.5	172.7	0	0	0	0	0	110.9	I602 L683 F686 L687 V695 R696 I697 A702 L703	I602-A699 HydrophobicContact CD1-CB 4.15Å; L683-A699 HydrophobicContact CD2-CB 4.45Å; F686-A699 HydrophobicContact CB-CB 3.86Å; L687-A699 HydrophobicContact CB-CB 4.16Å; V695-A699 WeakPolarHBondContact O-CB 3.42Å; V695-A699 PolarHBondContact O-N 3.49Å; R696-A699 PolarHBondContact O-N 2.99Å; I697-A699 VanDerWaalsContact C-N 3.35Å; I697-A699 PolarHBondContact O-N 2.91Å; A699-A702 PolarHBondContact O-N 3.48Å; A699-L703 WeakPolarHBondContact O-CG 3.45Å; A699-L703 PolarHBondContact O-N 3.48Å
700	T	92.8	Very high	92.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-48.2	172.3	-67.8	0	0	0	0	112.5	L687 R696 I697 C698 A702 L703 H704 L723 F738 A739 S742	L687-T700 WeakPolarHBondContact CD1-OG1 3.26Å; R696-T700 PolarHBondContact O-N 2.69Å; R696-T700 PolarHBondContact O-OG1 2.83Å; I697-T700 VanDerWaalsContact O-CB 3.32Å; I697-T700 WeakPolarHBondContact O-CB 3.25Å; I697-T700 PolarHBondContact O-N 3.2Å; C698-T700 VanDerWaalsContact C-N 3.34Å; T700-A702 VanDerWaalsContact C-N 3.35Å; T700-L703 PolarHBondContact O-N 3.28Å; T700-H704 PolarHBondContact O-N 3.43Å; T700-L723 HydrophobicContact CG2-CD2 4.07Å; T700-F738 HydrophobicContact CG2-CB 4.25Å; T700-F738 WeakPolarHBondContact CG2-O 3.39Å; T700-A739 HydrophobicContact CG2-CB 4.42Å; T700-S742 VanDerWaalsContact CG2-OG 3.3Å; T700-S742 WeakPolarHBondContact CG2-OG 3.32Å; T700-S742 PolarHBondContact O-OG 2.89Å
701	Q	89.4	Confident	92	Very high	45 Å²	45	30.7 Å²	30.7	21%	0.21	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-39.9	178.1	-70.4	173.1	-27.2	0	0	111.4	I697 C698 H704 V705 F738	I697-Q701 WeakPolarHBondContact O-CG 3.37Å; I697-Q701 PolarHBondContact O-N 2.83Å; C698-Q701 PolarHBondContact O-N 2.84Å; Q701-H704 WeakPolarHBondContact O-CB 3.43Å; Q701-H704 PolarHBondContact O-N 3.4Å; Q701-V705 VanDerWaalsContact O-CG2 3.31Å; Q701-V705 WeakPolarHBondContact O-CG2 3.44Å; Q701-V705 PolarHBondContact O-N 2.95Å; Q701-F738 HydrophobicContact CG-CD1 4.42Å
702	A	91.8	Very high	91.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.2	-42.6	178.6	0	0	0	0	0	112.5	I602 Q606 L683 C698 A699 T700 H704 V705 I706	I602-A702 HydrophobicContact CG2-CB 3.45Å; I602-A702 VanDerWaalsContact CG2-CB 3.45Å; Q606-A702 HydrophobicContact CG-CB 3.6Å; L683-A702 HydrophobicContact CD1-CB 4.11Å; L683-A702 HydrophobicContact CD2-CB 4.2Å; C698-A702 VanDerWaalsContact O-CB 3.25Å; C698-A702 WeakPolarHBondContact O-CB 3.34Å; C698-A702 PolarHBondContact O-N 3.47Å; A699-A702 PolarHBondContact O-N 3.48Å; T700-A702 VanDerWaalsContact C-N 3.35Å; A702-H704 PolarHBondContact O-N 2.97Å; A702-V705 PolarHBondContact O-N 3.47Å; A702-V705 VanDerWaalsContact O-N 3.17Å; A702-I706 WeakPolarHBondContact O-CG1 3.46Å; A702-I706 PolarHBondContact O-N 3.34Å
703	L	92.8	Very high	91.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.7	-40.1	174.6	-74.2	165.9	0	0	0	111.6	V680 L683 L684 L687 A699 T700 S707 V719	V680-L703 HydrophobicContact CG1-CD2 4.34Å; L683-L703 HydrophobicContact CB-CD2 4.04Å; L683-L703 HydrophobicContact CB-CG 4.16Å; L683-L703 HydrophobicContact CD1-CD2 3.99Å; L683-L703 HydrophobicContact CD1-CG 4.18Å; L684-L703 HydrophobicContact CD2-CD1 3.79Å; L684-L703 HydrophobicContact CD2-CD2 4.4Å; L687-L703 HydrophobicContact CD2-CD1 3.89Å; A699-L703 WeakPolarHBondContact O-CG 3.45Å; A699-L703 PolarHBondContact O-N 3.48Å; T700-L703 PolarHBondContact O-N 3.28Å; L703-S707 PolarHBondContact O-N 3.45Å; L703-V719 HydrophobicContact CB-CG1 4.45Å; L703-V719 HydrophobicContact CD1-CG1 4.33Å; L703-V719 HydrophobicContact CD2-CG2 4.19Å
704	H	88.3	Confident	91.4	Very high	23 Å²	23	38.4 Å²	38.4	11%	0.106	21%	0.208	C	C	.	.	H	α-helix	trans	-66	-47.9	173.6	178.3	102.9	0	0	0	112	T700 Q701 A702 I706 S707 Y745	T700-H704 PolarHBondContact O-N 3.43Å; Q701-H704 WeakPolarHBondContact O-CB 3.43Å; Q701-H704 PolarHBondContact O-N 3.4Å; A702-H704 PolarHBondContact O-N 2.97Å; H704-I706 VanDerWaalsContact C-N 3.32Å; H704-I706 PolarHBondContact O-N 3.23Å; H704-S707 VanDerWaalsContact O-CB 3.23Å; H704-S707 WeakPolarHBondContact O-CB 3.14Å; H704-S707 PolarHBondContact O-N 3.11Å; H704-S707 VanDerWaalsContact O-N 3.16Å; H704-S707 PolarHBondContact O-OG 3.13Å; H704-S707 VanDerWaalsContact O-OG 3.14Å; H704-Y745 VanDerWaalsContact CE1-CB 3.48Å; H704-Y745 WeakPolarHBondContact CE1-CB 3.31Å; H704-Y745 AromaticContact CE1-CD1 3.43Å; H704-Y745 VanDerWaalsContact CE1-CD1 3.43Å; H704-Y745 WeakPolarHBondContact CE1-CD1 3.29Å; H704-Y745 AromaticContact CE1-CD2 3.36Å; H704-Y745 WeakPolarHBondContact CE1-CD2 3.36Å; H704-Y745 AromaticContact CE1-CE1 3.88Å; H704-Y745 AromaticContact CE1-CE2 3.83Å; H704-Y745 AromaticContact CE1-CG 3.12Å; H704-Y745 AromaticContact ND1-CD1 3.34Å; H704-Y745 VanDerWaalsContact ND1-CD1 3.34Å; H704-Y745 WeakPolarHBondContact ND1-CD1 3.48Å; H704-Y745 AromaticContact ND1-CE1 3.96Å; H704-Y745 AromaticContact ND1-CG 3.41Å
705	V	87.2	Confident	91.3	Very high	20 Å²	20	35.8 Å²	35.8	12%	0.121	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-37.6	-178.3	168.5	0	0	0	0	112.4	Q606 Q701 A702 S707	Q606-V705 HydrophobicContact CB-CG1 4.33Å; Q606-V705 HydrophobicContact CG-CB 4.35Å; Q606-V705 HydrophobicContact CG-CG1 4.19Å; Q701-V705 VanDerWaalsContact O-CG2 3.31Å; Q701-V705 WeakPolarHBondContact O-CG2 3.44Å; Q701-V705 PolarHBondContact O-N 2.95Å; A702-V705 PolarHBondContact O-N 3.47Å; A702-V705 VanDerWaalsContact O-N 3.17Å; V705-S707 VanDerWaalsContact C-N 3.32Å
706	I	90.2	Very high	91.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	6	179.9	75	-177.4	0	0	0	113.1	V605 W609 L676 V680 L683 A702 H704 G708 S709 L710	V605-I706 HydrophobicContact CG1-CD1 3.95Å; V605-I706 HydrophobicContact CG1-CG2 4.4Å; W609-I706 HydrophobicContact CB-CB 4.11Å; W609-I706 HydrophobicContact CB-CG2 3.93Å; L676-I706 HydrophobicContact CD1-CD1 4.25Å; V680-I706 HydrophobicContact CG2-CD1 4.36Å; L683-I706 HydrophobicContact CD1-CD1 3.78Å; A702-I706 WeakPolarHBondContact O-CG1 3.46Å; A702-I706 PolarHBondContact O-N 3.34Å; H704-I706 VanDerWaalsContact C-N 3.32Å; H704-I706 PolarHBondContact O-N 3.23Å; I706-G708 PolarHBondContact O-N 2.87Å; I706-G708 VanDerWaalsContact O-N 3.08Å; I706-S709 WeakPolarHBondContact O-CB 3.32Å; I706-S709 PolarHBondContact O-N 3.5Å; I706-L710 HydrophobicContact CD1-CD2 4.36Å; I706-L710 HydrophobicContact CG1-CD1 4.24Å; I706-L710 HydrophobicContact CG1-CD2 4.39Å; I706-L710 HydrophobicContact CG1-CG 4.27Å
707	S	88.8	Confident	91.1	Very high	13 Å²	13	44.9 Å²	44.9	9%	0.091	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-55.2	-34.2	-172.6	71.3	0	0	0	0	113.2	L703 H704 V705 S709 L710 Y745	L703-S707 PolarHBondContact O-N 3.45Å; H704-S707 VanDerWaalsContact O-CB 3.23Å; H704-S707 WeakPolarHBondContact O-CB 3.14Å; H704-S707 PolarHBondContact O-N 3.11Å; H704-S707 VanDerWaalsContact O-N 3.16Å; H704-S707 PolarHBondContact O-OG 3.13Å; H704-S707 VanDerWaalsContact O-OG 3.14Å; V705-S707 VanDerWaalsContact C-N 3.32Å; S707-S709 PolarHBondContact O-N 3.13Å; S707-L710 PolarHBondContact O-N 3.2Å; S707-L710 VanDerWaalsContact O-N 3.12Å; S707-Y745 WeakPolarHBondContact OG-CE1 3.29Å; S707-Y745 PolarHBondContact OG-OH 3.44Å
708	G	84.9	Confident	91.1	Very high	64 Å²	64	47.6 Å²	47.6	66%	0.66	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18.6	178.1	0	0	0	0	0	114.3	I706	I706-G708 PolarHBondContact O-N 2.87Å; I706-G708 VanDerWaalsContact O-N 3.08Å
709	S	88.5	Confident	91.3	Very high	51 Å²	51	46.9 Å²	46.9	36%	0.357	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-93.3	-11.5	175.3	-63.1	0	0	0	0	112.8	W609 L676 I706 S707	W609-S709 PolarHBondContact O-OG 3.24Å; L676-S709 VanDerWaalsContact CD2-O 3.26Å; L676-S709 WeakPolarHBondContact CD2-O 3.32Å; I706-S709 WeakPolarHBondContact O-CB 3.32Å; I706-S709 PolarHBondContact O-N 3.5Å; S707-S709 PolarHBondContact O-N 3.13Å
710	L	90.5	Very high	91.3	Very high	18 Å²	18	47.4 Å²	47.4	9%	0.094	25%	0.253	C	S	.	.	S	Bend	trans	-91	138.8	-178	-56.3	-176.8	0	0	0	110.9	L676 V680 I706 S707 I715 V719	L676-L710 HydrophobicContact CD1-CD2 3.99Å; L676-L710 HydrophobicContact CD2-CD2 4.11Å; L676-L710 HydrophobicContact CG-CD2 4.14Å; V680-L710 HydrophobicContact CG2-CD2 3.39Å; I706-L710 HydrophobicContact CD1-CD2 4.36Å; I706-L710 HydrophobicContact CG1-CD1 4.24Å; I706-L710 HydrophobicContact CG1-CD2 4.39Å; I706-L710 HydrophobicContact CG1-CG 4.27Å; S707-L710 PolarHBondContact O-N 3.2Å; S707-L710 VanDerWaalsContact O-N 3.12Å; L710-I715 HydrophobicContact CB-CD1 4.09Å; L710-I715 HydrophobicContact CB-CG1 3.89Å; L710-I715 HydrophobicContact CD1-CG1 4.31Å; L710-V719 HydrophobicContact CD1-CG2 4.31Å
711	D	90.2	Very high	91.4	Very high	72 Å²	72	50.3 Å²	50.3	39%	0.385	27%	0.272	S	S	.	.			trans	-74.8	155.2	170.9	72.2	-81.7	0	0	0	111.2	K713 T714 I715	D711-K713 PolarHBondContact O-N 3.32Å; D711-K713 VanDerWaalsContact O-N 3.16Å; D711-K713 WeakPolarHBondContact OD2-CA 3.41Å; D711-K713 VanDerWaalsContact OD2-CB 3.24Å; D711-K713 WeakPolarHBondContact OD2-CB 3.46Å; D711-K713 PolarHBondContact OD2-N 3.49Å; D711-T714 PolarHBondContact O-N 3.44Å; D711-T714 WeakPolarHBondContact OD1-CB 3.42Å; D711-T714 PolarHBondContact OD1-OG1 3.37Å; D711-T714 PolarHBondContact OD2-N 3.33Å; D711-T714 VanDerWaalsContact OD2-N 3.09Å; D711-I715 PolarHBondContact O-N 2.77Å
712	K	89.3	Confident	91.8	Very high	178 Å²	178	49.5 Å²	49.5	77%	0.774	27%	0.27	S	S	*	.	H	α-helix	trans	-58.7	-30.3	-177.5	-66.5	-172.9	177	-170.8	0	113.4	Q716	K712-Q716 WeakPolarHBondContact O-CB 3.27Å; K712-Q716 VanDerWaalsContact O-CG 3.3Å; K712-Q716 WeakPolarHBondContact O-CG 3.39Å; K712-Q716 PolarHBondContact O-N 3.26Å; K712-Q716 VanDerWaalsContact O-N 3.07Å
713	K	92.5	Very high	92	Very high	158 Å²	158	49.5 Å²	49.5	69%	0.687	27%	0.27	S	S	*	.	H	α-helix	trans	-71.2	-45.2	-178.9	-60.9	179.7	177.2	178.3	0	110.3	D711 I715 Q716 N717	D711-K713 PolarHBondContact O-N 3.32Å; D711-K713 VanDerWaalsContact O-N 3.16Å; D711-K713 WeakPolarHBondContact OD2-CA 3.41Å; D711-K713 VanDerWaalsContact OD2-CB 3.24Å; D711-K713 WeakPolarHBondContact OD2-CB 3.46Å; D711-K713 PolarHBondContact OD2-N 3.49Å; K713-I715 VanDerWaalsContact C-N 3.3Å; K713-I715 PolarHBondContact O-N 3.3Å; K713-Q716 PolarHBondContact O-N 3.15Å; K713-N717 VanDerWaalsContact O-CB 3.25Å; K713-N717 WeakPolarHBondContact O-CB 3.28Å; K713-N717 PolarHBondContact O-N 3.49Å
714	T	92.8	Very high	92.1	Very high	27 Å²	27	54.6 Å²	54.6	17%	0.166	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-42.4	175.3	-58.8	0	0	0	0	111.4	V680 D711 D718 V719	V680-T714 HydrophobicContact CG1-CG2 3.93Å; D711-T714 PolarHBondContact O-N 3.44Å; D711-T714 WeakPolarHBondContact OD1-CB 3.42Å; D711-T714 PolarHBondContact OD1-OG1 3.37Å; D711-T714 PolarHBondContact OD2-N 3.33Å; D711-T714 VanDerWaalsContact OD2-N 3.09Å; T714-D718 WeakPolarHBondContact O-CB 3.47Å; T714-D718 PolarHBondContact O-N 2.89Å; T714-V719 PolarHBondContact O-N 3.04Å; T714-V719 VanDerWaalsContact O-N 3.15Å
715	I	92.2	Very high	92.5	Very high	23 Å²	23	59.6 Å²	59.6	12%	0.118	31%	0.314	C	S	.	.	I	π-helix	trans	-62.2	-49.2	177.1	-64.5	172.4	0	0	0	111.4	L710 D711 K713 V719 I720 F746	L710-I715 HydrophobicContact CB-CD1 4.09Å; L710-I715 HydrophobicContact CB-CG1 3.89Å; L710-I715 HydrophobicContact CD1-CG1 4.31Å; D711-I715 PolarHBondContact O-N 2.77Å; K713-I715 VanDerWaalsContact C-N 3.3Å; K713-I715 PolarHBondContact O-N 3.3Å; I715-V719 PolarHBondContact O-N 3.01Å; I715-I720 HydrophobicContact CG2-CD1 4.02Å; I715-I720 HydrophobicContact CG2-CG1 4.2Å; I715-I720 WeakPolarHBondContact O-CG1 3.4Å; I715-I720 PolarHBondContact O-N 3.15Å; I715-F746 HydrophobicContact CD1-CD1 4.28Å; I715-F746 HydrophobicContact CD1-CE1 4.14Å; I715-F746 HydrophobicContact CG1-CD1 4.48Å; I715-F746 HydrophobicContact CG1-CE1 4.25Å; I715-F746 HydrophobicContact CG2-CB 4.29Å; I715-F746 HydrophobicContact CG2-CD1 3.54Å; I715-F746 HydrophobicContact CG2-CE1 4.07Å; I715-F746 HydrophobicContact CG2-CG 4.1Å
716	Q	93.6	Very high	92.9	Very high	104 Å²	104	59 Å²	59	49%	0.486	31%	0.31	S	S	.	.	I	π-helix	trans	-73.4	-38.6	-174.9	-69.8	-65.6	-21.1	0	0	113.5	K712 K713 P721	K712-Q716 WeakPolarHBondContact O-CB 3.27Å; K712-Q716 VanDerWaalsContact O-CG 3.3Å; K712-Q716 WeakPolarHBondContact O-CG 3.39Å; K712-Q716 PolarHBondContact O-N 3.26Å; K712-Q716 VanDerWaalsContact O-N 3.07Å; K713-Q716 PolarHBondContact O-N 3.15Å; Q716-P721 WeakPolarHBondContact O-CD 3.43Å
717	N	94.9	Very high	93.2	Very high	111 Å²	111	60.3 Å²	60.3	59%	0.594	32%	0.317	S	S	*	.	I	π-helix	trans	-91.2	-29.8	-172.8	-64.3	-18	0	0	0	113.2	K713 P721	K713-N717 VanDerWaalsContact O-CB 3.25Å; K713-N717 WeakPolarHBondContact O-CB 3.28Å; K713-N717 PolarHBondContact O-N 3.49Å; N717-P721 WeakPolarHBondContact O-CG 3.5Å
718	D	94.8	Very high	93.6	Very high	78 Å²	78	65 Å²	65	42%	0.417	34%	0.341	S	S	.	.	I	π-helix	trans	-115.3	-50.6	-172.5	-51.5	-45.9	0	0	0	111.9	L684 T714 V722	L684-D718 HydrophobicContact CD1-CB 3.74Å; T714-D718 WeakPolarHBondContact O-CB 3.47Å; T714-D718 PolarHBondContact O-N 2.89Å; D718-V722 VanDerWaalsContact O-CG2 3.26Å; D718-V722 WeakPolarHBondContact O-CG2 3.2Å
719	V	95.4	Very high	94.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.34	C	S	.	.	I	π-helix	trans	-73.1	-54.4	-173.1	-178.2	0	0	0	0	112.6	L684 L703 L710 T714 I715 V722 L723 F746	L684-V719 HydrophobicContact CD2-CG2 4.35Å; L703-V719 HydrophobicContact CB-CG1 4.45Å; L703-V719 HydrophobicContact CD1-CG1 4.33Å; L703-V719 HydrophobicContact CD2-CG2 4.19Å; L710-V719 HydrophobicContact CD1-CG2 4.31Å; T714-V719 PolarHBondContact O-N 3.04Å; T714-V719 VanDerWaalsContact O-N 3.15Å; I715-V719 PolarHBondContact O-N 3.01Å; V719-V722 PolarHBondContact O-N 3.39Å; V719-L723 HydrophobicContact CG1-CD1 3.85Å; V719-L723 HydrophobicContact CG1-CG 4.36Å; V719-L723 WeakPolarHBondContact O-CG 3.32Å; V719-L723 PolarHBondContact O-N 3.05Å; V719-F746 HydrophobicContact CG1-CD2 4.27Å; V719-F746 HydrophobicContact CG1-CE2 3.77Å; V719-F746 HydrophobicContact CG1-CZ 4.01Å
720	I	95.6	Very high	94.4	Very high	10 Å²	10	68.3 Å²	68.3	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-45.4	-176.6	-73.2	173.3	0	0	0	112.3	I715 V722 L723 K724 L743 F746	I715-I720 HydrophobicContact CG2-CD1 4.02Å; I715-I720 HydrophobicContact CG2-CG1 4.2Å; I715-I720 WeakPolarHBondContact O-CG1 3.4Å; I715-I720 PolarHBondContact O-N 3.15Å; I720-V722 VanDerWaalsContact C-N 3.33Å; I720-V722 PolarHBondContact O-N 3.29Å; I720-L723 PolarHBondContact O-N 3.42Å; I720-K724 HydrophobicContact CG2-CD 4.27Å; I720-K724 WeakPolarHBondContact O-CG 3.47Å; I720-K724 PolarHBondContact O-N 2.84Å; I720-L743 HydrophobicContact CB-CD1 4.47Å; I720-L743 HydrophobicContact CG1-CD1 4.26Å; I720-L743 HydrophobicContact CG2-CD1 3.92Å; I720-F746 HydrophobicContact CD1-CB 4.14Å; I720-F746 HydrophobicContact CG1-CB 4.08Å
721	P	96.2	Very high	94.6	Very high	62 Å²	62	77 Å²	77	40%	0.403	37%	0.366	S	S	.	.	H	α-helix	trans	-62.1	-39.1	178.7	-27.9	39.4	0	0	0	113.2	Q716 N717 K725	Q716-P721 WeakPolarHBondContact O-CD 3.43Å; N717-P721 WeakPolarHBondContact O-CG 3.5Å; P721-K725 WeakPolarHBondContact O-CB 3.26Å; P721-K725 PolarHBondContact O-N 2.62Å
722	V	96.9	Very high	94.9	Very high	28 Å²	28	75.6 Å²	75.6	17%	0.17	36%	0.358	C	S	.	.	H	α-helix	trans	-66.9	-43.6	176.4	172.1	0	0	0	0	111.1	L684 L687 S688 D718 V719 I720 K724 K725 V726	L684-V722 HydrophobicContact CD2-CB 3.97Å; L684-V722 HydrophobicContact CD2-CG1 4.09Å; L684-V722 HydrophobicContact CD2-CG2 4.1Å; L687-V722 HydrophobicContact CD2-CG1 3.79Å; L687-V722 HydrophobicContact CG-CG1 3.97Å; S688-V722 VanDerWaalsContact OG-CG1 3.25Å; S688-V722 WeakPolarHBondContact OG-CG1 3.44Å; D718-V722 VanDerWaalsContact O-CG2 3.26Å; D718-V722 WeakPolarHBondContact O-CG2 3.2Å; V719-V722 PolarHBondContact O-N 3.39Å; I720-V722 VanDerWaalsContact C-N 3.33Å; I720-V722 PolarHBondContact O-N 3.29Å; V722-K724 PolarHBondContact O-N 3.04Å; V722-K725 PolarHBondContact O-N 3.02Å; V722-V726 HydrophobicContact CG1-CG2 4.49Å; V722-V726 WeakPolarHBondContact O-CG2 3.41Å; V722-V726 PolarHBondContact O-N 3.41Å
723	L	95.9	Very high	95.2	Very high	0 Å²	0	73 Å²	73	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.8	-45.6	176	-73.6	170.9	0	0	0	112	L687 T700 V719 I720 K725 V726 I727 A739 L743 F746	L687-L723 HydrophobicContact CD2-CD2 3.84Å; L687-L723 HydrophobicContact CD2-CG 4.45Å; T700-L723 HydrophobicContact CG2-CD2 4.07Å; V719-L723 HydrophobicContact CG1-CD1 3.85Å; V719-L723 HydrophobicContact CG1-CG 4.36Å; V719-L723 WeakPolarHBondContact O-CG 3.32Å; V719-L723 PolarHBondContact O-N 3.05Å; I720-L723 PolarHBondContact O-N 3.42Å; L723-K725 PolarHBondContact O-N 2.85Å; L723-V726 PolarHBondContact O-N 3.21Å; L723-I727 WeakPolarHBondContact O-CD1 3.44Å; L723-I727 VanDerWaalsContact O-CG1 3.22Å; L723-I727 WeakPolarHBondContact O-CG1 3.35Å; L723-I727 PolarHBondContact O-N 3.09Å; L723-A739 HydrophobicContact CD2-CB 4.01Å; L723-L743 HydrophobicContact CB-CB 4.49Å; L723-L743 HydrophobicContact CD1-CB 4.43Å; L723-F746 HydrophobicContact CD1-CD2 3.67Å; L723-F746 HydrophobicContact CD1-CE2 3.88Å
724	K	96.5	Very high	95.3	Very high	107 Å²	107	70 Å²	70	47%	0.465	34%	0.34	S	S	.	.	H	α-helix	trans	-59.4	-46.7	175.9	-73	179.6	178.3	-179.2	0	111.7	I720 V722 V726 I727 D728 L743	I720-K724 HydrophobicContact CG2-CD 4.27Å; I720-K724 WeakPolarHBondContact O-CG 3.47Å; I720-K724 PolarHBondContact O-N 2.84Å; V722-K724 PolarHBondContact O-N 3.04Å; K724-V726 VanDerWaalsContact C-N 3.3Å; K724-V726 PolarHBondContact O-N 3.04Å; K724-I727 PolarHBondContact O-N 3.24Å; K724-D728 VanDerWaalsContact O-CG 3.31Å; K724-D728 PolarHBondContact O-N 2.97Å; K724-L743 HydrophobicContact CG-CD1 4.4Å; K724-L743 HydrophobicContact CG-CD2 3.94Å
725	K	96.3	Very high	95.4	Very high	127 Å²	127	68.7 Å²	68.7	55%	0.552	33%	0.333	S	S	*	.	H	α-helix	trans	-58.8	-41.6	176.6	-172	-176.2	177.8	-173.8	0	111.8	P721 V722 L723 D728 Y729	P721-K725 WeakPolarHBondContact O-CB 3.26Å; P721-K725 PolarHBondContact O-N 2.62Å; V722-K725 PolarHBondContact O-N 3.02Å; L723-K725 PolarHBondContact O-N 2.85Å; K725-D728 PolarHBondContact O-N 3.16Å; K725-Y729 HydrophobicContact CG-CD2 3.84Å; K725-Y729 HydrophobicContact CG-CE2 4.45Å; K725-Y729 WeakPolarHBondContact O-CB 3.4Å; K725-Y729 VanDerWaalsContact O-CD2 3.27Å; K725-Y729 WeakPolarHBondContact O-CD2 3.25Å; K725-Y729 PolarHBondContact O-N 3.43Å
726	V	95.9	Very high	95.6	Very high	8 Å²	8	71.3 Å²	71.3	5%	0.048	34%	0.341	C	S	.	.	H	α-helix	trans	-66.2	-43	176.9	168	0	0	0	0	111.4	L687 V722 L723 K724 D728 Y729 D730 V735 R736 A739	L687-V726 HydrophobicContact CD1-CB 4.37Å; L687-V726 HydrophobicContact CD1-CG1 4.01Å; L687-V726 HydrophobicContact CD1-CG2 3.83Å; L687-V726 HydrophobicContact CG-CG2 3.88Å; V722-V726 HydrophobicContact CG1-CG2 4.49Å; V722-V726 WeakPolarHBondContact O-CG2 3.41Å; V722-V726 PolarHBondContact O-N 3.41Å; L723-V726 PolarHBondContact O-N 3.21Å; K724-V726 VanDerWaalsContact C-N 3.3Å; K724-V726 PolarHBondContact O-N 3.04Å; V726-D728 VanDerWaalsContact C-N 3.28Å; V726-D728 PolarHBondContact O-N 2.92Å; V726-Y729 PolarHBondContact O-N 2.99Å; V726-D730 HydrophobicContact CG1-CB 3.83Å; V726-D730 WeakPolarHBondContact O-CB 3.43Å; V726-D730 PolarHBondContact O-N 3.31Å; V726-V735 HydrophobicContact CG1-CG1 3.64Å; V726-R736 WeakPolarHBondContact O-CG 3.26Å; V726-A739 HydrophobicContact CB-CB 4.49Å; V726-A739 HydrophobicContact CG1-CB 3.9Å
727	I	96.2	Very high	95.7	Very high	28 Å²	28	72 Å²	72	14%	0.144	34%	0.342	C	S	.	.	H	α-helix	trans	-58.6	-42	176.5	-68.2	158.2	0	0	0	111.2	L723 K724 R736 A739 Q740 L743	L723-I727 WeakPolarHBondContact O-CD1 3.44Å; L723-I727 VanDerWaalsContact O-CG1 3.22Å; L723-I727 WeakPolarHBondContact O-CG1 3.35Å; L723-I727 PolarHBondContact O-N 3.09Å; K724-I727 PolarHBondContact O-N 3.24Å; I727-R736 WeakPolarHBondContact O-CD 3.46Å; I727-A739 HydrophobicContact CD1-CB 4.36Å; I727-A739 HydrophobicContact CG1-CB 3.75Å; I727-Q740 HydrophobicContact CD1-CB 4.28Å; I727-Q740 HydrophobicContact CG1-CB 4.39Å; I727-L743 HydrophobicContact CD1-CB 4.04Å; I727-L743 HydrophobicContact CD1-CD2 3.51Å; I727-L743 HydrophobicContact CD1-CG 4.41Å
728	D	95.9	Very high	95.5	Very high	110 Å²	110	69.2 Å²	69.2	59%	0.588	33%	0.325	S	S	*	.	H	α-helix	trans	-77.3	-36.9	-176.8	-66.3	-22.6	0	0	0	113	K724 K725 V726	K724-D728 VanDerWaalsContact O-CG 3.31Å; K724-D728 PolarHBondContact O-N 2.97Å; K725-D728 PolarHBondContact O-N 3.16Å; V726-D728 VanDerWaalsContact C-N 3.28Å; V726-D728 PolarHBondContact O-N 2.92Å
729	Y	95.6	Very high	95.4	Very high	166 Å²	166	65.5 Å²	65.5	65%	0.651	31%	0.305	S	S	*	.	H	α-helix	trans	-122.7	-11.1	-164.9	-59.8	-75.5	0	0	0	116.2	K725 V726	K725-Y729 HydrophobicContact CG-CD2 3.84Å; K725-Y729 HydrophobicContact CG-CE2 4.45Å; K725-Y729 WeakPolarHBondContact O-CB 3.4Å; K725-Y729 VanDerWaalsContact O-CD2 3.27Å; K725-Y729 WeakPolarHBondContact O-CD2 3.25Å; K725-Y729 PolarHBondContact O-N 3.43Å; V726-Y729 PolarHBondContact O-N 2.99Å
730	D	96.2	Very high	95.4	Very high	19 Å²	19	69 Å²	69	10%	0.102	32%	0.322	C	S	.	.			trans	-71.5	133.7	178.2	-160.8	-57.7	0	0	0	110.8	R696 V726 D732 V735 R736	R696-D730 IonicContact CZ-OD1 3.75Å; R696-D730 IonicContact CZ-OD2 2.85Å; R696-D730 IonicContact NE-OD1 3.24Å; R696-D730 IonicContact NE-OD2 3.77Å; R696-D730 PolarHBondContact NE-OD2 2.86Å; R696-D730 IonicContact NH2-OD1 3.9Å; R696-D730 PolarHBondContact NH2-OD1 3.04Å; R696-D730 IonicContact NH2-OD2 2.91Å; R696-D730 PolarHBondContact NH2-OD2 2.87Å; V726-D730 HydrophobicContact CG1-CB 3.83Å; V726-D730 WeakPolarHBondContact O-CB 3.43Å; V726-D730 PolarHBondContact O-N 3.31Å; D730-D732 VanDerWaalsContact C-N 3.28Å; D730-D732 PolarHBondContact O-N 2.8Å; D730-D732 WeakPolarHBondContact OD1-CB 3.24Å; D730-D732 PolarHBondContact OD1-N 2.93Å; D730-V735 HydrophobicContact CB-CG1 4.41Å; D730-V735 WeakPolarHBondContact OD2-CG1 3.45Å; D730-R736 HydrophobicContact CB-CG 4.03Å; D730-R736 WeakPolarHBondContact O-CD 3.3Å; D730-R736 PolarHBondContact O-NE 2.89Å; D730-R736 VanDerWaalsContact O-NE 3.1Å
731	F	93.4	Very high	95	Very high	201 Å²	201	73.8 Å²	73.8	88%	0.882	34%	0.344	S	S	*	.	S	Bend	trans	-71.4	-25	-177.4	-57.1	-78.8	0	0	0	112.6
732	D	96.9	Very high	94.7	Very high	43 Å²	43	71.1 Å²	71.1	23%	0.23	33%	0.327	C	S	.	.			trans	-87.5	127.3	-175.7	-169.3	-72.5	0	0	0	111.2	P693 D730 D734 V735 R736	P693-D732 HydrophobicContact CB-CB 4.25Å; P693-D732 WeakPolarHBondContact CB-OD2 3.16Å; P693-D732 HydrophobicContact CG-CB 4.43Å; P693-D732 WeakPolarHBondContact CG-OD2 3.35Å; D730-D732 VanDerWaalsContact C-N 3.28Å; D730-D732 PolarHBondContact O-N 2.8Å; D730-D732 WeakPolarHBondContact OD1-CB 3.24Å; D730-D732 PolarHBondContact OD1-N 2.93Å; D732-D734 WeakPolarHBondContact OD1-CB 3.32Å; D732-D734 PolarHBondContact OD1-N 3.29Å; D732-V735 HydrophobicContact CB-CB 4.05Å; D732-V735 HydrophobicContact CB-CG2 3.68Å; D732-V735 PolarHBondContact OD1-N 2.91Å; D732-R736 WeakPolarHBondContact O-CG 3.36Å; D732-R736 PolarHBondContact O-N 2.92Å; D732-R736 PolarHBondContact O-NE 3.07Å
733	Q	95.1	Very high	94.4	Very high	122 Å²	122	70.4 Å²	70.4	57%	0.57	32%	0.322	S	S	*	.	H	α-helix	trans	-69.5	-35.1	-176.8	-175.3	64.8	39.8	0	0	112.4	R736 F737	Q733-R736 PolarHBondContact O-N 3.09Å; Q733-F737 WeakPolarHBondContact O-CB 3.42Å; Q733-F737 PolarHBondContact O-N 3.2Å
734	D	94.5	Very high	94	Very high	96 Å²	96	74.4 Å²	74.4	51%	0.513	34%	0.343	S	S	.	.	H	α-helix	trans	-73.2	-40	-178.9	-67.6	-27.3	0	0	0	110.3	I697 D732 R736 F737 F738	I697-D734 HydrophobicContact CD1-CB 3.88Å; D732-D734 WeakPolarHBondContact OD1-CB 3.32Å; D732-D734 PolarHBondContact OD1-N 3.29Å; D734-R736 VanDerWaalsContact C-N 3.31Å; D734-R736 PolarHBondContact O-N 3.32Å; D734-F737 WeakPolarHBondContact O-CB 3.3Å; D734-F737 PolarHBondContact O-N 2.88Å; D734-F738 VanDerWaalsContact O-CD2 3.22Å; D734-F738 WeakPolarHBondContact O-CD2 3.47Å; D734-F738 PolarHBondContact O-N 2.92Å
735	V	96.1	Very high	93.4	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-57.1	-47.4	173	-179.2	0	0	0	0	110.5	P693 R696 I697 V726 D730 D732 F737 F738 A739	P693-V735 HydrophobicContact CB-CG2 3.87Å; R696-V735 HydrophobicContact CB-CG1 3.92Å; R696-V735 HydrophobicContact CB-CG2 4.1Å; I697-V735 HydrophobicContact CD1-CG2 4.34Å; I697-V735 HydrophobicContact CG1-CB 4.4Å; I697-V735 HydrophobicContact CG1-CG2 3.79Å; V726-V735 HydrophobicContact CG1-CG1 3.64Å; D730-V735 HydrophobicContact CB-CG1 4.41Å; D730-V735 WeakPolarHBondContact OD2-CG1 3.45Å; D732-V735 HydrophobicContact CB-CB 4.05Å; D732-V735 HydrophobicContact CB-CG2 3.68Å; D732-V735 PolarHBondContact OD1-N 2.91Å; V735-F737 PolarHBondContact O-N 2.93Å; V735-F738 PolarHBondContact O-N 3.15Å; V735-A739 VanDerWaalsContact O-CB 3.26Å; V735-A739 WeakPolarHBondContact O-CB 3.13Å; V735-A739 PolarHBondContact O-N 3.15Å
736	R	96.3	Very high	92.8	Very high	77 Å²	77	65.2 Å²	65.2	29%	0.291	30%	0.302	S	S	.	.	H	α-helix	trans	-62.2	-41.7	176.4	-71.1	-173.3	-74.3	165	-1.5	112.5	V726 I727 D730 D732 Q733 D734 A739 Q740	V726-R736 WeakPolarHBondContact O-CG 3.26Å; I727-R736 WeakPolarHBondContact O-CD 3.46Å; D730-R736 HydrophobicContact CB-CG 4.03Å; D730-R736 WeakPolarHBondContact O-CD 3.3Å; D730-R736 PolarHBondContact O-NE 2.89Å; D730-R736 VanDerWaalsContact O-NE 3.1Å; D732-R736 WeakPolarHBondContact O-CG 3.36Å; D732-R736 PolarHBondContact O-N 2.92Å; D732-R736 PolarHBondContact O-NE 3.07Å; Q733-R736 PolarHBondContact O-N 3.09Å; D734-R736 VanDerWaalsContact C-N 3.31Å; D734-R736 PolarHBondContact O-N 3.32Å; R736-A739 PolarHBondContact O-N 2.6Å; R736-Q740 WeakPolarHBondContact O-CB 3.39Å; R736-Q740 PolarHBondContact O-N 3.22Å
737	F	94.7	Very high	92	Very high	119 Å²	119	69 Å²	69	52%	0.522	33%	0.326	S	S	.	.	H	α-helix	trans	-59.6	-51.5	177.3	173.5	-94.5	0	0	0	112	Q733 D734 V735 A739 Q740 Q741	Q733-F737 WeakPolarHBondContact O-CB 3.42Å; Q733-F737 PolarHBondContact O-N 3.2Å; D734-F737 WeakPolarHBondContact O-CB 3.3Å; D734-F737 PolarHBondContact O-N 2.88Å; V735-F737 PolarHBondContact O-N 2.93Å; F737-A739 VanDerWaalsContact C-N 3.33Å; F737-A739 PolarHBondContact O-N 3.09Å; F737-Q740 PolarHBondContact O-N 3.42Å; F737-Q741 PolarHBondContact O-N 3.3Å
738	F	90.7	Very high	90.8	Very high	52 Å²	52	71.9 Å²	71.9	23%	0.228	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-35.5	178.1	-76.3	-71.4	0	0	0	112	I697 T700 Q701 D734 V735 Q741 S742	I697-F738 HydrophobicContact CB-CD2 4.38Å; I697-F738 HydrophobicContact CD1-CD2 4.17Å; I697-F738 HydrophobicContact CD1-CE2 4.39Å; I697-F738 HydrophobicContact CG1-CD2 4.03Å; I697-F738 HydrophobicContact CG2-CB 4.38Å; I697-F738 HydrophobicContact CG2-CD2 3.51Å; I697-F738 HydrophobicContact CG2-CE2 3.87Å; I697-F738 HydrophobicContact CG2-CG 3.91Å; T700-F738 HydrophobicContact CG2-CB 4.25Å; T700-F738 WeakPolarHBondContact CG2-O 3.39Å; Q701-F738 HydrophobicContact CG-CD1 4.42Å; D734-F738 VanDerWaalsContact O-CD2 3.22Å; D734-F738 WeakPolarHBondContact O-CD2 3.47Å; D734-F738 PolarHBondContact O-N 2.92Å; V735-F738 PolarHBondContact O-N 3.15Å; F738-Q741 PolarHBondContact O-N 3.45Å; F738-S742 PolarHBondContact O-N 3.21Å; F738-S742 PolarHBondContact O-OG 3.17Å
739	A	93.9	Very high	89	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-42.2	174.9	0	0	0	0	0	111.7	T700 L723 V726 I727 V735 R736 F737 S742 L743	T700-A739 HydrophobicContact CG2-CB 4.42Å; L723-A739 HydrophobicContact CD2-CB 4.01Å; V726-A739 HydrophobicContact CB-CB 4.49Å; V726-A739 HydrophobicContact CG1-CB 3.9Å; I727-A739 HydrophobicContact CD1-CB 4.36Å; I727-A739 HydrophobicContact CG1-CB 3.75Å; V735-A739 VanDerWaalsContact O-CB 3.26Å; V735-A739 WeakPolarHBondContact O-CB 3.13Å; V735-A739 PolarHBondContact O-N 3.15Å; R736-A739 PolarHBondContact O-N 2.6Å; F737-A739 VanDerWaalsContact C-N 3.33Å; F737-A739 PolarHBondContact O-N 3.09Å; A739-S742 PolarHBondContact O-N 3.13Å; A739-L743 WeakPolarHBondContact O-CB 3.46Å; A739-L743 PolarHBondContact O-N 3.02Å
740	Q	94.2	Very high	88.6	Confident	75 Å²	75	67.1 Å²	67.1	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-63	-42	174.3	-173.8	65.2	56.2	0	0	111.7	I727 R736 F737 L743 N744	I727-Q740 HydrophobicContact CD1-CB 4.28Å; I727-Q740 HydrophobicContact CG1-CB 4.39Å; R736-Q740 WeakPolarHBondContact O-CB 3.39Å; R736-Q740 PolarHBondContact O-N 3.22Å; F737-Q740 PolarHBondContact O-N 3.42Å; Q740-L743 PolarHBondContact O-N 3.02Å; Q740-N744 PolarHBondContact NE2-OD1 3.15Å; Q740-N744 WeakPolarHBondContact O-CB 3.5Å; Q740-N744 PolarHBondContact O-N 2.81Å; Q740-N744 PolarHBondContact O-ND2 2.58Å; Q740-N744 PolarHBondContact O-OD1 3.48Å
741	Q	88.3	Confident	88.2	Confident	109 Å²	109	69.6 Å²	69.6	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-61.3	-45.9	176.6	-171.7	-178.2	13.5	0	0	111.7	F737 F738 N744 Y745	F737-Q741 PolarHBondContact O-N 3.3Å; F738-Q741 PolarHBondContact O-N 3.45Å; Q741-N744 PolarHBondContact O-N 3.05Å; Q741-Y745 PolarHBondContact O-N 3.43Å
742	S	88.5	Confident	87.9	Confident	6 Å²	6	62.3 Å²	62.3	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-64.8	-41.7	175.7	-73.2	0	0	0	0	112.1	T700 F738 A739 N744 Y745 F746	T700-S742 VanDerWaalsContact CG2-OG 3.3Å; T700-S742 WeakPolarHBondContact CG2-OG 3.32Å; T700-S742 PolarHBondContact O-OG 2.89Å; F738-S742 PolarHBondContact O-N 3.21Å; F738-S742 PolarHBondContact O-OG 3.17Å; A739-S742 PolarHBondContact O-N 3.13Å; S742-N744 PolarHBondContact O-N 3.31Å; S742-Y745 WeakPolarHBondContact O-CB 3.49Å; S742-Y745 PolarHBondContact O-N 3.1Å; S742-F746 WeakPolarHBondContact O-CD2 3.39Å; S742-F746 PolarHBondContact O-N 3.23Å; S742-F746 VanDerWaalsContact O-N 3.09Å
743	L	91	Very high	87.4	Confident	13 Å²	13	63.4 Å²	63.4	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-60.2	-46.9	177	179.8	63.4	0	0	0	111.3	I720 L723 K724 I727 A739 Q740 Y745 F746 T747	I720-L743 HydrophobicContact CB-CD1 4.47Å; I720-L743 HydrophobicContact CG1-CD1 4.26Å; I720-L743 HydrophobicContact CG2-CD1 3.92Å; L723-L743 HydrophobicContact CB-CB 4.49Å; L723-L743 HydrophobicContact CD1-CB 4.43Å; K724-L743 HydrophobicContact CG-CD1 4.4Å; K724-L743 HydrophobicContact CG-CD2 3.94Å; I727-L743 HydrophobicContact CD1-CB 4.04Å; I727-L743 HydrophobicContact CD1-CD2 3.51Å; I727-L743 HydrophobicContact CD1-CG 4.41Å; A739-L743 WeakPolarHBondContact O-CB 3.46Å; A739-L743 PolarHBondContact O-N 3.02Å; Q740-L743 PolarHBondContact O-N 3.02Å; L743-Y745 PolarHBondContact O-N 3.44Å; L743-F746 PolarHBondContact O-N 2.94Å; L743-F746 VanDerWaalsContact O-N 3.08Å; L743-T747 HydrophobicContact CD1-CG2 4.06Å; L743-T747 HydrophobicContact CG-CG2 4.33Å; L743-T747 WeakPolarHBondContact O-CG2 3.26Å; L743-T747 PolarHBondContact O-N 3.43Å; L743-T747 PolarHBondContact O-OG1 3.45Å; L743-T747 VanDerWaalsContact O-OG1 3.08Å
744	N	88.8	Confident	86.9	Confident	85 Å²	85	59.8 Å²	59.8	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-55.6	-38	178.2	-70.2	-12.4	0	0	0	111.8	Q740 Q741 S742 T747 A748	Q740-N744 PolarHBondContact NE2-OD1 3.15Å; Q740-N744 WeakPolarHBondContact O-CB 3.5Å; Q740-N744 PolarHBondContact O-N 2.81Å; Q740-N744 PolarHBondContact O-ND2 2.58Å; Q740-N744 PolarHBondContact O-OD1 3.48Å; Q741-N744 PolarHBondContact O-N 3.05Å; S742-N744 PolarHBondContact O-N 3.31Å; N744-T747 WeakPolarHBondContact CA-OG1 3.41Å; N744-T747 PolarHBondContact O-OG1 3.24Å; N744-A748 VanDerWaalsContact O-CB 3.27Å; N744-A748 WeakPolarHBondContact O-CB 3.35Å; N744-A748 PolarHBondContact O-N 2.76Å; N744-A748 VanDerWaalsContact O-N 3.13Å
745	Y	83.2	Confident	86.4	Confident	37 Å²	37	57.3 Å²	57.3	15%	0.145	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-50	174.9	175.9	-96.8	0	0	0	112.3	H704 S707 Q741 S742 L743 T747 A748 T749	H704-Y745 VanDerWaalsContact CE1-CB 3.48Å; H704-Y745 WeakPolarHBondContact CE1-CB 3.31Å; H704-Y745 AromaticContact CE1-CD1 3.43Å; H704-Y745 VanDerWaalsContact CE1-CD1 3.43Å; H704-Y745 WeakPolarHBondContact CE1-CD1 3.29Å; H704-Y745 AromaticContact CE1-CD2 3.36Å; H704-Y745 WeakPolarHBondContact CE1-CD2 3.36Å; H704-Y745 AromaticContact CE1-CE1 3.88Å; H704-Y745 AromaticContact CE1-CE2 3.83Å; H704-Y745 AromaticContact CE1-CG 3.12Å; H704-Y745 AromaticContact ND1-CD1 3.34Å; H704-Y745 VanDerWaalsContact ND1-CD1 3.34Å; H704-Y745 WeakPolarHBondContact ND1-CD1 3.48Å; H704-Y745 AromaticContact ND1-CE1 3.96Å; H704-Y745 AromaticContact ND1-CG 3.41Å; S707-Y745 WeakPolarHBondContact OG-CE1 3.29Å; S707-Y745 PolarHBondContact OG-OH 3.44Å; Q741-Y745 PolarHBondContact O-N 3.43Å; S742-Y745 WeakPolarHBondContact O-CB 3.49Å; S742-Y745 PolarHBondContact O-N 3.1Å; L743-Y745 PolarHBondContact O-N 3.44Å; Y745-T747 PolarHBondContact O-N 3.03Å; Y745-A748 PolarHBondContact O-N 3.01Å; Y745-A748 VanDerWaalsContact O-N 3.11Å; Y745-T749 HydrophobicContact CE2-CG2 4.49Å; Y745-T749 PolarHBondContact O-N 2.85Å; Y745-T749 VanDerWaalsContact O-N 3.13Å; Y745-T749 PolarHBondContact O-OG1 2.74Å
746	F	84.1	Confident	85.7	Confident	3 Å²	3	61.4 Å²	61.4	1%	0.013	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-21.7	179.5	-71.2	-63	0	0	0	114.1	I715 V719 I720 L723 S742 L743	I715-F746 HydrophobicContact CD1-CD1 4.28Å; I715-F746 HydrophobicContact CD1-CE1 4.14Å; I715-F746 HydrophobicContact CG1-CD1 4.48Å; I715-F746 HydrophobicContact CG1-CE1 4.25Å; I715-F746 HydrophobicContact CG2-CB 4.29Å; I715-F746 HydrophobicContact CG2-CD1 3.54Å; I715-F746 HydrophobicContact CG2-CE1 4.07Å; I715-F746 HydrophobicContact CG2-CG 4.1Å; V719-F746 HydrophobicContact CG1-CD2 4.27Å; V719-F746 HydrophobicContact CG1-CE2 3.77Å; V719-F746 HydrophobicContact CG1-CZ 4.01Å; I720-F746 HydrophobicContact CD1-CB 4.14Å; I720-F746 HydrophobicContact CG1-CB 4.08Å; L723-F746 HydrophobicContact CD1-CD2 3.67Å; L723-F746 HydrophobicContact CD1-CE2 3.88Å; S742-F746 WeakPolarHBondContact O-CD2 3.39Å; S742-F746 PolarHBondContact O-N 3.23Å; S742-F746 VanDerWaalsContact O-N 3.09Å; L743-F746 PolarHBondContact O-N 2.94Å; L743-F746 VanDerWaalsContact O-N 3.08Å
747	T	79.3	Confident	84.9	Confident	89 Å²	89	60.2 Å²	60.2	55%	0.546	33%	0.328	S	S	.	.	H	α-helix	trans	-87.7	-20.7	173.7	53	0	0	0	0	113.4	L743 N744 Y745	L743-T747 HydrophobicContact CD1-CG2 4.06Å; L743-T747 HydrophobicContact CG-CG2 4.33Å; L743-T747 WeakPolarHBondContact O-CG2 3.26Å; L743-T747 PolarHBondContact O-N 3.43Å; L743-T747 PolarHBondContact O-OG1 3.45Å; L743-T747 VanDerWaalsContact O-OG1 3.08Å; N744-T747 WeakPolarHBondContact CA-OG1 3.41Å; N744-T747 PolarHBondContact O-OG1 3.24Å; Y745-T747 PolarHBondContact O-N 3.03Å
748	A	70.1	Confident	84.1	Confident	88 Å²	88	55.3 Å²	55.3	73%	0.727	31%	0.312	S	S	*	.	H	α-helix	trans	-88.8	-16.9	178	0	0	0	0	0	113.3	N744 Y745	N744-A748 VanDerWaalsContact O-CB 3.27Å; N744-A748 WeakPolarHBondContact O-CB 3.35Å; N744-A748 PolarHBondContact O-N 2.76Å; N744-A748 VanDerWaalsContact O-N 3.13Å; Y745-A748 PolarHBondContact O-N 3.01Å; Y745-A748 VanDerWaalsContact O-N 3.11Å
749	T	57.2	Low	83.5	Confident	107 Å²	107	55.6 Å²	55.6	66%	0.656	32%	0.319	S	S	*	.			trans	-103.1	0	174	37.1	0	0	0	0	110.4	Y745	Y745-T749 HydrophobicContact CE2-CG2 4.49Å; Y745-T749 PolarHBondContact O-N 2.85Å; Y745-T749 VanDerWaalsContact O-N 3.13Å; Y745-T749 PolarHBondContact O-OG1 2.74Å

Retrieved 749 of 749 residues in 597 ms (Link to these results)

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