A0A5K4FFH8_SCHMA Loading...

Huntingtin

AlphaFold DB , UniProt , Accession A0A5K4FFH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 371 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	31.8	Very low	32.6	Very low	68 Å²	68	63.5 Å²	63.5	34%	0.335	32%	0.321	S	S	.	.				0	124.2	0	-127.8	163.9	-168	0	0	108.9	K218 Q312 L320	M1-K218 WeakPolarHBondContact O-CD 3.45Å; M1-K218 WeakPolarHBondContact O-CE 3.46Å; M1-K218 PolarHBondContact O-NZ 2.94Å; M1-Q312 VanDerWaalsContact CG-NE2 3.31Å; M1-L320 VanDerWaalsContact N-CD1 3.32Å
2	F	33.5	Very low	32.8	Very low	17 Å²	17	58.9 Å²	58.9	8%	0.075	30%	0.299	C	S	.	.			trans	-49.4	155.9	157.1	-82.3	-85.6	0	0	0	109.1	K4 I6 F8 H324	F2-K4 PolarHBondContact O-N 3.07Å; F2-I6 HydrophobicContact CB-CB 4.33Å; F2-I6 WeakPolarHBondContact CB-O 3.45Å; F2-I6 HydrophobicContact CD1-CB 3.85Å; F2-I6 HydrophobicContact CD1-CG2 3.99Å; F2-I6 WeakPolarHBondContact CD1-O 3.21Å; F2-I6 WeakPolarHBondContact CD2-O 3.37Å; F2-I6 HydrophobicContact CE1-CB 4.34Å; F2-I6 HydrophobicContact CE1-CG2 3.95Å; F2-I6 WeakPolarHBondContact CE2-O 3.5Å; F2-I6 HydrophobicContact CG-CB 4.25Å; F2-I6 WeakPolarHBondContact CG-O 3.46Å; F2-I6 HydrophobicContact CZ-CG2 4.48Å; F2-F8 HydrophobicContact CE2-CB 3.93Å; F2-F8 AromaticContact CE2-CD2 4Å; F2-F8 HydrophobicContact CE2-CD2 4Å; F2-F8 HydrophobicContact CE2-CG 4.44Å; F2-F8 HydrophobicContact CZ-CB 4.38Å; F2-F8 AromaticContact CZ-CD2 3.72Å; F2-F8 HydrophobicContact CZ-CD2 3.72Å; F2-H324 AromaticContact CD1-CE1 3.92Å; F2-H324 AromaticContact CD2-CE1 3.18Å; F2-H324 WeakPolarHBondContact CD2-CE1 3.45Å; F2-H324 AromaticContact CD2-ND1 4Å; F2-H324 AromaticContact CD2-NE2 3.26Å; F2-H324 VanDerWaalsContact CD2-NE2 3.26Å; F2-H324 WeakPolarHBondContact CD2-NE2 3.12Å; F2-H324 AromaticContact CE1-CE1 3.72Å; F2-H324 AromaticContact CE1-CG 3.96Å; F2-H324 AromaticContact CE1-ND1 3.54Å; F2-H324 AromaticContact CE2-CD2 3.21Å; F2-H324 WeakPolarHBondContact CE2-CD2 3.27Å; F2-H324 AromaticContact CE2-CE1 3.03Å; F2-H324 WeakPolarHBondContact CE2-CE1 3.43Å; F2-H324 AromaticContact CE2-CG 3.69Å; F2-H324 AromaticContact CE2-ND1 3.56Å; F2-H324 AromaticContact CE2-NE2 2.8Å; F2-H324 WeakPolarHBondContact CE2-NE2 3.41Å; F2-H324 AromaticContact CG-CE1 3.66Å; F2-H324 HydrophobicContact CZ-CB 4.2Å; F2-H324 AromaticContact CZ-CD2 3.3Å; F2-H324 WeakPolarHBondContact CZ-CD2 2.96Å; F2-H324 AromaticContact CZ-CE1 3.28Å; F2-H324 WeakPolarHBondContact CZ-CE1 3.29Å; F2-H324 AromaticContact CZ-CG 3.3Å; F2-H324 AromaticContact CZ-ND1 3.26Å; F2-H324 VanDerWaalsContact CZ-ND1 3.26Å; F2-H324 WeakPolarHBondContact CZ-ND1 3.17Å; F2-H324 AromaticContact CZ-NE2 3.34Å; F2-H324 VanDerWaalsContact CZ-NE2 3.34Å; F2-H324 WeakPolarHBondContact CZ-NE2 3.49Å
3	P	35.6	Very low	33.2	Very low	10 Å²	10	59.8 Å²	59.8	7%	0.065	30%	0.296	C	S	.	.			trans	-46.2	129.6	160.2	20.9	-27.9	0	0	0	105.7	G5 I6 A181 H182 K218	P3-G5 PolarHBondContact O-N 3.45Å; P3-I6 HydrophobicContact CG-CD1 4.31Å; P3-I6 PolarHBondContact O-N 3.24Å; P3-A181 HydrophobicContact CB-CB 3.98Å; P3-A181 HydrophobicContact CG-CB 4.46Å; P3-H182 WeakPolarHBondContact CB-CE1 3.25Å; P3-H182 WeakPolarHBondContact CB-ND1 3.17Å; P3-K218 VanDerWaalsContact N-NZ 3.11Å
4	K	33.4	Very low	33.3	Very low	116 Å²	116	66.5 Å²	66.5	50%	0.504	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46	2.5	-170.4	-84.4	-177.1	172.5	-177.9	0	117.4	F2 H182	F2-K4 PolarHBondContact O-N 3.07Å; K4-H182 PolarHBondContact N-CE1 3.11Å
5	G	30.6	Very low	33.4	Very low	18 Å²	18	66.1 Å²	66.1	19%	0.186	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-3.8	172.3	0	0	0	0	0	118.3	P3	P3-G5 PolarHBondContact O-N 3.45Å
6	I	35.5	Very low	33.6	Very low	11 Å²	11	64.6 Å²	64.6	6%	0.056	32%	0.324	C	S	.	.			trans	-123.8	63.5	-179.6	-49.8	170.9	0	0	0	109.9	F2 P3 F8 F185 W359	F2-I6 HydrophobicContact CB-CB 4.33Å; F2-I6 WeakPolarHBondContact CB-O 3.45Å; F2-I6 HydrophobicContact CD1-CB 3.85Å; F2-I6 HydrophobicContact CD1-CG2 3.99Å; F2-I6 WeakPolarHBondContact CD1-O 3.21Å; F2-I6 WeakPolarHBondContact CD2-O 3.37Å; F2-I6 HydrophobicContact CE1-CB 4.34Å; F2-I6 HydrophobicContact CE1-CG2 3.95Å; F2-I6 WeakPolarHBondContact CE2-O 3.5Å; F2-I6 HydrophobicContact CG-CB 4.25Å; F2-I6 WeakPolarHBondContact CG-O 3.46Å; F2-I6 HydrophobicContact CZ-CG2 4.48Å; P3-I6 HydrophobicContact CG-CD1 4.31Å; P3-I6 PolarHBondContact O-N 3.24Å; I6-F8 HydrophobicContact CG2-CD2 4.29Å; I6-F8 HydrophobicContact CG2-CE2 3.92Å; I6-F8 PolarHBondContact O-N 3.43Å; I6-F185 HydrophobicContact CD1-CE2 3.82Å; I6-W359 HydrophobicContact CD1-CE3 4.11Å; I6-W359 HydrophobicContact CD1-CH2 3.48Å; I6-W359 VanDerWaalsContact CD1-CH2 3.48Å; I6-W359 HydrophobicContact CD1-CZ2 4.22Å; I6-W359 HydrophobicContact CD1-CZ3 3.43Å; I6-W359 VanDerWaalsContact CD1-CZ3 3.43Å; I6-W359 HydrophobicContact CG1-CH2 3.63Å; I6-W359 HydrophobicContact CG1-CZ2 3.87Å; I6-W359 HydrophobicContact CG1-CZ3 4.01Å; I6-W359 HydrophobicContact CG2-CD2 3.77Å; I6-W359 HydrophobicContact CG2-CE3 3.98Å; I6-W359 HydrophobicContact CG2-CG 4.29Å; I6-W359 HydrophobicContact CG2-CH2 4.34Å; I6-W359 HydrophobicContact CG2-CZ2 4.14Å; I6-W359 HydrophobicContact CG2-CZ3 4.27Å
7	Q	32.2	Very low	33.8	Very low	83 Å²	83	64 Å²	64	39%	0.388	32%	0.324	S	S	.	.			trans	-84.1	106.8	-175.4	-65.4	-174	28.9	0	0	111.5	P12	Q7-P12 HydrophobicContact CB-CB 3.65Å; Q7-P12 HydrophobicContact CB-CG 3.5Å; Q7-P12 VanDerWaalsContact CB-CG 3.5Å; Q7-P12 HydrophobicContact CG-CB 4.35Å; Q7-P12 WeakPolarHBondContact O-CG 3.44Å
8	F	32.4	Very low	34.1	Very low	22 Å²	22	65.1 Å²	65.1	10%	0.096	33%	0.328	C	S	.	.			trans	-95	142.4	153.9	-64.9	-66.8	0	0	0	109.1	F2 I6 S355 V356 W359	F2-F8 HydrophobicContact CE2-CB 3.93Å; F2-F8 AromaticContact CE2-CD2 4Å; F2-F8 HydrophobicContact CE2-CD2 4Å; F2-F8 HydrophobicContact CE2-CG 4.44Å; F2-F8 HydrophobicContact CZ-CB 4.38Å; F2-F8 AromaticContact CZ-CD2 3.72Å; F2-F8 HydrophobicContact CZ-CD2 3.72Å; I6-F8 HydrophobicContact CG2-CD2 4.29Å; I6-F8 HydrophobicContact CG2-CE2 3.92Å; I6-F8 PolarHBondContact O-N 3.43Å; F8-S355 VanDerWaalsContact CE1-C 3.41Å; F8-S355 WeakPolarHBondContact CE1-OG 3.47Å; F8-S355 VanDerWaalsContact CZ-C 3.41Å; F8-S355 WeakPolarHBondContact CZ-O 3.46Å; F8-V356 HydrophobicContact CB-CG2 4.32Å; F8-V356 HydrophobicContact CD1-CB 4.11Å; F8-V356 HydrophobicContact CD1-CG2 3.09Å; F8-V356 HydrophobicContact CD2-CG2 4.47Å; F8-V356 HydrophobicContact CE1-CB 3.9Å; F8-V356 HydrophobicContact CE1-CG2 3.34Å; F8-V356 HydrophobicContact CG-CG2 3.71Å; F8-V356 HydrophobicContact CZ-CB 4.31Å; F8-V356 HydrophobicContact CZ-CG2 4.13Å; F8-W359 HydrophobicContact CE2-CB 3.56Å; F8-W359 AromaticContact CE2-CD1 3.78Å; F8-W359 AromaticContact CE2-CG 3.63Å; F8-W359 HydrophobicContact CE2-CG 3.63Å; F8-W359 HydrophobicContact CZ-CB 3.67Å; F8-W359 AromaticContact CZ-CD1 3.34Å; F8-W359 AromaticContact CZ-CG 3.63Å; F8-W359 HydrophobicContact CZ-CG 3.63Å
9	A	32.9	Very low	34.4	Very low	41 Å²	41	66.2 Å²	66.2	34%	0.339	33%	0.334	S	S	.	.	S	Bend	trans	94	0.7	174.7	0	0	0	0	0	121.1
10	N	29.6	Very low	34.7	Very low	128 Å²	128	64.1 Å²	64.1	68%	0.684	32%	0.324	S	S	*	.	S	Bend	trans	-148.3	89.2	171.8	-88.7	-41.8	0	0	0	114.4	P12	N10-P12 WeakPolarHBondContact O-CA 3.12Å; N10-P12 WeakPolarHBondContact O-CB 3.4Å; N10-P12 WeakPolarHBondContact O-CD 3.5Å; N10-P12 WeakPolarHBondContact O-CG 3.48Å
11	K	31.2	Very low	35.1	Very low	185 Å²	185	65.1 Å²	65.1	80%	0.804	33%	0.327	S	S	*	.			trans	28.2	42.7	169	-67.8	-174.1	174.5	179.5	0	116.6	W13 C15	K11-W13 PolarHBondContact O-N 3.2Å; K11-C15 WeakPolarHBondContact O-CB 3.38Å; K11-C15 PolarHBondContact O-N 2.92Å
12	P	35.2	Very low	35.6	Very low	8 Å²	8	66.4 Å²	66.4	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-82.5	-29.5	-151.1	-1.7	15.4	0	0	0	111.6	Q7 N10 C15 V16	Q7-P12 HydrophobicContact CB-CB 3.65Å; Q7-P12 HydrophobicContact CB-CG 3.5Å; Q7-P12 VanDerWaalsContact CB-CG 3.5Å; Q7-P12 HydrophobicContact CG-CB 4.35Å; Q7-P12 WeakPolarHBondContact O-CG 3.44Å; N10-P12 WeakPolarHBondContact O-CA 3.12Å; N10-P12 WeakPolarHBondContact O-CB 3.4Å; N10-P12 WeakPolarHBondContact O-CD 3.5Å; N10-P12 WeakPolarHBondContact O-CG 3.48Å; P12-C15 CarbonylContact O-C 3.59Å; P12-C15 PolarHBondContact O-N 3.28Å; P12-V16 WeakPolarHBondContact O-CA 3.41Å; P12-V16 WeakPolarHBondContact O-CB 3.29Å; P12-V16 WeakPolarHBondContact O-CG2 3.38Å; P12-V16 PolarHBondContact O-N 3.14Å
13	W	37.5	Very low	36	Very low	70 Å²	70	68.9 Å²	68.9	27%	0.265	35%	0.346	S	S	.	.	H	α-helix	trans	-81.8	-36	-173.5	-72.3	112.3	0	0	0	113.8	K11 C15 V16 V17 I109	K11-W13 PolarHBondContact O-N 3.2Å; W13-C15 VanDerWaalsContact C-N 3.26Å; W13-C15 PolarHBondContact O-N 3.35Å; W13-V16 HydrophobicContact CE3-CB 3.9Å; W13-V16 HydrophobicContact CE3-CG1 3.75Å; W13-V16 HydrophobicContact CZ3-CB 4.21Å; W13-V16 HydrophobicContact CZ3-CG1 3.58Å; W13-V16 PolarHBondContact O-N 3.09Å; W13-V17 WeakPolarHBondContact O-CA 3.39Å; W13-V17 WeakPolarHBondContact O-CB 3.03Å; W13-V17 WeakPolarHBondContact O-CG2 3.5Å; W13-V17 PolarHBondContact O-N 2.93Å; W13-I109 HydrophobicContact CH2-CD1 4.13Å; W13-I109 HydrophobicContact CZ3-CD1 4.29Å
14	K	34.2	Very low	36.1	Very low	154 Å²	154	71.8 Å²	71.8	67%	0.67	36%	0.36	S	S	*	.	H	α-helix	trans	-62.4	-41.6	167.7	-152.3	-168.9	-174.8	-157.8	0	109.9	E18	K14-E18 VanDerWaalsContact CD-OE1 3.31Å; K14-E18 WeakPolarHBondContact CD-OE1 3.48Å; K14-E18 WeakPolarHBondContact CE-OE1 3.26Å; K14-E18 HydrophobicContact CG-CG 4.29Å; K14-E18 WeakPolarHBondContact CG-OE1 3.4Å; K14-E18 IonicContact NZ-OE1 2.92Å; K14-E18 PolarHBondContact NZ-OE1 3.12Å; K14-E18 WeakPolarHBondContact O-CA 3.26Å; K14-E18 WeakPolarHBondContact O-CB 3.18Å; K14-E18 WeakPolarHBondContact O-CG 3.28Å; K14-E18 PolarHBondContact O-N 3.34Å
15	C	34.7	Very low	36.6	Very low	61 Å²	61	72.2 Å²	72.2	41%	0.412	37%	0.369	S	S	.	.	H	α-helix	trans	-71	-31.1	177.5	-164.4	0	0	0	0	113.5	K11 P12 W13 L19	K11-C15 WeakPolarHBondContact O-CB 3.38Å; K11-C15 PolarHBondContact O-N 2.92Å; P12-C15 CarbonylContact O-C 3.59Å; P12-C15 PolarHBondContact O-N 3.28Å; W13-C15 VanDerWaalsContact C-N 3.26Å; W13-C15 PolarHBondContact O-N 3.35Å; C15-L19 WeakPolarHBondContact O-CA 3.27Å; C15-L19 WeakPolarHBondContact O-CB 3.33Å; C15-L19 WeakPolarHBondContact O-CD1 3.28Å; C15-L19 PolarHBondContact O-N 3.46Å
16	V	37	Very low	37.1	Very low	42 Å²	42	78.4 Å²	78.4	26%	0.255	39%	0.392	S	S	.	.	H	α-helix	trans	-79	-43.2	177.1	165.6	0	0	0	0	109.2	P12 W13 L19 L20	P12-V16 WeakPolarHBondContact O-CA 3.41Å; P12-V16 WeakPolarHBondContact O-CB 3.29Å; P12-V16 WeakPolarHBondContact O-CG2 3.38Å; P12-V16 PolarHBondContact O-N 3.14Å; W13-V16 HydrophobicContact CE3-CB 3.9Å; W13-V16 HydrophobicContact CE3-CG1 3.75Å; W13-V16 HydrophobicContact CZ3-CB 4.21Å; W13-V16 HydrophobicContact CZ3-CG1 3.58Å; W13-V16 PolarHBondContact O-N 3.09Å; V16-L19 CarbonylContact O-C 3.47Å; V16-L19 PolarHBondContact O-N 3.42Å; V16-L20 HydrophobicContact CG1-CD1 3.59Å; V16-L20 HydrophobicContact CG1-CG 4.08Å; V16-L20 WeakPolarHBondContact O-CA 3.32Å; V16-L20 WeakPolarHBondContact O-CB 3.44Å; V16-L20 WeakPolarHBondContact O-CD1 3.36Å; V16-L20 WeakPolarHBondContact O-CG 3.24Å; V16-L20 PolarHBondContact O-N 2.98Å
17	V	37.1	Very low	37.1	Very low	54 Å²	54	83.7 Å²	83.7	33%	0.327	42%	0.416	S	S	.	.	H	α-helix	trans	-65.4	-40.4	171.8	175.4	0	0	0	0	110.2	W13 L20 H21	W13-V17 WeakPolarHBondContact O-CA 3.39Å; W13-V17 WeakPolarHBondContact O-CB 3.03Å; W13-V17 WeakPolarHBondContact O-CG2 3.5Å; W13-V17 PolarHBondContact O-N 2.93Å; V17-L20 CarbonylContact O-C 3.23Å; V17-L20 PolarHBondContact O-N 3.47Å; V17-H21 WeakPolarHBondContact CG1-ND1 3.42Å; V17-H21 VanDerWaalsContact O-CB 3.28Å; V17-H21 WeakPolarHBondContact O-CB 3.44Å; V17-H21 PolarHBondContact O-N 3.14Å; V17-H21 PolarHBondContact O-ND1 3.45Å
18	E	39.6	Very low	37.5	Very low	84 Å²	84	85 Å²	85	39%	0.393	43%	0.432	S	S	.	.	H	α-helix	trans	-68.5	-39.5	172	-75.4	169.3	178.4	0	0	110.9	K14 L20 H21 Q22	K14-E18 VanDerWaalsContact CD-OE1 3.31Å; K14-E18 WeakPolarHBondContact CD-OE1 3.48Å; K14-E18 WeakPolarHBondContact CE-OE1 3.26Å; K14-E18 HydrophobicContact CG-CG 4.29Å; K14-E18 WeakPolarHBondContact CG-OE1 3.4Å; K14-E18 IonicContact NZ-OE1 2.92Å; K14-E18 PolarHBondContact NZ-OE1 3.12Å; K14-E18 WeakPolarHBondContact O-CA 3.26Å; K14-E18 WeakPolarHBondContact O-CB 3.18Å; K14-E18 WeakPolarHBondContact O-CG 3.28Å; K14-E18 PolarHBondContact O-N 3.34Å; E18-L20 VanDerWaalsContact C-N 3.28Å; E18-L20 PolarHBondContact O-N 3.27Å; E18-H21 CarbonylContact O-C 3.58Å; E18-H21 PolarHBondContact O-N 2.9Å; E18-Q22 WeakPolarHBondContact O-CA 3.28Å; E18-Q22 WeakPolarHBondContact O-CB 3.5Å; E18-Q22 WeakPolarHBondContact O-CG 3.24Å; E18-Q22 PolarHBondContact O-N 3.43Å
19	L	39	Very low	37.9	Very low	85 Å²	85	87.4 Å²	87.4	45%	0.445	45%	0.445	S	S	.	.	H	α-helix	trans	-66.3	-35.1	172.9	-119	91.5	0	0	0	109.9	C15 V16 Q22 I23	C15-L19 WeakPolarHBondContact O-CA 3.27Å; C15-L19 WeakPolarHBondContact O-CB 3.33Å; C15-L19 WeakPolarHBondContact O-CD1 3.28Å; C15-L19 PolarHBondContact O-N 3.46Å; V16-L19 CarbonylContact O-C 3.47Å; V16-L19 PolarHBondContact O-N 3.42Å; L19-Q22 CarbonylContact O-C 3.59Å; L19-Q22 WeakPolarHBondContact O-CB 3.33Å; L19-Q22 PolarHBondContact O-N 3.44Å; L19-I23 WeakPolarHBondContact O-CA 3.47Å; L19-I23 VanDerWaalsContact O-CB 3.28Å; L19-I23 WeakPolarHBondContact O-CB 3.27Å; L19-I23 WeakPolarHBondContact O-CD1 3.44Å; L19-I23 WeakPolarHBondContact O-CG1 3.48Å; L19-I23 PolarHBondContact O-N 2.93Å
20	L	41.6	Very low	38.4	Very low	25 Å²	25	89.2 Å²	89.2	13%	0.131	45%	0.452	C	S	.	.	H	α-helix	trans	-75.3	-37.6	179.8	-77.7	167.3	0	0	0	110	V16 V17 E18 Q22 I23 L24 L89	V16-L20 HydrophobicContact CG1-CD1 3.59Å; V16-L20 HydrophobicContact CG1-CG 4.08Å; V16-L20 WeakPolarHBondContact O-CA 3.32Å; V16-L20 WeakPolarHBondContact O-CB 3.44Å; V16-L20 WeakPolarHBondContact O-CD1 3.36Å; V16-L20 WeakPolarHBondContact O-CG 3.24Å; V16-L20 PolarHBondContact O-N 2.98Å; V17-L20 CarbonylContact O-C 3.23Å; V17-L20 PolarHBondContact O-N 3.47Å; E18-L20 VanDerWaalsContact C-N 3.28Å; E18-L20 PolarHBondContact O-N 3.27Å; L20-Q22 VanDerWaalsContact C-N 3.35Å; L20-I23 HydrophobicContact CD2-CD1 4.41Å; L20-I23 CarbonylContact O-C 3.59Å; L20-I23 PolarHBondContact O-N 3.49Å; L20-L24 WeakPolarHBondContact O-CB 3.46Å; L20-L24 WeakPolarHBondContact O-CG 3.42Å; L20-L24 PolarHBondContact O-N 3.33Å; L20-L89 HydrophobicContact CD2-CD1 3.91Å; L20-L89 HydrophobicContact CD2-CD2 4.11Å
21	H	42.7	Very low	38.9	Very low	85 Å²	85	87 Å²	87	39%	0.394	45%	0.447	S	S	.	.	H	α-helix	trans	-67.1	-38.5	167.8	-83	72.3	0	0	0	110.2	V17 E18 L24 N25	V17-H21 WeakPolarHBondContact CG1-ND1 3.42Å; V17-H21 VanDerWaalsContact O-CB 3.28Å; V17-H21 WeakPolarHBondContact O-CB 3.44Å; V17-H21 PolarHBondContact O-N 3.14Å; V17-H21 PolarHBondContact O-ND1 3.45Å; E18-H21 CarbonylContact O-C 3.58Å; E18-H21 PolarHBondContact O-N 2.9Å; H21-L24 CarbonylContact O-C 3.57Å; H21-L24 WeakPolarHBondContact O-CB 3.2Å; H21-L24 PolarHBondContact O-N 3.44Å; H21-N25 WeakPolarHBondContact O-CB 3.4Å; H21-N25 PolarHBondContact O-N 2.86Å; H21-N25 PolarHBondContact O-ND2 2.66Å; H21-N25 PolarHBondContact O-OD1 2.85Å
22	Q	41.8	Very low	39.6	Very low	96 Å²	96	78.6 Å²	78.6	45%	0.449	41%	0.411	S	S	.	.	H	α-helix	trans	-66.7	-38.7	173	-77.2	168.6	11.3	0	0	110.3	E18 L19 L20 N25 H26	E18-Q22 WeakPolarHBondContact O-CA 3.28Å; E18-Q22 WeakPolarHBondContact O-CB 3.5Å; E18-Q22 WeakPolarHBondContact O-CG 3.24Å; E18-Q22 PolarHBondContact O-N 3.43Å; L19-Q22 CarbonylContact O-C 3.59Å; L19-Q22 WeakPolarHBondContact O-CB 3.33Å; L19-Q22 PolarHBondContact O-N 3.44Å; L20-Q22 VanDerWaalsContact C-N 3.35Å; Q22-N25 CarbonylContact O-C 3.48Å; Q22-N25 PolarHBondContact O-N 2.88Å; Q22-H26 WeakPolarHBondContact O-CA 3.47Å; Q22-H26 WeakPolarHBondContact O-CB 3.26Å; Q22-H26 PolarHBondContact O-N 3.46Å; Q22-H26 PolarHBondContact O-ND1 3.43Å
23	I	41.1	Very low	40.1	Very low	68 Å²	68	82.8 Å²	82.8	35%	0.349	44%	0.44	S	S	.	.	H	α-helix	trans	-65.4	-47.1	173.1	-73.9	159.9	0	0	0	108.4	L19 L20 N25 H26 H27	L19-I23 WeakPolarHBondContact O-CA 3.47Å; L19-I23 VanDerWaalsContact O-CB 3.28Å; L19-I23 WeakPolarHBondContact O-CB 3.27Å; L19-I23 WeakPolarHBondContact O-CD1 3.44Å; L19-I23 WeakPolarHBondContact O-CG1 3.48Å; L19-I23 PolarHBondContact O-N 2.93Å; L20-I23 HydrophobicContact CD2-CD1 4.41Å; L20-I23 CarbonylContact O-C 3.59Å; L20-I23 PolarHBondContact O-N 3.49Å; I23-N25 PolarHBondContact O-N 3.31Å; I23-H26 PolarHBondContact O-N 2.96Å; I23-H27 HydrophobicContact CG2-CB 4.16Å; I23-H27 CarbonylContact O-C 3.37Å; I23-H27 VanDerWaalsContact O-CA 3.28Å; I23-H27 WeakPolarHBondContact O-CA 3.49Å; I23-H27 WeakPolarHBondContact O-CB 3.23Å; I23-H27 PolarHBondContact O-N 3.14Å
24	L	39.4	Very low	40.4	Very low	71 Å²	71	82.8 Å²	82.8	37%	0.372	46%	0.461	S	S	.	.	H	α-helix	trans	-55	-37.6	171.8	-85.9	158.2	0	0	0	112	L20 H21 I29	L20-L24 WeakPolarHBondContact O-CB 3.46Å; L20-L24 WeakPolarHBondContact O-CG 3.42Å; L20-L24 PolarHBondContact O-N 3.33Å; H21-L24 CarbonylContact O-C 3.57Å; H21-L24 WeakPolarHBondContact O-CB 3.2Å; H21-L24 PolarHBondContact O-N 3.44Å; L24-I29 HydrophobicContact CD2-CD1 3.76Å; L24-I29 HydrophobicContact CD2-CG1 3.94Å
25	N	43.7	Very low	41	Very low	126 Å²	126	81 Å²	81	67%	0.674	46%	0.463	S	S	*	.	H	α-helix	trans	-86.5	-29.7	-176.7	-69.4	-17.7	0	0	0	113.8	H21 Q22 I23	H21-N25 WeakPolarHBondContact O-CB 3.4Å; H21-N25 PolarHBondContact O-N 2.86Å; H21-N25 PolarHBondContact O-ND2 2.66Å; H21-N25 PolarHBondContact O-OD1 2.85Å; Q22-N25 CarbonylContact O-C 3.48Å; Q22-N25 PolarHBondContact O-N 2.88Å; I23-N25 PolarHBondContact O-N 3.31Å
26	H	40.1	Very low	42	Very low	147 Å²	147	80.7 Å²	80.7	68%	0.681	46%	0.456	S	S	*	.	H	α-helix	trans	-112.9	-26.2	-171	-68.6	63.3	0	0	0	113.1	Q22 I23	Q22-H26 WeakPolarHBondContact O-CA 3.47Å; Q22-H26 WeakPolarHBondContact O-CB 3.26Å; Q22-H26 PolarHBondContact O-N 3.46Å; Q22-H26 PolarHBondContact O-ND1 3.43Å; I23-H26 PolarHBondContact O-N 2.96Å
27	H	36.6	Very low	43.3	Very low	122 Å²	122	83.1 Å²	83.1	57%	0.565	47%	0.467	S	S	*	.	S	Bend	trans	-104.9	120.3	166.3	-69.2	-64.6	0	0	0	107.5	I23 I29	I23-H27 HydrophobicContact CG2-CB 4.16Å; I23-H27 CarbonylContact O-C 3.37Å; I23-H27 VanDerWaalsContact O-CA 3.28Å; I23-H27 WeakPolarHBondContact O-CA 3.49Å; I23-H27 WeakPolarHBondContact O-CB 3.23Å; I23-H27 PolarHBondContact O-N 3.14Å; H27-I29 PolarHBondContact O-N 3.44Å
28	P	39.7	Very low	44.3	Very low	112 Å²	112	82.8 Å²	82.8	73%	0.727	47%	0.465	S	S	*	.			trans	-52.9	124.6	161.7	23.7	-29.6	0	0	0	105.4	V30	P28-V30 PolarHBondContact O-N 3.44Å
29	I	42.1	Very low	45.5	Very low	71 Å²	71	88.9 Å²	88.9	36%	0.364	49%	0.485	S	S	.	.			trans	-35.5	116.1	161.6	-65.7	171.2	0	0	0	104.3	L24 H27 S31 S90	L24-I29 HydrophobicContact CD2-CD1 3.76Å; L24-I29 HydrophobicContact CD2-CG1 3.94Å; H27-I29 PolarHBondContact O-N 3.44Å; I29-S31 PolarHBondContact O-N 3.33Å; I29-S90 WeakPolarHBondContact CG2-OG 3.01Å
30	V	42.2	Very low	46.9	Very low	80 Å²	80	87.8 Å²	87.8	49%	0.485	48%	0.484	S	S	.	.			trans	-46.8	116.2	-177.7	173.4	0	0	0	0	104.6	P28 L32	P28-V30 PolarHBondContact O-N 3.44Å; V30-L32 VanDerWaalsContact C-N 3.25Å; V30-L32 WeakPolarHBondContact O-CG 3.49Å; V30-L32 PolarHBondContact O-N 3.01Å
31	S	40.7	Very low	48.2	Very low	82 Å²	82	87 Å²	87	57%	0.573	48%	0.48	S	S	*	.			trans	-61.3	99.7	-171.5	-170.5	0	0	0	0	106.6	I29 S33	I29-S31 PolarHBondContact O-N 3.33Å; S31-S33 PolarHBondContact O-N 3.33Å; S31-S33 PolarHBondContact OG-OG 3.5Å
32	L	44.7	Very low	49.5	Very low	8 Å²	8	84.3 Å²	84.3	4%	0.042	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-63.2	-18.4	-175	-67.8	163.9	0	0	0	109.3	V30 G34 V35 H36 V38 M41 T83	V30-L32 VanDerWaalsContact C-N 3.25Å; V30-L32 WeakPolarHBondContact O-CG 3.49Å; V30-L32 PolarHBondContact O-N 3.01Å; L32-G34 PolarHBondContact O-N 2.84Å; L32-V35 PolarHBondContact O-N 3.16Å; L32-V35 VanDerWaalsContact O-N 3.08Å; L32-H36 CarbonylContact C-O 3.53Å; L32-H36 PolarHBondContact O-N 3.28Å; L32-H36 VanDerWaalsContact O-N 3.1Å; L32-V38 HydrophobicContact CB-CB 4.28Å; L32-V38 HydrophobicContact CB-CG1 4.35Å; L32-V38 HydrophobicContact CB-CG2 3.37Å; L32-V38 HydrophobicContact CD1-CG1 3.92Å; L32-V38 HydrophobicContact CD1-CG2 4.5Å; L32-M41 HydrophobicContact CB-CE 4.04Å; L32-M41 HydrophobicContact CD1-CE 3.78Å; L32-M41 HydrophobicContact CD2-CE 3.78Å; L32-M41 HydrophobicContact CG-CE 4.04Å; L32-T83 HydrophobicContact CD2-CG2 3.61Å
33	S	45.8	Very low	51	Low	96 Å²	96	85.8 Å²	85.8	67%	0.671	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-50.3	-16.6	179.3	71	0	0	0	0	116.3	S31	S31-S33 PolarHBondContact O-N 3.33Å; S31-S33 PolarHBondContact OG-OG 3.5Å
34	G	44.4	Very low	52.9	Low	69 Å²	69	84.2 Å²	84.2	71%	0.711	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-101.4	-20.3	179.3	0	0	0	0	0	116	L32	L32-G34 PolarHBondContact O-N 2.84Å
35	V	47.7	Very low	54.8	Low	117 Å²	117	80.8 Å²	80.8	71%	0.709	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-33.3	-166.9	-168.2	0	0	0	0	112.5	L32	L32-V35 PolarHBondContact O-N 3.16Å; L32-V35 VanDerWaalsContact O-N 3.08Å
36	H	55.1	Low	56.3	Low	55 Å²	55	79.4 Å²	79.4	26%	0.255	44%	0.438	S	S	.	.	S	Bend	trans	-141.1	143.3	-176.6	-65.8	-71.7	0	0	0	111	L32 V38 M41 T83	L32-H36 CarbonylContact C-O 3.53Å; L32-H36 PolarHBondContact O-N 3.28Å; L32-H36 VanDerWaalsContact O-N 3.1Å; H36-V38 PolarHBondContact O-N 3.28Å; H36-M41 HydrophobicContact CB-CE 3.33Å; H36-M41 HydrophobicContact CB-SD 3.93Å; H36-T83 VanDerWaalsContact CD2-CG2 3.43Å; H36-T83 WeakPolarHBondContact CD2-CG2 2.94Å
37	D	63.4	Low	58.1	Low	92 Å²	92	75.2 Å²	75.2	49%	0.492	42%	0.421	S	S	.	.			trans	-67.1	103.4	175.3	177.8	13.3	0	0	0	110.2	R39 S40 M41	D37-R39 PolarHBondContact O-N 3.4Å; D37-R39 WeakPolarHBondContact OD1-CB 3.21Å; D37-R39 PolarHBondContact OD1-N 2.92Å; D37-S40 PolarHBondContact O-N 3.46Å; D37-S40 VanDerWaalsContact O-N 3.14Å; D37-S40 PolarHBondContact OD1-N 3.38Å; D37-S40 VanDerWaalsContact OD2-CB 3.28Å; D37-S40 WeakPolarHBondContact OD2-CB 3.41Å; D37-S40 PolarHBondContact OD2-N 2.87Å; D37-S40 PolarHBondContact OD2-OG 3.45Å; D37-M41 PolarHBondContact O-N 3.46Å
38	V	58.8	Low	60.2	Low	48 Å²	48	69.4 Å²	69.4	29%	0.291	39%	0.394	S	S	.	.	H	α-helix	trans	-54.9	-42	179.4	-163.8	0	0	0	0	110.9	L32 H36 M41 T42	L32-V38 HydrophobicContact CB-CB 4.28Å; L32-V38 HydrophobicContact CB-CG1 4.35Å; L32-V38 HydrophobicContact CB-CG2 3.37Å; L32-V38 HydrophobicContact CD1-CG1 3.92Å; L32-V38 HydrophobicContact CD1-CG2 4.5Å; H36-V38 PolarHBondContact O-N 3.28Å; V38-M41 PolarHBondContact O-N 3Å; V38-T42 PolarHBondContact O-N 3.16Å; V38-T42 PolarHBondContact O-OG1 2.99Å; V38-T42 VanDerWaalsContact O-OG1 3.05Å
39	R	64.4	Low	61.9	Low	212 Å²	212	65 Å²	65	80%	0.8	36%	0.364	S	S	*	.	H	α-helix	trans	-65.4	-42.1	-179.2	-74.6	-177.9	175.7	174.5	-1	110.8	D37 T42 K43	D37-R39 PolarHBondContact O-N 3.4Å; D37-R39 WeakPolarHBondContact OD1-CB 3.21Å; D37-R39 PolarHBondContact OD1-N 2.92Å; R39-T42 PolarHBondContact O-N 3.46Å; R39-K43 WeakPolarHBondContact O-CB 3.48Å; R39-K43 PolarHBondContact O-N 2.96Å
40	S	68.3	Low	63.5	Low	62 Å²	62	66 Å²	66	43%	0.434	37%	0.374	S	S	.	.	H	α-helix	trans	-62.5	-42.6	175.1	-72.3	0	0	0	0	111.9	D37 K43 L44	D37-S40 PolarHBondContact O-N 3.46Å; D37-S40 VanDerWaalsContact O-N 3.14Å; D37-S40 PolarHBondContact OD1-N 3.38Å; D37-S40 VanDerWaalsContact OD2-CB 3.28Å; D37-S40 WeakPolarHBondContact OD2-CB 3.41Å; D37-S40 PolarHBondContact OD2-N 2.87Å; D37-S40 PolarHBondContact OD2-OG 3.45Å; S40-K43 PolarHBondContact O-N 2.92Å; S40-L44 WeakPolarHBondContact O-CG 3.33Å; S40-L44 PolarHBondContact O-N 3.04Å
41	M	70.5	Confident	65.2	Low	7 Å²	7	66.7 Å²	66.7	3%	0.034	37%	0.374	C	S	.	.	H	α-helix	trans	-67.9	-39.4	176.6	-70.6	-177.7	-70.9	0	0	112.9	L32 H36 D37 V38 K43 L44 W45 T83	L32-M41 HydrophobicContact CB-CE 4.04Å; L32-M41 HydrophobicContact CD1-CE 3.78Å; L32-M41 HydrophobicContact CD2-CE 3.78Å; L32-M41 HydrophobicContact CG-CE 4.04Å; H36-M41 HydrophobicContact CB-CE 3.33Å; H36-M41 HydrophobicContact CB-SD 3.93Å; D37-M41 PolarHBondContact O-N 3.46Å; V38-M41 PolarHBondContact O-N 3Å; M41-K43 VanDerWaalsContact C-N 3.29Å; M41-K43 PolarHBondContact O-N 2.93Å; M41-L44 WeakPolarHBondContact O-CB 3.36Å; M41-L44 PolarHBondContact O-N 3.43Å; M41-W45 PolarHBondContact O-N 2.86Å; M41-T83 HydrophobicContact SD-CG2 4.32Å
42	T	69.1	Low	67	Low	30 Å²	30	63.6 Å²	63.6	18%	0.184	35%	0.352	C	S	.	.	H	α-helix	trans	-58.4	-45.2	172.2	-61.5	0	0	0	0	110.6	V38 R39 L44 W45 E46 A91	V38-T42 PolarHBondContact O-N 3.16Å; V38-T42 PolarHBondContact O-OG1 2.99Å; V38-T42 VanDerWaalsContact O-OG1 3.05Å; R39-T42 PolarHBondContact O-N 3.46Å; T42-L44 PolarHBondContact O-N 3.25Å; T42-W45 WeakPolarHBondContact O-CB 3.38Å; T42-W45 PolarHBondContact O-N 3.32Å; T42-W45 VanDerWaalsContact O-N 3.12Å; T42-E46 WeakPolarHBondContact O-CG 3.4Å; T42-E46 PolarHBondContact O-N 3.05Å; T42-A91 HydrophobicContact CG2-CB 4.05Å
43	K	74.5	Confident	68.4	Low	126 Å²	126	65.7 Å²	65.7	55%	0.548	36%	0.361	S	S	.	.	H	α-helix	trans	-61.6	-42.1	176.7	-170	179.3	178.4	-174.5	0	112.3	R39 S40 M41 W45 E46 D47	R39-K43 WeakPolarHBondContact O-CB 3.48Å; R39-K43 PolarHBondContact O-N 2.96Å; S40-K43 PolarHBondContact O-N 2.92Å; M41-K43 VanDerWaalsContact C-N 3.29Å; M41-K43 PolarHBondContact O-N 2.93Å; K43-W45 PolarHBondContact O-N 3.47Å; K43-E46 PolarHBondContact O-N 3.49Å; K43-E46 VanDerWaalsContact O-N 3.16Å; K43-D47 WeakPolarHBondContact O-CB 3.41Å; K43-D47 PolarHBondContact O-N 3.17Å
44	L	79.1	Confident	70	Confident	35 Å²	35	65.6 Å²	65.6	18%	0.183	36%	0.358	C	S	.	.	H	α-helix	trans	-57.5	-40.3	174.1	-72.9	171.6	0	0	0	111.8	S40 M41 T42 D47 F48 F69 H73	S40-L44 WeakPolarHBondContact O-CG 3.33Å; S40-L44 PolarHBondContact O-N 3.04Å; M41-L44 WeakPolarHBondContact O-CB 3.36Å; M41-L44 PolarHBondContact O-N 3.43Å; T42-L44 PolarHBondContact O-N 3.25Å; L44-D47 PolarHBondContact O-N 3.37Å; L44-F48 WeakPolarHBondContact O-CB 3.22Å; L44-F48 PolarHBondContact O-N 3.21Å; L44-F69 HydrophobicContact CB-CZ 4.14Å; L44-F69 WeakPolarHBondContact O-CE2 3.37Å; L44-F69 WeakPolarHBondContact O-CZ 3.47Å; L44-H73 HydrophobicContact CD1-CB 4.04Å; L44-H73 HydrophobicContact CD2-CB 4.2Å; L44-H73 WeakPolarHBondContact CD2-ND1 3.43Å
45	W	79.2	Confident	71.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-71.2	-36.5	176.8	-72.2	124.2	0	0	0	113.1	M41 T42 K43 F48 I49 F69 L70 F74 S87 L88 A91 L93 L108 I112	M41-W45 PolarHBondContact O-N 2.86Å; T42-W45 WeakPolarHBondContact O-CB 3.38Å; T42-W45 PolarHBondContact O-N 3.32Å; T42-W45 VanDerWaalsContact O-N 3.12Å; K43-W45 PolarHBondContact O-N 3.47Å; W45-F48 HydrophobicContact CE3-CB 4.21Å; W45-F48 HydrophobicContact CE3-CD1 4.31Å; W45-F48 HydrophobicContact CE3-CG 4.25Å; W45-F48 HydrophobicContact CZ3-CG 4.44Å; W45-F48 WeakPolarHBondContact O-CB 3.47Å; W45-F48 PolarHBondContact O-N 2.81Å; W45-I49 WeakPolarHBondContact O-CG1 3.17Å; W45-I49 PolarHBondContact O-N 2.98Å; W45-F69 AromaticContact CE3-CE1 3.96Å; W45-F69 HydrophobicContact CE3-CE1 3.96Å; W45-F69 HydrophobicContact CE3-CZ 4.36Å; W45-F69 HydrophobicContact CH2-CE1 4.2Å; W45-F69 HydrophobicContact CZ3-CD1 4.42Å; W45-F69 AromaticContact CZ3-CE1 3.66Å; W45-F69 HydrophobicContact CZ3-CE1 3.66Å; W45-F69 HydrophobicContact CZ3-CZ 4.49Å; W45-L70 HydrophobicContact CH2-CD2 4.05Å; W45-F74 HydrophobicContact CD2-CZ 4.46Å; W45-F74 AromaticContact CE2-CZ 3.61Å; W45-F74 HydrophobicContact CH2-CE2 4.15Å; W45-F74 HydrophobicContact CH2-CZ 4.07Å; W45-F74 AromaticContact CZ2-CE1 3.98Å; W45-F74 HydrophobicContact CZ2-CE1 3.98Å; W45-F74 AromaticContact CZ2-CE2 3.95Å; W45-F74 HydrophobicContact CZ2-CE2 3.95Å; W45-F74 AromaticContact CZ2-CZ 3.4Å; W45-F74 HydrophobicContact CZ2-CZ 3.4Å; W45-F74 VanDerWaalsContact CZ2-CZ 3.4Å; W45-F74 AromaticContact NE1-CZ 3.82Å; W45-S87 PolarHBondContact NE1-OG 3.16Å; W45-L88 HydrophobicContact CD2-CB 4.26Å; W45-L88 HydrophobicContact CD2-CD1 3.59Å; W45-L88 HydrophobicContact CE3-CD1 3.53Å; W45-L88 HydrophobicContact CG-CD1 4.19Å; W45-L88 HydrophobicContact CH2-CB 4.39Å; W45-L88 HydrophobicContact CH2-CD1 4.11Å; W45-L88 HydrophobicContact CZ2-CB 3.77Å; W45-L88 HydrophobicContact CZ2-CD1 4.15Å; W45-L88 HydrophobicContact CZ2-CG 4.45Å; W45-L88 HydrophobicContact CZ3-CD1 3.81Å; W45-L88 VanDerWaalsContact NE1-N 3.14Å; W45-A91 HydrophobicContact CB-CB 3.88Å; W45-A91 HydrophobicContact CG-CB 4.23Å; W45-L93 HydrophobicContact CB-CD1 3.67Å; W45-L93 HydrophobicContact CB-CG 4.49Å; W45-L93 HydrophobicContact CG-CD1 4.4Å; W45-L108 HydrophobicContact CH2-CD1 4.34Å; W45-L108 HydrophobicContact CH2-CD2 4.49Å; W45-L108 HydrophobicContact CZ3-CD1 4.02Å; W45-L108 HydrophobicContact CZ3-CD2 3.93Å; W45-L108 HydrophobicContact CZ3-CG 4.45Å; W45-I112 HydrophobicContact CH2-CD1 3.74Å; W45-I112 HydrophobicContact CH2-CG1 4.32Å; W45-I112 HydrophobicContact CZ2-CD1 4.29Å
46	E	75.7	Confident	73	Confident	96 Å²	96	64.5 Å²	64.5	45%	0.449	32%	0.321	S	S	.	.	H	α-helix	trans	-63	-43.9	170.8	-69.7	173.5	169.4	0	0	111.3	T42 K43 F48 I49 T50	T42-E46 WeakPolarHBondContact O-CG 3.4Å; T42-E46 PolarHBondContact O-N 3.05Å; K43-E46 PolarHBondContact O-N 3.49Å; K43-E46 VanDerWaalsContact O-N 3.16Å; E46-F48 VanDerWaalsContact C-N 3.31Å; E46-F48 PolarHBondContact O-N 2.99Å; E46-I49 PolarHBondContact O-N 3.45Å; E46-T50 WeakPolarHBondContact O-CB 3.29Å; E46-T50 PolarHBondContact O-N 3.3Å; E46-T50 PolarHBondContact O-OG1 3.11Å
47	D	78.7	Confident	73.7	Confident	60 Å²	60	66.1 Å²	66.1	32%	0.321	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-39.7	175	-64.4	-18.2	0	0	0	110.3	K43 L44 I49 T50 D51	K43-D47 WeakPolarHBondContact O-CB 3.41Å; K43-D47 PolarHBondContact O-N 3.17Å; L44-D47 PolarHBondContact O-N 3.37Å; D47-I49 PolarHBondContact O-N 3.42Å; D47-T50 PolarHBondContact O-N 2.94Å; D47-D51 WeakPolarHBondContact O-CA 3.21Å; D47-D51 VanDerWaalsContact O-CB 3.27Å; D47-D51 WeakPolarHBondContact O-CB 3.29Å; D47-D51 PolarHBondContact O-N 3.42Å
48	F	80.7	Confident	73.9	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.34	C	S	.	.	I	π-helix	trans	-57.8	-48.2	172.3	172.4	-94.7	0	0	0	112.4	L44 W45 E46 T50 V52 K53 M56 M66 F69 L100 L108	L44-F48 WeakPolarHBondContact O-CB 3.22Å; L44-F48 PolarHBondContact O-N 3.21Å; W45-F48 HydrophobicContact CE3-CB 4.21Å; W45-F48 HydrophobicContact CE3-CD1 4.31Å; W45-F48 HydrophobicContact CE3-CG 4.25Å; W45-F48 HydrophobicContact CZ3-CG 4.44Å; W45-F48 WeakPolarHBondContact O-CB 3.47Å; W45-F48 PolarHBondContact O-N 2.81Å; E46-F48 VanDerWaalsContact C-N 3.31Å; E46-F48 PolarHBondContact O-N 2.99Å; F48-T50 VanDerWaalsContact C-N 3.32Å; F48-T50 PolarHBondContact O-N 3.42Å; F48-V52 HydrophobicContact CD2-CB 3.85Å; F48-V52 HydrophobicContact CD2-CG1 4.1Å; F48-V52 HydrophobicContact CD2-CG2 4.17Å; F48-V52 HydrophobicContact CE2-CB 4.25Å; F48-V52 HydrophobicContact CE2-CG1 4.12Å; F48-V52 HydrophobicContact CG-CB 4.44Å; F48-V52 CarbonylContact O-C 3.5Å; F48-V52 WeakPolarHBondContact O-CA 3.14Å; F48-V52 VanDerWaalsContact O-CB 3.27Å; F48-V52 WeakPolarHBondContact O-CB 3.4Å; F48-V52 PolarHBondContact O-N 3.34Å; F48-K53 PolarHBondContact O-N 3.16Å; F48-M56 HydrophobicContact CD2-CE 4.31Å; F48-M56 HydrophobicContact CE1-CE 4.45Å; F48-M56 HydrophobicContact CE2-CE 3.3Å; F48-M56 HydrophobicContact CZ-CE 3.39Å; F48-M56 HydrophobicContact CZ-SD 4.25Å; F48-M66 HydrophobicContact CE2-CG 3.88Å; F48-M66 HydrophobicContact CZ-CE 4.2Å; F48-M66 HydrophobicContact CZ-CG 3.98Å; F48-F69 HydrophobicContact CB-CD1 4.5Å; F48-F69 HydrophobicContact CB-CD2 4.27Å; F48-F69 HydrophobicContact CB-CE1 4Å; F48-F69 HydrophobicContact CB-CE2 3.76Å; F48-F69 HydrophobicContact CB-CZ 3.63Å; F48-F69 HydrophobicContact CD2-CB 4.4Å; F48-F69 AromaticContact CD2-CD1 3.7Å; F48-F69 HydrophobicContact CD2-CD1 3.7Å; F48-F69 HydrophobicContact CD2-CD2 4.15Å; F48-F69 AromaticContact CD2-CE1 3.97Å; F48-F69 HydrophobicContact CD2-CE1 3.97Å; F48-F69 HydrophobicContact CD2-CE2 4.41Å; F48-F69 AromaticContact CD2-CG 3.81Å; F48-F69 HydrophobicContact CD2-CG 3.81Å; F48-F69 HydrophobicContact CD2-CZ 4.35Å; F48-F69 HydrophobicContact CE2-CD1 4.39Å; F48-F69 HydrophobicContact CG-CD1 4.44Å; F48-F69 HydrophobicContact CG-CE1 4.26Å; F48-F69 HydrophobicContact CG-CZ 4.37Å; F48-L100 HydrophobicContact CE1-CD2 4.21Å; F48-L108 HydrophobicContact CE1-CD1 4.46Å; F48-L108 HydrophobicContact CE1-CD2 3.89Å; F48-L108 HydrophobicContact CE2-CD1 4.09Å; F48-L108 HydrophobicContact CZ-CD1 3.84Å; F48-L108 HydrophobicContact CZ-CD2 4.06Å; F48-L108 HydrophobicContact CZ-CG 4.44Å
49	I	74.2	Confident	74.1	Confident	19 Å²	19	64.5 Å²	64.5	10%	0.097	33%	0.332	C	S	.	.	I	π-helix	trans	-66.9	-35.6	179.4	-64.2	-62.4	0	0	0	111.7	W45 E46 D47 K53 P54 L93 E99 L100	W45-I49 WeakPolarHBondContact O-CG1 3.17Å; W45-I49 PolarHBondContact O-N 2.98Å; E46-I49 PolarHBondContact O-N 3.45Å; D47-I49 PolarHBondContact O-N 3.42Å; I49-K53 WeakPolarHBondContact O-CB 3.5Å; I49-P54 WeakPolarHBondContact O-CD 3.23Å; I49-L93 HydrophobicContact CD1-CD1 4.23Å; I49-L93 HydrophobicContact CG1-CD1 3.76Å; I49-L93 HydrophobicContact CG1-CD2 3.91Å; I49-L93 HydrophobicContact CG1-CG 4.42Å; I49-E99 HydrophobicContact CG2-CB 4.34Å; I49-L100 HydrophobicContact CD1-CD1 3.79Å; I49-L100 HydrophobicContact CD1-CD2 3.41Å; I49-L100 VanDerWaalsContact CD1-CD2 3.41Å; I49-L100 HydrophobicContact CD1-CG 3.46Å; I49-L100 VanDerWaalsContact CD1-CG 3.46Å
50	T	75.9	Confident	74.1	Confident	92 Å²	92	54.8 Å²	54.8	56%	0.564	30%	0.295	S	S	*	.	I	π-helix	trans	-82.5	-42.7	-174.8	-51.6	0	0	0	0	112	E46 D47 F48 P54	E46-T50 WeakPolarHBondContact O-CB 3.29Å; E46-T50 PolarHBondContact O-N 3.3Å; E46-T50 PolarHBondContact O-OG1 3.11Å; D47-T50 PolarHBondContact O-N 2.94Å; F48-T50 VanDerWaalsContact C-N 3.32Å; F48-T50 PolarHBondContact O-N 3.42Å; T50-P54 WeakPolarHBondContact O-CD 3.44Å; T50-P54 VanDerWaalsContact O-CG 3.29Å; T50-P54 WeakPolarHBondContact O-CG 3.26Å
51	D	77.9	Confident	74.1	Confident	94 Å²	94	54.7 Å²	54.7	50%	0.503	29%	0.292	S	S	.	.	I	π-helix	trans	-106.7	-31.2	-167.7	-61.8	-27.1	0	0	0	113.2	D47 R55	D47-D51 WeakPolarHBondContact O-CA 3.21Å; D47-D51 VanDerWaalsContact O-CB 3.27Å; D47-D51 WeakPolarHBondContact O-CB 3.29Å; D47-D51 PolarHBondContact O-N 3.42Å; D51-R55 WeakPolarHBondContact O-CD 3.38Å
52	V	78.3	Confident	74.1	Confident	17 Å²	17	54.4 Å²	54.4	10%	0.103	29%	0.291	C	S	.	.	I	π-helix	trans	-98.3	-51.4	-172.6	-166.4	0	0	0	0	110.3	F48 R55 M56 L65 F69	F48-V52 HydrophobicContact CD2-CB 3.85Å; F48-V52 HydrophobicContact CD2-CG1 4.1Å; F48-V52 HydrophobicContact CD2-CG2 4.17Å; F48-V52 HydrophobicContact CE2-CB 4.25Å; F48-V52 HydrophobicContact CE2-CG1 4.12Å; F48-V52 HydrophobicContact CG-CB 4.44Å; F48-V52 CarbonylContact O-C 3.5Å; F48-V52 WeakPolarHBondContact O-CA 3.14Å; F48-V52 VanDerWaalsContact O-CB 3.27Å; F48-V52 WeakPolarHBondContact O-CB 3.4Å; F48-V52 PolarHBondContact O-N 3.34Å; V52-R55 WeakPolarHBondContact O-CB 3.34Å; V52-R55 PolarHBondContact O-N 2.98Å; V52-R55 VanDerWaalsContact O-N 3.11Å; V52-M56 HydrophobicContact CB-CE 4.12Å; V52-M56 HydrophobicContact CG1-CE 3.38Å; V52-M56 WeakPolarHBondContact O-CG 3.49Å; V52-L65 HydrophobicContact CG1-CB 3.57Å; V52-L65 HydrophobicContact CG1-CD1 4.25Å; V52-L65 HydrophobicContact CG1-CG 4.45Å; V52-F69 HydrophobicContact CG2-CD2 4.06Å
53	K	75.1	Confident	74.1	Confident	53 Å²	53	53.3 Å²	53.3	23%	0.23	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-55.4	-44.8	-176.6	-169.6	-142.7	171.9	-170.6	0	113.8	F48 I49 R55 M56 E99 L100 T104	F48-K53 PolarHBondContact O-N 3.16Å; I49-K53 WeakPolarHBondContact O-CB 3.5Å; K53-R55 PolarHBondContact O-N 3.4Å; K53-M56 WeakPolarHBondContact O-CB 3.37Å; K53-M56 WeakPolarHBondContact O-CG 3.45Å; K53-M56 PolarHBondContact O-N 3.42Å; K53-E99 WeakPolarHBondContact CD-O 3.31Å; K53-E99 WeakPolarHBondContact CE-O 3.44Å; K53-E99 VanDerWaalsContact NZ-C 3.32Å; K53-E99 PolarHBondContact NZ-O 3.04Å; K53-L100 HydrophobicContact CD-CD2 4.15Å; K53-L100 HydrophobicContact CG-CD2 4.18Å; K53-T104 HydrophobicContact CG-CG2 4.43Å
54	P	78.2	Confident	74	Confident	94 Å²	94	49.7 Å²	49.7	61%	0.61	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-63.9	-19.6	-178	-24.4	38	0	0	0	113.4	I49 T50	I49-P54 WeakPolarHBondContact O-CD 3.23Å; T50-P54 WeakPolarHBondContact O-CD 3.44Å; T50-P54 VanDerWaalsContact O-CG 3.29Å; T50-P54 WeakPolarHBondContact O-CG 3.26Å
55	R	80	Confident	73.9	Confident	142 Å²	142	48.9 Å²	48.9	54%	0.536	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-88.3	-4.6	177.1	-46	-171.5	-34.8	-158.2	9.2	112.9	D51 V52 K53 A57 T61 L65	D51-R55 WeakPolarHBondContact O-CD 3.38Å; V52-R55 WeakPolarHBondContact O-CB 3.34Å; V52-R55 PolarHBondContact O-N 2.98Å; V52-R55 VanDerWaalsContact O-N 3.11Å; K53-R55 PolarHBondContact O-N 3.4Å; R55-A57 PolarHBondContact O-N 2.87Å; R55-T61 WeakPolarHBondContact O-CG2 3.47Å; R55-L65 HydrophobicContact CB-CD1 3.65Å
56	M	75.6	Confident	73.8	Confident	20 Å²	20	48.9 Å²	48.9	10%	0.099	26%	0.263	C	S	.	.			trans	-83.1	45.5	-177.5	-59.6	-170.3	176.4	0	0	112.8	F48 V52 K53 Q58 A62 L65 M66 T104	F48-M56 HydrophobicContact CD2-CE 4.31Å; F48-M56 HydrophobicContact CE1-CE 4.45Å; F48-M56 HydrophobicContact CE2-CE 3.3Å; F48-M56 HydrophobicContact CZ-CE 3.39Å; F48-M56 HydrophobicContact CZ-SD 4.25Å; V52-M56 HydrophobicContact CB-CE 4.12Å; V52-M56 HydrophobicContact CG1-CE 3.38Å; V52-M56 WeakPolarHBondContact O-CG 3.49Å; K53-M56 WeakPolarHBondContact O-CB 3.37Å; K53-M56 WeakPolarHBondContact O-CG 3.45Å; K53-M56 PolarHBondContact O-N 3.42Å; M56-Q58 PolarHBondContact O-N 3.28Å; M56-Q58 VanDerWaalsContact O-N 3.17Å; M56-A62 HydrophobicContact CB-CB 3.68Å; M56-A62 HydrophobicContact CG-CB 3.99Å; M56-A62 HydrophobicContact SD-CB 4Å; M56-L65 HydrophobicContact CE-CB 4.19Å; M56-L65 HydrophobicContact CG-CD1 4.32Å; M56-M66 HydrophobicContact CE-CE 3.93Å; M56-M66 HydrophobicContact CE-CG 3.54Å; M56-M66 HydrophobicContact SD-CE 3.45Å; M56-M66 WeakPolarHBondContact SD-CE 3.47Å; M56-M66 HydrophobicContact SD-CG 4.27Å; M56-T104 HydrophobicContact SD-CG2 4.07Å
57	A	70.6	Confident	73.9	Confident	89 Å²	89	46.7 Å²	46.7	74%	0.736	25%	0.251	S	S	*	.			trans	-65.4	-21	-176	0	0	0	0	0	113.7	R55	R55-A57 PolarHBondContact O-N 2.87Å
58	Q	66.9	Low	73.9	Confident	90 Å²	90	49.1 Å²	49.1	42%	0.421	26%	0.26	S	S	.	.	S	Bend	trans	-132.3	141.8	-174.1	-73.8	-74.2	-41.1	0	0	110.2	M56 L60 T61 A62	M56-Q58 PolarHBondContact O-N 3.28Å; M56-Q58 VanDerWaalsContact O-N 3.17Å; Q58-L60 VanDerWaalsContact C-N 3.27Å; Q58-L60 PolarHBondContact O-N 2.97Å; Q58-L60 VanDerWaalsContact O-N 3.1Å; Q58-T61 WeakPolarHBondContact O-CB 3.36Å; Q58-T61 PolarHBondContact O-N 2.84Å; Q58-A62 WeakPolarHBondContact O-CB 3.38Å; Q58-A62 PolarHBondContact O-N 3.4Å
59	P	63.5	Low	73.9	Confident	17 Å²	17	49.6 Å²	49.6	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-43.5	-45.5	179.3	-39.8	41.3	0	0	0	116.2	A62 Y63 Y103 F362	P59-A62 WeakPolarHBondContact O-CB 3.39Å; P59-Y63 WeakPolarHBondContact O-CB 3.35Å; P59-Y63 PolarHBondContact O-N 2.89Å; P59-Y103 WeakPolarHBondContact CA-OH 3.49Å; P59-Y103 WeakPolarHBondContact CB-OH 3.47Å; P59-Y103 HydrophobicContact CG-CE1 4.47Å; P59-F362 HydrophobicContact CB-CB 4.21Å; P59-F362 HydrophobicContact CB-CD2 3.59Å; P59-F362 HydrophobicContact CB-CE2 4.35Å; P59-F362 HydrophobicContact CB-CG 4.23Å
60	L	63.5	Low	74	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-73.8	-42.2	-178.1	-174.6	64.2	0	0	0	112.1	Q58 A62 Y63 K64 E141	Q58-L60 VanDerWaalsContact C-N 3.27Å; Q58-L60 PolarHBondContact O-N 2.97Å; Q58-L60 VanDerWaalsContact O-N 3.1Å; L60-A62 VanDerWaalsContact C-N 3.29Å; L60-A62 PolarHBondContact O-N 3.4Å; L60-Y63 PolarHBondContact O-N 2.9Å; L60-K64 WeakPolarHBondContact O-CB 3.48Å; L60-K64 WeakPolarHBondContact O-CG 3.32Å; L60-K64 PolarHBondContact O-N 2.89Å; L60-E141 WeakPolarHBondContact CD2-O 3.34Å
61	T	68.9	Low	74	Confident	61 Å²	61	46.9 Å²	46.9	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-60.3	-44.6	174.2	-50.6	0	0	0	0	109.6	R55 Q58 Y63 K64 L65	R55-T61 WeakPolarHBondContact O-CG2 3.47Å; Q58-T61 WeakPolarHBondContact O-CB 3.36Å; Q58-T61 PolarHBondContact O-N 2.84Å; T61-Y63 PolarHBondContact O-N 2.89Å; T61-K64 PolarHBondContact O-N 3.1Å; T61-L65 HydrophobicContact CG2-CD1 3.89Å; T61-L65 HydrophobicContact CG2-CG 4.13Å; T61-L65 VanDerWaalsContact O-CB 3.29Å; T61-L65 WeakPolarHBondContact O-CB 3.43Å; T61-L65 WeakPolarHBondContact O-CG 3.15Å; T61-L65 PolarHBondContact O-N 3.01Å
62	A	69.8	Low	73.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-55.5	-52.8	174.5	0	0	0	0	0	111.6	M56 Q58 P59 L60 K64 L65 M66 L107	M56-A62 HydrophobicContact CB-CB 3.68Å; M56-A62 HydrophobicContact CG-CB 3.99Å; M56-A62 HydrophobicContact SD-CB 4Å; Q58-A62 WeakPolarHBondContact O-CB 3.38Å; Q58-A62 PolarHBondContact O-N 3.4Å; P59-A62 WeakPolarHBondContact O-CB 3.39Å; L60-A62 VanDerWaalsContact C-N 3.29Å; L60-A62 PolarHBondContact O-N 3.4Å; A62-K64 PolarHBondContact O-N 2.65Å; A62-L65 PolarHBondContact O-N 3.37Å; A62-M66 HydrophobicContact CB-CE 4.4Å; A62-M66 WeakPolarHBondContact O-CB 3.18Å; A62-M66 WeakPolarHBondContact O-CG 3.49Å; A62-M66 PolarHBondContact O-N 3.2Å; A62-L107 HydrophobicContact CB-CD2 3.51Å
63	Y	69.4	Low	73.6	Confident	6 Å²	6	48.2 Å²	48.2	2%	0.024	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-44.7	179.1	179.7	-113.3	0	0	0	112.5	P59 L60 T61 M66 R67 L107 T111 E114 F185 F362	P59-Y63 WeakPolarHBondContact O-CB 3.35Å; P59-Y63 PolarHBondContact O-N 2.89Å; L60-Y63 PolarHBondContact O-N 2.9Å; T61-Y63 PolarHBondContact O-N 2.89Å; Y63-M66 PolarHBondContact O-N 3.44Å; Y63-R67 VanDerWaalsContact CE1-CD 3.45Å; Y63-R67 HydrophobicContact CE1-CG 4.41Å; Y63-R67 HydrophobicContact CE2-CG 4.25Å; Y63-R67 VanDerWaalsContact CZ-CD 3.45Å; Y63-R67 WeakPolarHBondContact O-CB 3.33Å; Y63-R67 WeakPolarHBondContact O-CG 3.13Å; Y63-R67 PolarHBondContact O-N 3.42Å; Y63-R67 PolarHBondContact OH-NH1 3.17Å; Y63-L107 HydrophobicContact CD2-CD1 3.88Å; Y63-L107 HydrophobicContact CD2-CG 4.46Å; Y63-L107 HydrophobicContact CG-CD1 4.41Å; Y63-T111 HydrophobicContact CD2-CG2 4.41Å; Y63-T111 WeakPolarHBondContact CD2-OG1 3.47Å; Y63-T111 HydrophobicContact CE2-CG2 4.25Å; Y63-E114 PolarHBondContact OH-OE1 3.47Å; Y63-E114 VanDerWaalsContact OH-OE1 3.09Å; Y63-E114 PolarHBondContact OH-OE2 3.3Å; Y63-F185 HydrophobicContact CE1-CD1 4.44Å; Y63-F185 HydrophobicContact CE2-CD1 4.1Å; Y63-F185 HydrophobicContact CE2-CE1 4.21Å; Y63-F185 AromaticContact CZ-CD1 3.69Å; Y63-F185 WeakPolarHBondContact OH-CD1 3.23Å; Y63-F362 HydrophobicContact CD1-CZ 4.4Å; Y63-F362 HydrophobicContact CD2-CZ 4.43Å; Y63-F362 HydrophobicContact CG-CZ 4.09Å
64	K	71.9	Confident	73.3	Confident	51 Å²	51	45.8 Å²	45.8	22%	0.222	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-49.5	178.1	-74.3	-173.5	-178	-162	0	112.1	L60 T61 A62 M66 R67 E68 S140 E141	L60-K64 WeakPolarHBondContact O-CB 3.48Å; L60-K64 WeakPolarHBondContact O-CG 3.32Å; L60-K64 PolarHBondContact O-N 2.89Å; T61-K64 PolarHBondContact O-N 3.1Å; A62-K64 PolarHBondContact O-N 2.65Å; K64-M66 VanDerWaalsContact C-N 3.29Å; K64-M66 PolarHBondContact O-N 3.48Å; K64-R67 WeakPolarHBondContact O-CA 3.34Å; K64-R67 WeakPolarHBondContact O-CB 3.34Å; K64-R67 PolarHBondContact O-N 3.37Å; K64-E68 WeakPolarHBondContact O-CG 3.35Å; K64-E68 PolarHBondContact O-N 2.81Å; K64-S140 PolarHBondContact NZ-O 3.28Å; K64-S140 VanDerWaalsContact NZ-O 3.09Å; K64-E141 VanDerWaalsContact NZ-CA 3.25Å; K64-E141 VanDerWaalsContact NZ-CG 3.32Å
65	L	78	Confident	72.7	Confident	17 Å²	17	43.1 Å²	43.1	9%	0.089	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-37.2	-180	-69.5	-172.5	0	0	0	112	V52 R55 M56 T61 A62 F69	V52-L65 HydrophobicContact CG1-CB 3.57Å; V52-L65 HydrophobicContact CG1-CD1 4.25Å; V52-L65 HydrophobicContact CG1-CG 4.45Å; R55-L65 HydrophobicContact CB-CD1 3.65Å; M56-L65 HydrophobicContact CE-CB 4.19Å; M56-L65 HydrophobicContact CG-CD1 4.32Å; T61-L65 HydrophobicContact CG2-CD1 3.89Å; T61-L65 HydrophobicContact CG2-CG 4.13Å; T61-L65 VanDerWaalsContact O-CB 3.29Å; T61-L65 WeakPolarHBondContact O-CB 3.43Å; T61-L65 WeakPolarHBondContact O-CG 3.15Å; T61-L65 PolarHBondContact O-N 3.01Å; A62-L65 PolarHBondContact O-N 3.37Å; L65-F69 WeakPolarHBondContact O-CB 3.44Å; L65-F69 PolarHBondContact O-N 3.33Å
66	M	78.1	Confident	72	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-44.9	170.3	-70.1	172.9	-172.6	0	0	111.4	F48 M56 A62 Y63 K64 F69 L70 T104 L107 L108 T111	F48-M66 HydrophobicContact CE2-CG 3.88Å; F48-M66 HydrophobicContact CZ-CE 4.2Å; F48-M66 HydrophobicContact CZ-CG 3.98Å; M56-M66 HydrophobicContact CE-CE 3.93Å; M56-M66 HydrophobicContact CE-CG 3.54Å; M56-M66 HydrophobicContact SD-CE 3.45Å; M56-M66 WeakPolarHBondContact SD-CE 3.47Å; M56-M66 HydrophobicContact SD-CG 4.27Å; A62-M66 HydrophobicContact CB-CE 4.4Å; A62-M66 WeakPolarHBondContact O-CB 3.18Å; A62-M66 WeakPolarHBondContact O-CG 3.49Å; A62-M66 PolarHBondContact O-N 3.2Å; Y63-M66 PolarHBondContact O-N 3.44Å; K64-M66 VanDerWaalsContact C-N 3.29Å; K64-M66 PolarHBondContact O-N 3.48Å; M66-F69 PolarHBondContact O-N 3.04Å; M66-L70 VanDerWaalsContact O-CB 3.31Å; M66-L70 WeakPolarHBondContact O-CB 2.97Å; M66-L70 WeakPolarHBondContact O-CD1 3.21Å; M66-L70 WeakPolarHBondContact O-CG 3.05Å; M66-L70 PolarHBondContact O-N 3.46Å; M66-T104 HydrophobicContact CE-CG2 3.49Å; M66-T104 VanDerWaalsContact CE-CG2 3.49Å; M66-T104 VanDerWaalsContact CE-O 3.28Å; M66-T104 WeakPolarHBondContact CE-O 3.3Å; M66-L107 HydrophobicContact CE-CB 4.13Å; M66-L107 HydrophobicContact CE-CD2 4.07Å; M66-L107 HydrophobicContact CE-CG 4.28Å; M66-L107 HydrophobicContact SD-CB 3.97Å; M66-L107 HydrophobicContact SD-CD2 3.91Å; M66-L107 HydrophobicContact SD-CG 3.71Å; M66-L108 HydrophobicContact CB-CD1 4.41Å; M66-L108 HydrophobicContact CE-CB 4.02Å; M66-L108 HydrophobicContact CG-CD1 4.03Å; M66-L108 WeakPolarHBondContact SD-CA 3.32Å; M66-L108 HydrophobicContact SD-CB 3.84Å; M66-L108 HydrophobicContact SD-CD1 4.22Å; M66-L108 PolarHBondContact SD-N 3.37Å; M66-L108 VanDerWaalsContact SD-N 3.36Å; M66-T111 HydrophobicContact CB-CG2 4.07Å
67	R	76.3	Confident	71.5	Confident	50 Å²	50	44.9 Å²	44.9	19%	0.189	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-47.3	177.7	-78.7	-176.9	79.8	155.8	6.9	111.6	Y63 K64 L70 D71 T111 E114 D186	Y63-R67 VanDerWaalsContact CE1-CD 3.45Å; Y63-R67 HydrophobicContact CE1-CG 4.41Å; Y63-R67 HydrophobicContact CE2-CG 4.25Å; Y63-R67 VanDerWaalsContact CZ-CD 3.45Å; Y63-R67 WeakPolarHBondContact O-CB 3.33Å; Y63-R67 WeakPolarHBondContact O-CG 3.13Å; Y63-R67 PolarHBondContact O-N 3.42Å; Y63-R67 PolarHBondContact OH-NH1 3.17Å; K64-R67 WeakPolarHBondContact O-CA 3.34Å; K64-R67 WeakPolarHBondContact O-CB 3.34Å; K64-R67 PolarHBondContact O-N 3.37Å; R67-L70 PolarHBondContact O-N 2.92Å; R67-D71 VanDerWaalsContact O-CB 3.28Å; R67-D71 WeakPolarHBondContact O-CB 3.5Å; R67-D71 PolarHBondContact O-N 3.05Å; R67-T111 HydrophobicContact CB-CG2 4.22Å; R67-T111 HydrophobicContact CG-CG2 3.35Å; R67-E114 IonicContact CZ-OE1 3.29Å; R67-E114 IonicContact NE-OE1 3.79Å; R67-E114 IonicContact NH1-OE1 2.64Å; R67-E114 PolarHBondContact NH1-OE1 3.18Å; R67-E114 IonicContact NH2-OE1 2.67Å; R67-E114 PolarHBondContact NH2-OE1 2.96Å; R67-D186 IonicContact CZ-OD2 3.93Å; R67-D186 IonicContact NH1-OD1 3.28Å; R67-D186 IonicContact NH1-OD2 3.05Å; R67-D186 PolarHBondContact NH1-OD2 3.18Å; R67-D186 IonicContact NH2-OD2 3.05Å
68	E	78.7	Confident	71.3	Confident	111 Å²	111	45.1 Å²	45.1	52%	0.519	24%	0.236	S	C	.	.	H	α-helix	trans	-63.1	-46	179.3	-73.7	172.4	-175	0	0	111.8	K64 L70 D71 T72	K64-E68 WeakPolarHBondContact O-CG 3.35Å; K64-E68 PolarHBondContact O-N 2.81Å; E68-L70 VanDerWaalsContact C-N 3.35Å; E68-L70 PolarHBondContact O-N 3.38Å; E68-D71 PolarHBondContact O-N 2.86Å; E68-T72 WeakPolarHBondContact O-CB 3.39Å; E68-T72 PolarHBondContact O-N 3.07Å; E68-T72 PolarHBondContact O-OG1 2.86Å
69	F	81	Confident	71.1	Confident	11 Å²	11	41.2 Å²	41.2	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-47.5	175.6	175	-94.2	0	0	0	111.2	L44 W45 F48 V52 L65 M66 T72 H73 F74	L44-F69 HydrophobicContact CB-CZ 4.14Å; L44-F69 WeakPolarHBondContact O-CE2 3.37Å; L44-F69 WeakPolarHBondContact O-CZ 3.47Å; W45-F69 AromaticContact CE3-CE1 3.96Å; W45-F69 HydrophobicContact CE3-CE1 3.96Å; W45-F69 HydrophobicContact CE3-CZ 4.36Å; W45-F69 HydrophobicContact CH2-CE1 4.2Å; W45-F69 HydrophobicContact CZ3-CD1 4.42Å; W45-F69 AromaticContact CZ3-CE1 3.66Å; W45-F69 HydrophobicContact CZ3-CE1 3.66Å; W45-F69 HydrophobicContact CZ3-CZ 4.49Å; F48-F69 HydrophobicContact CB-CD1 4.5Å; F48-F69 HydrophobicContact CB-CD2 4.27Å; F48-F69 HydrophobicContact CB-CE1 4Å; F48-F69 HydrophobicContact CB-CE2 3.76Å; F48-F69 HydrophobicContact CB-CZ 3.63Å; F48-F69 HydrophobicContact CD2-CB 4.4Å; F48-F69 AromaticContact CD2-CD1 3.7Å; F48-F69 HydrophobicContact CD2-CD1 3.7Å; F48-F69 HydrophobicContact CD2-CD2 4.15Å; F48-F69 AromaticContact CD2-CE1 3.97Å; F48-F69 HydrophobicContact CD2-CE1 3.97Å; F48-F69 HydrophobicContact CD2-CE2 4.41Å; F48-F69 AromaticContact CD2-CG 3.81Å; F48-F69 HydrophobicContact CD2-CG 3.81Å; F48-F69 HydrophobicContact CD2-CZ 4.35Å; F48-F69 HydrophobicContact CE2-CD1 4.39Å; F48-F69 HydrophobicContact CG-CD1 4.44Å; F48-F69 HydrophobicContact CG-CE1 4.26Å; F48-F69 HydrophobicContact CG-CZ 4.37Å; V52-F69 HydrophobicContact CG2-CD2 4.06Å; L65-F69 WeakPolarHBondContact O-CB 3.44Å; L65-F69 PolarHBondContact O-N 3.33Å; M66-F69 PolarHBondContact O-N 3.04Å; F69-T72 PolarHBondContact O-N 3.17Å; F69-H73 AromaticContact CD2-CD2 3.36Å; F69-H73 WeakPolarHBondContact CD2-CD2 3.37Å; F69-H73 AromaticContact CD2-NE2 3.85Å; F69-H73 AromaticContact CE2-CD2 3.38Å; F69-H73 WeakPolarHBondContact CE2-CD2 3.47Å; F69-H73 AromaticContact CE2-NE2 3.9Å; F69-H73 AromaticContact CG-CD2 3.95Å; F69-H73 WeakPolarHBondContact O-CB 3.31Å; F69-H73 PolarHBondContact O-CD2 3.23Å; F69-H73 PolarHBondContact O-N 3.47Å; F69-F74 HydrophobicContact CD1-CE2 4.43Å; F69-F74 HydrophobicContact CE1-CD2 4.32Å; F69-F74 AromaticContact CE1-CE2 3.62Å; F69-F74 HydrophobicContact CE1-CE2 3.62Å; F69-F74 HydrophobicContact CZ-CE2 4.09Å
70	L	76.9	Confident	71.1	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-68.4	-38	179.3	-68.5	167.9	0	0	0	112.5	W45 M66 R67 E68 F74 V75 T111 I112 K115	W45-L70 HydrophobicContact CH2-CD2 4.05Å; M66-L70 VanDerWaalsContact O-CB 3.31Å; M66-L70 WeakPolarHBondContact O-CB 2.97Å; M66-L70 WeakPolarHBondContact O-CD1 3.21Å; M66-L70 WeakPolarHBondContact O-CG 3.05Å; M66-L70 PolarHBondContact O-N 3.46Å; R67-L70 PolarHBondContact O-N 2.92Å; E68-L70 VanDerWaalsContact C-N 3.35Å; E68-L70 PolarHBondContact O-N 3.38Å; L70-F74 HydrophobicContact CD2-CD2 3.69Å; L70-F74 HydrophobicContact CD2-CE2 4.16Å; L70-F74 HydrophobicContact CD2-CG 4.19Å; L70-F74 WeakPolarHBondContact O-CA 3.35Å; L70-F74 WeakPolarHBondContact O-CB 3.24Å; L70-F74 PolarHBondContact O-N 3.27Å; L70-V75 PolarHBondContact O-N 3.16Å; L70-T111 HydrophobicContact CD1-CG2 3.64Å; L70-I112 HydrophobicContact CD1-CB 4.34Å; L70-I112 HydrophobicContact CD1-CG1 3.72Å; L70-I112 HydrophobicContact CD2-CG1 3.65Å; L70-I112 HydrophobicContact CG-CG1 4.34Å; L70-K115 HydrophobicContact CB-CG 4.27Å; L70-K115 HydrophobicContact CD1-CG 4.48Å
71	D	74.7	Confident	71.1	Confident	52 Å²	52	45.1 Å²	45.1	28%	0.278	24%	0.236	S	C	.	.	I	π-helix	trans	-59.6	-51	176.2	-79.1	-26.8	0	0	0	110.4	R67 E68 E76 K115	R67-D71 VanDerWaalsContact O-CB 3.28Å; R67-D71 WeakPolarHBondContact O-CB 3.5Å; R67-D71 PolarHBondContact O-N 3.05Å; E68-D71 PolarHBondContact O-N 2.86Å; D71-E76 WeakPolarHBondContact O-CG 3.41Å; D71-E76 PolarHBondContact O-N 2.98Å; D71-K115 WeakPolarHBondContact OD1-CD 3.49Å; D71-K115 WeakPolarHBondContact OD1-CE 3.49Å; D71-K115 IonicContact OD1-NZ 3.87Å; D71-K115 PolarHBondContact OD1-NZ 3.15Å; D71-K115 IonicContact OD2-NZ 3.96Å; D71-K115 PolarHBondContact OD2-NZ 2.93Å
72	T	74.4	Confident	70.7	Confident	72 Å²	72	48.3 Å²	48.3	44%	0.442	25%	0.246	S	C	.	.	I	π-helix	trans	-65.4	-44.3	-177.5	-51.1	0	0	0	0	112.3	E68 F69	E68-T72 WeakPolarHBondContact O-CB 3.39Å; E68-T72 PolarHBondContact O-N 3.07Å; E68-T72 PolarHBondContact O-OG1 2.86Å; F69-T72 PolarHBondContact O-N 3.17Å
73	H	73.7	Confident	70.4	Confident	66 Å²	66	48.8 Å²	48.8	31%	0.306	25%	0.249	S	C	.	.	I	π-helix	trans	-102.4	-23.3	-166.8	-61.8	-59.6	0	0	0	114.9	L44 F69 A77	L44-H73 HydrophobicContact CD1-CB 4.04Å; L44-H73 HydrophobicContact CD2-CB 4.2Å; L44-H73 WeakPolarHBondContact CD2-ND1 3.43Å; F69-H73 AromaticContact CD2-CD2 3.36Å; F69-H73 WeakPolarHBondContact CD2-CD2 3.37Å; F69-H73 AromaticContact CD2-NE2 3.85Å; F69-H73 AromaticContact CE2-CD2 3.38Å; F69-H73 WeakPolarHBondContact CE2-CD2 3.47Å; F69-H73 AromaticContact CE2-NE2 3.9Å; F69-H73 AromaticContact CG-CD2 3.95Å; F69-H73 WeakPolarHBondContact O-CB 3.31Å; F69-H73 PolarHBondContact O-CD2 3.23Å; F69-H73 PolarHBondContact O-N 3.47Å; H73-A77 WeakPolarHBondContact O-CB 3.43Å
74	F	69.5	Low	70.4	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	25%	0.248	C	C	.	.	I	π-helix	trans	-119.7	-46.2	-173.7	-66.5	-93.6	0	0	0	112.3	W45 F69 L70 A77 N78 I79 C84	W45-F74 HydrophobicContact CD2-CZ 4.46Å; W45-F74 AromaticContact CE2-CZ 3.61Å; W45-F74 HydrophobicContact CH2-CE2 4.15Å; W45-F74 HydrophobicContact CH2-CZ 4.07Å; W45-F74 AromaticContact CZ2-CE1 3.98Å; W45-F74 HydrophobicContact CZ2-CE1 3.98Å; W45-F74 AromaticContact CZ2-CE2 3.95Å; W45-F74 HydrophobicContact CZ2-CE2 3.95Å; W45-F74 AromaticContact CZ2-CZ 3.4Å; W45-F74 HydrophobicContact CZ2-CZ 3.4Å; W45-F74 VanDerWaalsContact CZ2-CZ 3.4Å; W45-F74 AromaticContact NE1-CZ 3.82Å; F69-F74 HydrophobicContact CD1-CE2 4.43Å; F69-F74 HydrophobicContact CE1-CD2 4.32Å; F69-F74 AromaticContact CE1-CE2 3.62Å; F69-F74 HydrophobicContact CE1-CE2 3.62Å; F69-F74 HydrophobicContact CZ-CE2 4.09Å; L70-F74 HydrophobicContact CD2-CD2 3.69Å; L70-F74 HydrophobicContact CD2-CE2 4.16Å; L70-F74 HydrophobicContact CD2-CG 4.19Å; L70-F74 WeakPolarHBondContact O-CA 3.35Å; L70-F74 WeakPolarHBondContact O-CB 3.24Å; L70-F74 PolarHBondContact O-N 3.27Å; F74-A77 CarbonylContact O-C 3.49Å; F74-A77 PolarHBondContact O-N 2.96Å; F74-N78 PolarHBondContact O-N 3.46Å; F74-I79 HydrophobicContact CB-CB 4.34Å; F74-I79 HydrophobicContact CD1-CB 4.1Å; F74-I79 HydrophobicContact CD1-CD1 3.75Å; F74-I79 HydrophobicContact CD1-CG1 4.48Å; F74-I79 HydrophobicContact CD1-CG2 3.97Å; F74-I79 HydrophobicContact CE1-CD1 4.28Å; F74-I79 HydrophobicContact CG-CD1 4.42Å; F74-I79 PolarHBondContact O-N 3.32Å; F74-C84 HydrophobicContact CD1-CB 3.77Å; F74-C84 WeakPolarHBondContact CD1-SG 3.48Å; F74-C84 HydrophobicContact CE1-CB 4.08Å; F74-C84 VanDerWaalsContact CE1-SG 3.56Å
75	V	65.9	Low	70.1	Confident	38 Å²	38	47.4 Å²	47.4	23%	0.23	24%	0.244	C	C	.	.	I	π-helix	trans	-70.9	-48.3	-177.9	-179.9	0	0	0	0	110.9	L70 A77 N78 K115 V119	L70-V75 PolarHBondContact O-N 3.16Å; V75-A77 VanDerWaalsContact C-N 3.26Å; V75-A77 PolarHBondContact O-N 3.23Å; V75-N78 PolarHBondContact O-N 3.44Å; V75-K115 HydrophobicContact CG2-CB 3.77Å; V75-K115 HydrophobicContact CG2-CD 4.32Å; V75-K115 HydrophobicContact CG2-CG 4.36Å; V75-V119 HydrophobicContact CG1-CG2 3.87Å
76	E	65.2	Low	69.3	Low	146 Å²	146	47.5 Å²	47.5	68%	0.682	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-37.4	175	-76.3	-179.3	-175.8	0	0	111.9	D71 N78	D71-E76 WeakPolarHBondContact O-CG 3.41Å; D71-E76 PolarHBondContact O-N 2.98Å; E76-N78 PolarHBondContact O-N 3.27Å
77	A	64.9	Low	68.8	Low	54 Å²	54	47.5 Å²	47.5	45%	0.446	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	1.5	175.1	0	0	0	0	0	113.9	H73 F74 V75 I79	H73-A77 WeakPolarHBondContact O-CB 3.43Å; F74-A77 CarbonylContact O-C 3.49Å; F74-A77 PolarHBondContact O-N 2.96Å; V75-A77 VanDerWaalsContact C-N 3.26Å; V75-A77 PolarHBondContact O-N 3.23Å; A77-I79 HydrophobicContact CB-CD1 3.93Å; A77-I79 HydrophobicContact CB-CG1 3.83Å; A77-I79 PolarHBondContact O-N 3.46Å
78	N	65.4	Low	68.5	Low	94 Å²	94	45.1 Å²	45.1	50%	0.503	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	25.4	175.8	-89.5	-45.9	0	0	0	114.6	F74 V75 E76 R123	F74-N78 PolarHBondContact O-N 3.46Å; V75-N78 PolarHBondContact O-N 3.44Å; E76-N78 PolarHBondContact O-N 3.27Å; N78-R123 PolarHBondContact O-NH2 3.33Å; N78-R123 PolarHBondContact OD1-NH2 2.57Å
79	I	64.2	Low	67.7	Low	8 Å²	8	41 Å²	41	4%	0.041	22%	0.218	C	C	.	.			trans	-74.5	131	-177.7	-57.6	-179.1	0	0	0	110.1	F74 A77 T83 C84	F74-I79 HydrophobicContact CB-CB 4.34Å; F74-I79 HydrophobicContact CD1-CB 4.1Å; F74-I79 HydrophobicContact CD1-CD1 3.75Å; F74-I79 HydrophobicContact CD1-CG1 4.48Å; F74-I79 HydrophobicContact CD1-CG2 3.97Å; F74-I79 HydrophobicContact CE1-CD1 4.28Å; F74-I79 HydrophobicContact CG-CD1 4.42Å; F74-I79 PolarHBondContact O-N 3.32Å; A77-I79 HydrophobicContact CB-CD1 3.93Å; A77-I79 HydrophobicContact CB-CG1 3.83Å; A77-I79 PolarHBondContact O-N 3.46Å; I79-T83 HydrophobicContact CG2-CG2 3.56Å; I79-C84 HydrophobicContact CG2-CB 4.28Å
80	D	63.8	Low	66.8	Low	68 Å²	68	41.8 Å²	41.8	36%	0.364	23%	0.226	S	C	.	.			trans	-77.3	165.1	178.8	72.5	79.7	0	0	0	113.1	H82 T83 C84	D80-H82 VanDerWaalsContact C-N 3.35Å; D80-H82 PolarHBondContact O-N 3.07Å; D80-H82 WeakPolarHBondContact OD1-CA 3.49Å; D80-H82 WeakPolarHBondContact OD1-CB 3.36Å; D80-H82 PolarHBondContact OD1-N 3Å; D80-T83 VanDerWaalsContact CG-OG1 3.31Å; D80-T83 PolarHBondContact O-N 2.83Å; D80-T83 PolarHBondContact OD1-N 3.4Å; D80-T83 PolarHBondContact OD1-OG1 3.17Å; D80-T83 WeakPolarHBondContact OD2-CB 3.24Å; D80-T83 PolarHBondContact OD2-OG1 3.02Å; D80-C84 WeakPolarHBondContact O-CB 3.46Å; D80-C84 PolarHBondContact O-N 2.95Å
81	F	62.3	Low	66.2	Low	38 Å²	38	42 Å²	42	17%	0.167	23%	0.228	C	C	.	.	H	α-helix	trans	-56	-45.4	-178.2	175.6	-103.1	0	0	0	113.2	C84 L85 I112 K113 C116	F81-C84 PolarHBondContact O-N 3.25Å; F81-L85 HydrophobicContact CE1-CD2 3.97Å; F81-L85 HydrophobicContact CZ-CD2 3.89Å; F81-L85 VanDerWaalsContact O-CB 3.29Å; F81-L85 WeakPolarHBondContact O-CB 3.47Å; F81-L85 PolarHBondContact O-N 3.44Å; F81-I112 HydrophobicContact CD2-CG2 3.8Å; F81-I112 HydrophobicContact CE2-CG2 3.92Å; F81-K113 HydrophobicContact CD2-CB 4.18Å; F81-K113 HydrophobicContact CD2-CG 4.32Å; F81-K113 HydrophobicContact CE2-CB 3.7Å; F81-K113 HydrophobicContact CE2-CD 4.44Å; F81-K113 HydrophobicContact CE2-CG 4Å; F81-C116 VanDerWaalsContact CA-SG 3.56Å; F81-C116 HydrophobicContact CB-CB 3.57Å; F81-C116 HydrophobicContact CD2-CB 4.28Å; F81-C116 HydrophobicContact CG-CB 4.44Å
82	H	61.3	Low	65.4	Low	127 Å²	127	44.4 Å²	44.4	59%	0.588	24%	0.24	S	C	*	.	H	α-helix	trans	-68.3	-42.9	-176	-71.7	-71.6	0	0	0	110.4	D80 L85 S86	D80-H82 VanDerWaalsContact C-N 3.35Å; D80-H82 PolarHBondContact O-N 3.07Å; D80-H82 WeakPolarHBondContact OD1-CA 3.49Å; D80-H82 WeakPolarHBondContact OD1-CB 3.36Å; D80-H82 PolarHBondContact OD1-N 3Å; H82-L85 PolarHBondContact O-N 3.48Å; H82-S86 WeakPolarHBondContact O-CB 3.33Å; H82-S86 PolarHBondContact O-N 3.46Å; H82-S86 PolarHBondContact O-OG 3.28Å
83	T	63.7	Low	64.4	Low	11 Å²	11	41.6 Å²	41.6	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-45.9	175.8	-61.1	0	0	0	0	111.6	L32 H36 M41 I79 D80 S86 S87	L32-T83 HydrophobicContact CD2-CG2 3.61Å; H36-T83 VanDerWaalsContact CD2-CG2 3.43Å; H36-T83 WeakPolarHBondContact CD2-CG2 2.94Å; M41-T83 HydrophobicContact SD-CG2 4.32Å; I79-T83 HydrophobicContact CG2-CG2 3.56Å; D80-T83 VanDerWaalsContact CG-OG1 3.31Å; D80-T83 PolarHBondContact O-N 2.83Å; D80-T83 PolarHBondContact OD1-N 3.4Å; D80-T83 PolarHBondContact OD1-OG1 3.17Å; D80-T83 WeakPolarHBondContact OD2-CB 3.24Å; D80-T83 PolarHBondContact OD2-OG1 3.02Å; T83-S86 PolarHBondContact O-N 3.33Å; T83-S87 WeakPolarHBondContact O-CB 3.29Å; T83-S87 PolarHBondContact O-N 2.87Å; T83-S87 PolarHBondContact O-OG 3.34Å
84	C	69	Low	63.3	Low	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-51	176.5	-176.7	0	0	0	0	111.2	F74 I79 D80 F81 S87 L88 I112	F74-C84 HydrophobicContact CD1-CB 3.77Å; F74-C84 WeakPolarHBondContact CD1-SG 3.48Å; F74-C84 HydrophobicContact CE1-CB 4.08Å; F74-C84 VanDerWaalsContact CE1-SG 3.56Å; I79-C84 HydrophobicContact CG2-CB 4.28Å; D80-C84 WeakPolarHBondContact O-CB 3.46Å; D80-C84 PolarHBondContact O-N 2.95Å; F81-C84 PolarHBondContact O-N 3.25Å; C84-S87 PolarHBondContact O-N 3.45Å; C84-S87 PolarHBondContact O-OG 2.81Å; C84-L88 PolarHBondContact O-N 3.42Å; C84-I112 HydrophobicContact CB-CG2 4.02Å; C84-I112 VanDerWaalsContact SG-CG2 3.54Å
85	L	64.9	Low	62.3	Low	28 Å²	28	46.3 Å²	46.3	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-43.3	179	-174.6	66	0	0	0	112.2	F81 H82 S87 L88 L89 I109	F81-L85 HydrophobicContact CE1-CD2 3.97Å; F81-L85 HydrophobicContact CZ-CD2 3.89Å; F81-L85 VanDerWaalsContact O-CB 3.29Å; F81-L85 WeakPolarHBondContact O-CB 3.47Å; F81-L85 PolarHBondContact O-N 3.44Å; H82-L85 PolarHBondContact O-N 3.48Å; L85-S87 VanDerWaalsContact C-N 3.28Å; L85-S87 PolarHBondContact O-N 2.99Å; L85-L88 HydrophobicContact CD1-CD2 4.48Å; L85-L88 WeakPolarHBondContact O-CB 3.38Å; L85-L88 PolarHBondContact O-N 3.39Å; L85-L89 HydrophobicContact CG-CD1 4.12Å; L85-L89 VanDerWaalsContact O-CG 3.26Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.19Å; L85-I109 HydrophobicContact CD1-CG1 4.45Å
86	S	61.5	Low	61.5	Low	20 Å²	20	52.2 Å²	52.2	14%	0.14	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-37.4	175.9	-73.3	0	0	0	0	111.7	H82 T83 L89 S90	H82-S86 WeakPolarHBondContact O-CB 3.33Å; H82-S86 PolarHBondContact O-N 3.46Å; H82-S86 PolarHBondContact O-OG 3.28Å; T83-S86 PolarHBondContact O-N 3.33Å; S86-L89 PolarHBondContact O-N 2.95Å; S86-S90 VanDerWaalsContact O-CB 3.27Å; S86-S90 WeakPolarHBondContact O-CB 3.48Å; S86-S90 PolarHBondContact O-N 2.89Å; S86-S90 PolarHBondContact O-OG 3.25Å
87	S	67.9	Low	60.5	Low	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-68.1	-39.5	176	73.9	0	0	0	0	112.5	W45 T83 C84 L85 L89 S90 A91	W45-S87 PolarHBondContact NE1-OG 3.16Å; T83-S87 WeakPolarHBondContact O-CB 3.29Å; T83-S87 PolarHBondContact O-N 2.87Å; T83-S87 PolarHBondContact O-OG 3.34Å; C84-S87 PolarHBondContact O-N 3.45Å; C84-S87 PolarHBondContact O-OG 2.81Å; L85-S87 VanDerWaalsContact C-N 3.28Å; L85-S87 PolarHBondContact O-N 2.99Å; S87-L89 VanDerWaalsContact C-N 3.32Å; S87-L89 PolarHBondContact O-N 3.05Å; S87-S90 PolarHBondContact O-N 3.06Å; S87-A91 WeakPolarHBondContact O-CB 3.46Å; S87-A91 PolarHBondContact O-N 2.93Å
88	L	69.3	Low	59.8	Low	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-43.9	173.8	179.4	68.1	0	0	0	110.9	W45 C84 L85 L93 F94 L105 L108 I112	W45-L88 HydrophobicContact CD2-CB 4.26Å; W45-L88 HydrophobicContact CD2-CD1 3.59Å; W45-L88 HydrophobicContact CE3-CD1 3.53Å; W45-L88 HydrophobicContact CG-CD1 4.19Å; W45-L88 HydrophobicContact CH2-CB 4.39Å; W45-L88 HydrophobicContact CH2-CD1 4.11Å; W45-L88 HydrophobicContact CZ2-CB 3.77Å; W45-L88 HydrophobicContact CZ2-CD1 4.15Å; W45-L88 HydrophobicContact CZ2-CG 4.45Å; W45-L88 HydrophobicContact CZ3-CD1 3.81Å; W45-L88 VanDerWaalsContact NE1-N 3.14Å; C84-L88 PolarHBondContact O-N 3.42Å; L85-L88 HydrophobicContact CD1-CD2 4.48Å; L85-L88 WeakPolarHBondContact O-CB 3.38Å; L85-L88 PolarHBondContact O-N 3.39Å; L88-L93 HydrophobicContact CD1-CD1 4Å; L88-F94 HydrophobicContact CD2-CZ 4.34Å; L88-F94 HydrophobicContact CG-CE2 4.17Å; L88-F94 HydrophobicContact CG-CZ 4.27Å; L88-L105 HydrophobicContact CD2-CD1 4.49Å; L88-L108 HydrophobicContact CD1-CD2 3.89Å; L88-L108 HydrophobicContact CD2-CD2 3.9Å; L88-I112 HydrophobicContact CD2-CD1 4.01Å
89	L	62.3	Low	59.5	Low	23 Å²	23	53.2 Å²	53.2	12%	0.12	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-41.9	177.3	-66.4	165.9	0	0	0	112	L20 L85 S86 S87 A91 N92 F94	L20-L89 HydrophobicContact CD2-CD1 3.91Å; L20-L89 HydrophobicContact CD2-CD2 4.11Å; L85-L89 HydrophobicContact CG-CD1 4.12Å; L85-L89 VanDerWaalsContact O-CG 3.26Å; L85-L89 WeakPolarHBondContact O-CG 3.38Å; L85-L89 PolarHBondContact O-N 3.19Å; S86-L89 PolarHBondContact O-N 2.95Å; S87-L89 VanDerWaalsContact C-N 3.32Å; S87-L89 PolarHBondContact O-N 3.05Å; L89-A91 VanDerWaalsContact C-N 3.27Å; L89-A91 PolarHBondContact O-N 2.86Å; L89-N92 PolarHBondContact O-N 2.95Å; L89-F94 HydrophobicContact CD2-CD2 4.09Å; L89-F94 HydrophobicContact CD2-CE2 3.6Å; L89-F94 HydrophobicContact CD2-CZ 4.15Å; L89-F94 HydrophobicContact CG-CE2 4.33Å
90	S	63.1	Low	59.3	Low	28 Å²	28	53.8 Å²	53.8	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-70.9	-23.6	-179.4	-57	0	0	0	0	112.9	I29 S86 S87 N92	I29-S90 WeakPolarHBondContact CG2-OG 3.01Å; S86-S90 VanDerWaalsContact O-CB 3.27Å; S86-S90 WeakPolarHBondContact O-CB 3.48Å; S86-S90 PolarHBondContact O-N 2.89Å; S86-S90 PolarHBondContact O-OG 3.25Å; S87-S90 PolarHBondContact O-N 3.06Å; S90-N92 PolarHBondContact O-N 3.36Å
91	A	63.7	Low	59.4	Low	7 Å²	7	54.1 Å²	54.1	6%	0.058	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	0.8	177.2	0	0	0	0	0	113.2	T42 W45 S87 L89 L93	T42-A91 HydrophobicContact CG2-CB 4.05Å; W45-A91 HydrophobicContact CB-CB 3.88Å; W45-A91 HydrophobicContact CG-CB 4.23Å; S87-A91 WeakPolarHBondContact O-CB 3.46Å; S87-A91 PolarHBondContact O-N 2.93Å; L89-A91 VanDerWaalsContact C-N 3.27Å; L89-A91 PolarHBondContact O-N 2.86Å; A91-L93 HydrophobicContact CB-CD1 4.27Å; A91-L93 HydrophobicContact CB-CG 3.84Å; A91-L93 PolarHBondContact O-N 2.87Å
92	N	56.7	Low	59.2	Low	102 Å²	102	56.6 Å²	56.6	55%	0.545	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	15.3	-180	-86.4	-15	0	0	0	114	L89 S90 F94 I95	L89-N92 PolarHBondContact O-N 2.95Å; S90-N92 PolarHBondContact O-N 3.36Å; N92-F94 PolarHBondContact O-N 3.1Å; N92-F94 VanDerWaalsContact O-N 3.08Å; N92-I95 HydrophobicContact CB-CD1 3.87Å; N92-I95 HydrophobicContact CB-CG1 4.16Å; N92-I95 WeakPolarHBondContact O-CB 3.41Å; N92-I95 PolarHBondContact O-N 3.07Å; N92-I95 WeakPolarHBondContact OD1-CD1 3.17Å
93	L	54.7	Low	59.1	Low	13 Å²	13	52 Å²	52	7%	0.068	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-57.6	-28.2	177.7	-67.2	-176.7	0	0	0	111.2	W45 I49 L88 A91 I95 R96	W45-L93 HydrophobicContact CB-CD1 3.67Å; W45-L93 HydrophobicContact CB-CG 4.49Å; W45-L93 HydrophobicContact CG-CD1 4.4Å; I49-L93 HydrophobicContact CD1-CD1 4.23Å; I49-L93 HydrophobicContact CG1-CD1 3.76Å; I49-L93 HydrophobicContact CG1-CD2 3.91Å; I49-L93 HydrophobicContact CG1-CG 4.42Å; L88-L93 HydrophobicContact CD1-CD1 4Å; A91-L93 HydrophobicContact CB-CD1 4.27Å; A91-L93 HydrophobicContact CB-CG 3.84Å; A91-L93 PolarHBondContact O-N 2.87Å; L93-I95 VanDerWaalsContact C-N 3.35Å; L93-I95 PolarHBondContact O-N 3.15Å; L93-R96 PolarHBondContact O-N 3.29Å
94	F	49.3	Very low	59.2	Low	48 Å²	48	51.9 Å²	51.9	21%	0.211	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-72.1	-21.3	176.1	-61.6	-76.6	0	0	0	114.5	L88 L89 N92 R96 Y97 L105	L88-F94 HydrophobicContact CD2-CZ 4.34Å; L88-F94 HydrophobicContact CG-CE2 4.17Å; L88-F94 HydrophobicContact CG-CZ 4.27Å; L89-F94 HydrophobicContact CD2-CD2 4.09Å; L89-F94 HydrophobicContact CD2-CE2 3.6Å; L89-F94 HydrophobicContact CD2-CZ 4.15Å; L89-F94 HydrophobicContact CG-CE2 4.33Å; N92-F94 PolarHBondContact O-N 3.1Å; N92-F94 VanDerWaalsContact O-N 3.08Å; F94-R96 PolarHBondContact O-N 3.04Å; F94-Y97 WeakPolarHBondContact O-CD2 3.19Å; F94-Y97 VanDerWaalsContact O-CE2 3.26Å; F94-Y97 WeakPolarHBondContact O-CE2 3.45Å; F94-Y97 PolarHBondContact O-N 3.3Å; F94-L105 HydrophobicContact CE1-CD1 3.57Å; F94-L105 HydrophobicContact CE1-CD2 3.68Å; F94-L105 HydrophobicContact CE1-CG 4.27Å; F94-L105 HydrophobicContact CZ-CD1 3.68Å; F94-L105 HydrophobicContact CZ-CD2 4.5Å
95	I	48.6	Very low	58.9	Low	120 Å²	120	52.9 Å²	52.9	62%	0.615	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-65.5	-20.7	175.9	-60.4	-175.1	0	0	0	110.2	N92 L93	N92-I95 HydrophobicContact CB-CD1 3.87Å; N92-I95 HydrophobicContact CB-CG1 4.16Å; N92-I95 WeakPolarHBondContact O-CB 3.41Å; N92-I95 PolarHBondContact O-N 3.07Å; N92-I95 WeakPolarHBondContact OD1-CD1 3.17Å; L93-I95 VanDerWaalsContact C-N 3.35Å; L93-I95 PolarHBondContact O-N 3.15Å
96	R	50.8	Low	58.8	Low	161 Å²	161	51.7 Å²	51.7	61%	0.608	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-109.9	69.1	171.5	-60.5	-178.4	-177.6	-177.9	4.5	109.5	L93 F94 S98 E99	L93-R96 PolarHBondContact O-N 3.29Å; F94-R96 PolarHBondContact O-N 3.04Å; R96-S98 PolarHBondContact O-N 2.95Å; R96-E99 HydrophobicContact CB-CB 4.42Å; R96-E99 HydrophobicContact CB-CG 3.85Å; R96-E99 WeakPolarHBondContact CD-OE1 3.37Å; R96-E99 IonicContact CZ-OE1 2.94Å; R96-E99 IonicContact NE-OE1 2.86Å; R96-E99 IonicContact NH1-OE1 3.81Å; R96-E99 PolarHBondContact NH1-OE1 3.42Å; R96-E99 WeakPolarHBondContact O-CB 3.32Å; R96-E99 PolarHBondContact O-N 3.44Å
97	Y	42.6	Very low	59	Low	159 Å²	159	50.8 Å²	50.8	62%	0.624	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-45.5	-24.1	178.7	-72.6	-83.4	0	0	0	115.1	F94 E99	F94-Y97 WeakPolarHBondContact O-CD2 3.19Å; F94-Y97 VanDerWaalsContact O-CE2 3.26Å; F94-Y97 WeakPolarHBondContact O-CE2 3.45Å; F94-Y97 PolarHBondContact O-N 3.3Å; Y97-E99 VanDerWaalsContact C-N 3.27Å; Y97-E99 PolarHBondContact O-N 2.79Å
98	S	50.9	Low	59	Low	111 Å²	111	50.8 Å²	50.8	78%	0.776	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-69.9	-15.6	173.9	52.8	0	0	0	0	114.9	R96	R96-S98 PolarHBondContact O-N 2.95Å
99	E	60	Low	58.8	Low	45 Å²	45	52 Å²	52	21%	0.21	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-86.9	-17.2	-173.6	-71	-176.3	-178.6	0	0	113.8	I49 K53 R96 Y97	I49-E99 HydrophobicContact CG2-CB 4.34Å; K53-E99 WeakPolarHBondContact CD-O 3.31Å; K53-E99 WeakPolarHBondContact CE-O 3.44Å; K53-E99 VanDerWaalsContact NZ-C 3.32Å; K53-E99 PolarHBondContact NZ-O 3.04Å; R96-E99 HydrophobicContact CB-CB 4.42Å; R96-E99 HydrophobicContact CB-CG 3.85Å; R96-E99 WeakPolarHBondContact CD-OE1 3.37Å; R96-E99 IonicContact CZ-OE1 2.94Å; R96-E99 IonicContact NE-OE1 2.86Å; R96-E99 IonicContact NH1-OE1 3.81Å; R96-E99 PolarHBondContact NH1-OE1 3.42Å; R96-E99 WeakPolarHBondContact O-CB 3.32Å; R96-E99 PolarHBondContact O-N 3.44Å; Y97-E99 VanDerWaalsContact C-N 3.27Å; Y97-E99 PolarHBondContact O-N 2.79Å
100	L	59.8	Low	58.8	Low	21 Å²	21	51.7 Å²	51.7	11%	0.11	26%	0.264	C	S	.	.	S	Bend	trans	-138.9	112.7	170.8	-74.5	175.3	0	0	0	109	F48 I49 K53 T104 L105	F48-L100 HydrophobicContact CE1-CD2 4.21Å; I49-L100 HydrophobicContact CD1-CD1 3.79Å; I49-L100 HydrophobicContact CD1-CD2 3.41Å; I49-L100 VanDerWaalsContact CD1-CD2 3.41Å; I49-L100 HydrophobicContact CD1-CG 3.46Å; I49-L100 VanDerWaalsContact CD1-CG 3.46Å; K53-L100 HydrophobicContact CD-CD2 4.15Å; K53-L100 HydrophobicContact CG-CD2 4.18Å; L100-T104 HydrophobicContact CD2-CG2 3.59Å; L100-L105 HydrophobicContact CD1-CD1 4.36Å
101	D	65	Low	59.1	Low	74 Å²	74	50.4 Å²	50.4	40%	0.396	25%	0.254	S	S	.	.			trans	-65.6	158.5	171.2	64.4	85.5	0	0	0	110.8	Y103 T104 L105	D101-Y103 PolarHBondContact O-N 3.13Å; D101-Y103 VanDerWaalsContact O-N 3.15Å; D101-Y103 WeakPolarHBondContact OD1-CA 3.43Å; D101-Y103 VanDerWaalsContact OD1-CB 3.27Å; D101-Y103 WeakPolarHBondContact OD1-CB 3.16Å; D101-Y103 PolarHBondContact OD1-N 3.47Å; D101-Y103 VanDerWaalsContact OD1-N 3.07Å; D101-T104 VanDerWaalsContact CG-OG1 3.25Å; D101-T104 PolarHBondContact O-N 2.94Å; D101-T104 VanDerWaalsContact O-N 3.16Å; D101-T104 PolarHBondContact OD1-N 3.48Å; D101-T104 PolarHBondContact OD1-OG1 2.85Å; D101-T104 WeakPolarHBondContact OD2-CB 3.28Å; D101-T104 PolarHBondContact OD2-OG1 2.9Å; D101-L105 PolarHBondContact O-N 2.67Å
102	T	57.5	Low	59.2	Low	90 Å²	90	50.1 Å²	50.1	55%	0.552	25%	0.252	S	S	*	.	H	α-helix	trans	-55.3	-34.8	-176.6	-50.6	0	0	0	0	112.8	G106	T102-G106 PolarHBondContact O-N 3.4Å
103	Y	61	Low	59.6	Low	31 Å²	31	47 Å²	47	12%	0.122	23%	0.234	C	C	.	.	H	α-helix	trans	-70.1	-50.8	179.5	168.5	-89.7	0	0	0	110.6	P59 D101 L105 G106 L107 N358	P59-Y103 WeakPolarHBondContact CA-OH 3.49Å; P59-Y103 WeakPolarHBondContact CB-OH 3.47Å; P59-Y103 HydrophobicContact CG-CE1 4.47Å; D101-Y103 PolarHBondContact O-N 3.13Å; D101-Y103 VanDerWaalsContact O-N 3.15Å; D101-Y103 WeakPolarHBondContact OD1-CA 3.43Å; D101-Y103 VanDerWaalsContact OD1-CB 3.27Å; D101-Y103 WeakPolarHBondContact OD1-CB 3.16Å; D101-Y103 PolarHBondContact OD1-N 3.47Å; D101-Y103 VanDerWaalsContact OD1-N 3.07Å; Y103-L105 VanDerWaalsContact C-N 3.3Å; Y103-L105 PolarHBondContact O-N 2.68Å; Y103-G106 PolarHBondContact O-N 2.91Å; Y103-L107 HydrophobicContact CE1-CD2 4.14Å; Y103-L107 WeakPolarHBondContact O-CB 3.5Å; Y103-L107 PolarHBondContact O-N 3.31Å; Y103-N358 HydrophobicContact CD2-CB 3.92Å; Y103-N358 HydrophobicContact CE2-CB 4.24Å
104	T	64.5	Low	60.2	Low	8 Å²	8	46.6 Å²	46.6	5%	0.049	23%	0.231	C	C	.	.	H	α-helix	trans	-59	-42.3	178.5	-59.8	0	0	0	0	111.2	K53 M56 M66 L100 D101 L107 L108	K53-T104 HydrophobicContact CG-CG2 4.43Å; M56-T104 HydrophobicContact SD-CG2 4.07Å; M66-T104 HydrophobicContact CE-CG2 3.49Å; M66-T104 VanDerWaalsContact CE-CG2 3.49Å; M66-T104 VanDerWaalsContact CE-O 3.28Å; M66-T104 WeakPolarHBondContact CE-O 3.3Å; L100-T104 HydrophobicContact CD2-CG2 3.59Å; D101-T104 VanDerWaalsContact CG-OG1 3.25Å; D101-T104 PolarHBondContact O-N 2.94Å; D101-T104 VanDerWaalsContact O-N 3.16Å; D101-T104 PolarHBondContact OD1-N 3.48Å; D101-T104 PolarHBondContact OD1-OG1 2.85Å; D101-T104 WeakPolarHBondContact OD2-CB 3.28Å; D101-T104 PolarHBondContact OD2-OG1 2.9Å; T104-L107 PolarHBondContact O-N 3.36Å; T104-L108 WeakPolarHBondContact O-CB 3.45Å; T104-L108 PolarHBondContact O-N 2.87Å
105	L	63.3	Low	61.1	Low	22 Å²	22	45.1 Å²	45.1	12%	0.115	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-45.7	176.5	-179.6	65.9	0	0	0	112.5	L88 F94 L100 D101 Y103 L107 L108 I109	L88-L105 HydrophobicContact CD2-CD1 4.49Å; F94-L105 HydrophobicContact CE1-CD1 3.57Å; F94-L105 HydrophobicContact CE1-CD2 3.68Å; F94-L105 HydrophobicContact CE1-CG 4.27Å; F94-L105 HydrophobicContact CZ-CD1 3.68Å; F94-L105 HydrophobicContact CZ-CD2 4.5Å; L100-L105 HydrophobicContact CD1-CD1 4.36Å; D101-L105 PolarHBondContact O-N 2.67Å; Y103-L105 VanDerWaalsContact C-N 3.3Å; Y103-L105 PolarHBondContact O-N 2.68Å; L105-L107 VanDerWaalsContact C-N 3.3Å; L105-L107 PolarHBondContact O-N 2.83Å; L105-L108 PolarHBondContact O-N 2.76Å; L105-I109 HydrophobicContact CD1-CD1 4.01Å; L105-I109 HydrophobicContact CD1-CG1 4.29Å; L105-I109 HydrophobicContact CG-CD1 3.93Å; L105-I109 WeakPolarHBondContact O-CG1 3.44Å; L105-I109 PolarHBondContact O-N 3.28Å
106	G	62	Low	61.9	Low	3 Å²	3	39.6 Å²	39.6	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-39.6	178.8	0	0	0	0	0	112.3	T102 Y103 S110	T102-G106 PolarHBondContact O-N 3.4Å; Y103-G106 PolarHBondContact O-N 2.91Å; G106-S110 WeakPolarHBondContact O-CB 3.43Å; G106-S110 PolarHBondContact O-N 2.97Å; G106-S110 PolarHBondContact O-OG 3.32Å
107	L	65.3	Low	62.6	Low	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-66.8	-42.8	174.5	-169.6	65.3	0	0	0	111.7	A62 Y63 M66 Y103 T104 L105 S110 T111 W359 F362	A62-L107 HydrophobicContact CB-CD2 3.51Å; Y63-L107 HydrophobicContact CD2-CD1 3.88Å; Y63-L107 HydrophobicContact CD2-CG 4.46Å; Y63-L107 HydrophobicContact CG-CD1 4.41Å; M66-L107 HydrophobicContact CE-CB 4.13Å; M66-L107 HydrophobicContact CE-CD2 4.07Å; M66-L107 HydrophobicContact CE-CG 4.28Å; M66-L107 HydrophobicContact SD-CB 3.97Å; M66-L107 HydrophobicContact SD-CD2 3.91Å; M66-L107 HydrophobicContact SD-CG 3.71Å; Y103-L107 HydrophobicContact CE1-CD2 4.14Å; Y103-L107 WeakPolarHBondContact O-CB 3.5Å; Y103-L107 PolarHBondContact O-N 3.31Å; T104-L107 PolarHBondContact O-N 3.36Å; L105-L107 VanDerWaalsContact C-N 3.3Å; L105-L107 PolarHBondContact O-N 2.83Å; L107-S110 PolarHBondContact O-N 3.03Å; L107-T111 WeakPolarHBondContact O-CB 3.41Å; L107-T111 PolarHBondContact O-N 2.74Å; L107-T111 PolarHBondContact O-OG1 3.3Å; L107-W359 HydrophobicContact CD1-CH2 4.39Å; L107-F362 HydrophobicContact CD1-CE1 4.13Å; L107-F362 HydrophobicContact CD1-CZ 4.19Å
108	L	69.2	Low	63.6	Low	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.5	-49.3	178.2	179.3	62.2	0	0	0	111.2	W45 F48 M66 L88 T104 L105 S110 T111 I112	W45-L108 HydrophobicContact CH2-CD1 4.34Å; W45-L108 HydrophobicContact CH2-CD2 4.49Å; W45-L108 HydrophobicContact CZ3-CD1 4.02Å; W45-L108 HydrophobicContact CZ3-CD2 3.93Å; W45-L108 HydrophobicContact CZ3-CG 4.45Å; F48-L108 HydrophobicContact CE1-CD1 4.46Å; F48-L108 HydrophobicContact CE1-CD2 3.89Å; F48-L108 HydrophobicContact CE2-CD1 4.09Å; F48-L108 HydrophobicContact CZ-CD1 3.84Å; F48-L108 HydrophobicContact CZ-CD2 4.06Å; F48-L108 HydrophobicContact CZ-CG 4.44Å; M66-L108 HydrophobicContact CB-CD1 4.41Å; M66-L108 HydrophobicContact CE-CB 4.02Å; M66-L108 HydrophobicContact CG-CD1 4.03Å; M66-L108 WeakPolarHBondContact SD-CA 3.32Å; M66-L108 HydrophobicContact SD-CB 3.84Å; M66-L108 HydrophobicContact SD-CD1 4.22Å; M66-L108 PolarHBondContact SD-N 3.37Å; M66-L108 VanDerWaalsContact SD-N 3.36Å; L88-L108 HydrophobicContact CD1-CD2 3.89Å; L88-L108 HydrophobicContact CD2-CD2 3.9Å; T104-L108 WeakPolarHBondContact O-CB 3.45Å; T104-L108 PolarHBondContact O-N 2.87Å; L105-L108 PolarHBondContact O-N 2.76Å; L108-S110 VanDerWaalsContact C-N 3.31Å; L108-S110 PolarHBondContact O-N 3.33Å; L108-T111 PolarHBondContact O-N 3.18Å; L108-I112 HydrophobicContact CD1-CD1 4.13Å; L108-I112 HydrophobicContact CD1-CG1 4.22Å; L108-I112 HydrophobicContact CG-CD1 3.86Å; L108-I112 HydrophobicContact CG-CG1 4.39Å; L108-I112 VanDerWaalsContact O-CG1 3.26Å; L108-I112 WeakPolarHBondContact O-CG1 3.11Å; L108-I112 PolarHBondContact O-N 3.3Å
109	I	65.5	Low	64.2	Low	24 Å²	24	22.8 Å²	22.8	12%	0.123	12%	0.12	C	C	.	.	H	α-helix	trans	-60.8	-42.7	177.5	-68.5	169.7	0	0	0	110.9	W13 L85 L105 T111 I112 K113	W13-I109 HydrophobicContact CH2-CD1 4.13Å; W13-I109 HydrophobicContact CZ3-CD1 4.29Å; L85-I109 HydrophobicContact CD1-CG1 4.45Å; L105-I109 HydrophobicContact CD1-CD1 4.01Å; L105-I109 HydrophobicContact CD1-CG1 4.29Å; L105-I109 HydrophobicContact CG-CD1 3.93Å; L105-I109 WeakPolarHBondContact O-CG1 3.44Å; L105-I109 PolarHBondContact O-N 3.28Å; I109-T111 VanDerWaalsContact C-N 3.29Å; I109-T111 PolarHBondContact O-N 3.14Å; I109-I112 PolarHBondContact O-N 3.2Å; I109-K113 VanDerWaalsContact O-CB 3.28Å; I109-K113 WeakPolarHBondContact O-CB 3.37Å; I109-K113 PolarHBondContact O-N 2.94Å
110	S	62.5	Low	64.3	Low	18 Å²	18	23.1 Å²	23.1	13%	0.126	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-41.4	177.4	-62.6	0	0	0	0	111.4	G106 L107 L108 K113 E114	G106-S110 WeakPolarHBondContact O-CB 3.43Å; G106-S110 PolarHBondContact O-N 2.97Å; G106-S110 PolarHBondContact O-OG 3.32Å; L107-S110 PolarHBondContact O-N 3.03Å; L108-S110 VanDerWaalsContact C-N 3.31Å; L108-S110 PolarHBondContact O-N 3.33Å; S110-K113 PolarHBondContact O-N 3.19Å; S110-E114 WeakPolarHBondContact O-CB 3.27Å; S110-E114 PolarHBondContact O-N 2.72Å
111	T	67.7	Low	64.4	Low	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-71.6	-43.9	179.5	-47.7	0	0	0	0	112	Y63 M66 R67 L70 L107 L108 I109 K113 E114 K115	Y63-T111 HydrophobicContact CD2-CG2 4.41Å; Y63-T111 WeakPolarHBondContact CD2-OG1 3.47Å; Y63-T111 HydrophobicContact CE2-CG2 4.25Å; M66-T111 HydrophobicContact CB-CG2 4.07Å; R67-T111 HydrophobicContact CB-CG2 4.22Å; R67-T111 HydrophobicContact CG-CG2 3.35Å; L70-T111 HydrophobicContact CD1-CG2 3.64Å; L107-T111 WeakPolarHBondContact O-CB 3.41Å; L107-T111 PolarHBondContact O-N 2.74Å; L107-T111 PolarHBondContact O-OG1 3.3Å; L108-T111 PolarHBondContact O-N 3.18Å; I109-T111 VanDerWaalsContact C-N 3.29Å; I109-T111 PolarHBondContact O-N 3.14Å; T111-K113 PolarHBondContact O-N 2.86Å; T111-E114 PolarHBondContact O-N 3.13Å; T111-K115 HydrophobicContact CG2-CG 4.41Å; T111-K115 WeakPolarHBondContact O-CB 3.37Å; T111-K115 VanDerWaalsContact O-CG 3.29Å; T111-K115 WeakPolarHBondContact O-CG 3.39Å; T111-K115 PolarHBondContact O-N 2.94Å
112	I	66.9	Low	64.4	Low	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-54.2	-47.8	172.5	-70.4	167.4	0	0	0	109.3	W45 L70 F81 C84 L88 L108 I109 K115 C116	W45-I112 HydrophobicContact CH2-CD1 3.74Å; W45-I112 HydrophobicContact CH2-CG1 4.32Å; W45-I112 HydrophobicContact CZ2-CD1 4.29Å; L70-I112 HydrophobicContact CD1-CB 4.34Å; L70-I112 HydrophobicContact CD1-CG1 3.72Å; L70-I112 HydrophobicContact CD2-CG1 3.65Å; L70-I112 HydrophobicContact CG-CG1 4.34Å; F81-I112 HydrophobicContact CD2-CG2 3.8Å; F81-I112 HydrophobicContact CE2-CG2 3.92Å; C84-I112 HydrophobicContact CB-CG2 4.02Å; C84-I112 VanDerWaalsContact SG-CG2 3.54Å; L88-I112 HydrophobicContact CD2-CD1 4.01Å; L108-I112 HydrophobicContact CD1-CD1 4.13Å; L108-I112 HydrophobicContact CD1-CG1 4.22Å; L108-I112 HydrophobicContact CG-CD1 3.86Å; L108-I112 HydrophobicContact CG-CG1 4.39Å; L108-I112 VanDerWaalsContact O-CG1 3.26Å; L108-I112 WeakPolarHBondContact O-CG1 3.11Å; L108-I112 PolarHBondContact O-N 3.3Å; I109-I112 PolarHBondContact O-N 3.2Å; I112-K115 PolarHBondContact O-N 3.3Å; I112-C116 WeakPolarHBondContact O-CB 3.48Å; I112-C116 PolarHBondContact O-N 2.97Å; I112-C116 PolarHBondContact O-SG 3.05Å; I112-C116 VanDerWaalsContact O-SG 3.38Å
113	K	65.2	Low	64.6	Low	37 Å²	37	28.7 Å²	28.7	16%	0.161	13%	0.129	C	C	.	.	H	α-helix	trans	-62.5	-50.5	-178.9	-169.6	165.1	-168.2	-175.5	0	112.1	F81 I109 S110 T111 K115 D117 H182	F81-K113 HydrophobicContact CD2-CB 4.18Å; F81-K113 HydrophobicContact CD2-CG 4.32Å; F81-K113 HydrophobicContact CE2-CB 3.7Å; F81-K113 HydrophobicContact CE2-CD 4.44Å; F81-K113 HydrophobicContact CE2-CG 4Å; I109-K113 VanDerWaalsContact O-CB 3.28Å; I109-K113 WeakPolarHBondContact O-CB 3.37Å; I109-K113 PolarHBondContact O-N 2.94Å; S110-K113 PolarHBondContact O-N 3.19Å; T111-K113 PolarHBondContact O-N 2.86Å; K113-K115 VanDerWaalsContact C-N 3.3Å; K113-K115 PolarHBondContact O-N 3.08Å; K113-D117 WeakPolarHBondContact CG-OD2 3.43Å; K113-D117 WeakPolarHBondContact O-CB 2.94Å; K113-D117 PolarHBondContact O-N 3.02Å; K113-H182 VanDerWaalsContact CD-CE1 3.49Å; K113-H182 WeakPolarHBondContact CD-CE1 2.78Å; K113-H182 WeakPolarHBondContact CD-ND1 3.39Å; K113-H182 VanDerWaalsContact CE-CD2 3.41Å; K113-H182 WeakPolarHBondContact CE-CD2 2.89Å; K113-H182 WeakPolarHBondContact CE-CE1 3.19Å; K113-H182 WeakPolarHBondContact CE-NE2 2.72Å; K113-H182 HydrophobicContact CG-CB 4.34Å; K113-H182 PolarHBondContact NZ-CE1 2.85Å; K113-H182 PolarHBondContact NZ-NE2 2.92Å
114	E	67.2	Low	64.4	Low	4 Å²	4	32.7 Å²	32.7	2%	0.019	15%	0.152	C	C	.	.	H	α-helix	trans	-51.9	-49.8	175.2	174.6	-172.7	154.7	0	0	111.6	Y63 R67 S110 T111 D117 H118 H182	Y63-E114 PolarHBondContact OH-OE1 3.47Å; Y63-E114 VanDerWaalsContact OH-OE1 3.09Å; Y63-E114 PolarHBondContact OH-OE2 3.3Å; R67-E114 IonicContact CZ-OE1 3.29Å; R67-E114 IonicContact NE-OE1 3.79Å; R67-E114 IonicContact NH1-OE1 2.64Å; R67-E114 PolarHBondContact NH1-OE1 3.18Å; R67-E114 IonicContact NH2-OE1 2.67Å; R67-E114 PolarHBondContact NH2-OE1 2.96Å; S110-E114 WeakPolarHBondContact O-CB 3.27Å; S110-E114 PolarHBondContact O-N 2.72Å; T111-E114 PolarHBondContact O-N 3.13Å; E114-D117 PolarHBondContact O-N 3.34Å; E114-H118 PolarHBondContact O-CD2 3.39Å; E114-H118 PolarHBondContact O-N 3.5Å; E114-H118 IonicContact OE1-NE2 3.42Å; E114-H182 VanDerWaalsContact CA-O 3.29Å; E114-H182 WeakPolarHBondContact CA-O 3.36Å; E114-H182 VanDerWaalsContact CB-O 3.23Å; E114-H182 WeakPolarHBondContact CB-O 3.39Å; E114-H182 VanDerWaalsContact CG-O 3.29Å; E114-H182 WeakPolarHBondContact CG-O 3.16Å
115	K	68.7	Low	64.2	Low	17 Å²	17	33.9 Å²	33.9	7%	0.074	16%	0.157	C	C	.	.	H	α-helix	trans	-69.6	-46.3	-174.6	-70.1	-59.5	-169.8	162.5	0	113.3	L70 D71 V75 T111 I112 K113 D117 H118 V119	L70-K115 HydrophobicContact CB-CG 4.27Å; L70-K115 HydrophobicContact CD1-CG 4.48Å; D71-K115 WeakPolarHBondContact OD1-CD 3.49Å; D71-K115 WeakPolarHBondContact OD1-CE 3.49Å; D71-K115 IonicContact OD1-NZ 3.87Å; D71-K115 PolarHBondContact OD1-NZ 3.15Å; D71-K115 IonicContact OD2-NZ 3.96Å; D71-K115 PolarHBondContact OD2-NZ 2.93Å; V75-K115 HydrophobicContact CG2-CB 3.77Å; V75-K115 HydrophobicContact CG2-CD 4.32Å; V75-K115 HydrophobicContact CG2-CG 4.36Å; T111-K115 HydrophobicContact CG2-CG 4.41Å; T111-K115 WeakPolarHBondContact O-CB 3.37Å; T111-K115 VanDerWaalsContact O-CG 3.29Å; T111-K115 WeakPolarHBondContact O-CG 3.39Å; T111-K115 PolarHBondContact O-N 2.94Å; I112-K115 PolarHBondContact O-N 3.3Å; K113-K115 VanDerWaalsContact C-N 3.3Å; K113-K115 PolarHBondContact O-N 3.08Å; K115-D117 VanDerWaalsContact C-N 3.29Å; K115-D117 PolarHBondContact O-N 2.8Å; K115-H118 WeakPolarHBondContact O-CB 3.26Å; K115-H118 PolarHBondContact O-N 3.26Å; K115-V119 PolarHBondContact O-N 3.35Å
116	C	65	Low	64.1	Low	4 Å²	4	36 Å²	36	3%	0.027	17%	0.173	C	C	.	.	H	α-helix	trans	-67.1	-34.4	176.2	-65.6	0	0	0	0	111.3	F81 I112 H118 V119 V120	F81-C116 VanDerWaalsContact CA-SG 3.56Å; F81-C116 HydrophobicContact CB-CB 3.57Å; F81-C116 HydrophobicContact CD2-CB 4.28Å; F81-C116 HydrophobicContact CG-CB 4.44Å; I112-C116 WeakPolarHBondContact O-CB 3.48Å; I112-C116 PolarHBondContact O-N 2.97Å; I112-C116 PolarHBondContact O-SG 3.05Å; I112-C116 VanDerWaalsContact O-SG 3.38Å; C116-H118 VanDerWaalsContact C-N 3.35Å; C116-V119 WeakPolarHBondContact O-CB 3.26Å; C116-V119 PolarHBondContact O-N 3.46Å; C116-V119 VanDerWaalsContact O-N 3.16Å; C116-V120 WeakPolarHBondContact O-CG2 2.95Å; C116-V120 PolarHBondContact O-N 2.87Å
117	D	65.1	Low	64.2	Low	30 Å²	30	40.2 Å²	40.2	16%	0.16	19%	0.192	C	C	.	.	H	α-helix	trans	-69.2	-31.3	174.4	-73.4	-18.1	0	0	0	111.9	K113 E114 K115 V119 V120 A121 H182	K113-D117 WeakPolarHBondContact CG-OD2 3.43Å; K113-D117 WeakPolarHBondContact O-CB 2.94Å; K113-D117 PolarHBondContact O-N 3.02Å; E114-D117 PolarHBondContact O-N 3.34Å; K115-D117 VanDerWaalsContact C-N 3.29Å; K115-D117 PolarHBondContact O-N 2.8Å; D117-V119 VanDerWaalsContact C-N 3.32Å; D117-V119 PolarHBondContact O-N 2.94Å; D117-V120 PolarHBondContact O-N 2.92Å; D117-A121 WeakPolarHBondContact O-CB 3.44Å; D117-A121 PolarHBondContact O-N 3.4Å; D117-H182 HydrophobicContact CB-CB 3.98Å; D117-H182 WeakPolarHBondContact OD2-CB 3.37Å; D117-H182 IonicContact OD2-CD2 3.58Å; D117-H182 PolarHBondContact OD2-CD2 3.4Å; D117-H182 VanDerWaalsContact OD2-CD2 3.23Å; D117-H182 IonicContact OD2-CG 3.63Å
118	H	64.2	Low	64	Low	35 Å²	35	40.2 Å²	40.2	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-40.3	168.1	-84.6	-69.8	0	0	0	112	E114 K115 C116 A121 R122 Y129 F183	E114-H118 PolarHBondContact O-CD2 3.39Å; E114-H118 PolarHBondContact O-N 3.5Å; E114-H118 IonicContact OE1-NE2 3.42Å; K115-H118 WeakPolarHBondContact O-CB 3.26Å; K115-H118 PolarHBondContact O-N 3.26Å; C116-H118 VanDerWaalsContact C-N 3.35Å; H118-A121 PolarHBondContact O-N 3.49Å; H118-R122 WeakPolarHBondContact O-CB 3.49Å; H118-R122 PolarHBondContact O-N 2.96Å; H118-Y129 AromaticContact ND1-CE2 3.76Å; H118-F183 PolarHBondContact CE1-O 3.08Å
119	V	63.9	Low	63.7	Low	13 Å²	13	42.8 Å²	42.8	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-45.1	176.1	177.2	0	0	0	0	110.4	V75 K115 C116 D117 R122 R123	V75-V119 HydrophobicContact CG1-CG2 3.87Å; K115-V119 PolarHBondContact O-N 3.35Å; C116-V119 WeakPolarHBondContact O-CB 3.26Å; C116-V119 PolarHBondContact O-N 3.46Å; C116-V119 VanDerWaalsContact O-N 3.16Å; D117-V119 VanDerWaalsContact C-N 3.32Å; D117-V119 PolarHBondContact O-N 2.94Å; V119-R122 PolarHBondContact O-N 3.4Å; V119-R123 HydrophobicContact CG1-CG 4.47Å; V119-R123 WeakPolarHBondContact O-CB 2.81Å; V119-R123 VanDerWaalsContact O-CG 3.3Å; V119-R123 WeakPolarHBondContact O-CG 3.28Å; V119-R123 PolarHBondContact O-N 3.39Å
120	V	61.7	Low	63.6	Low	52 Å²	52	48.8 Å²	48.8	32%	0.315	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-46.9	176.6	175.4	0	0	0	0	111	C116 D117 R122 R123 L124	C116-V120 WeakPolarHBondContact O-CG2 2.95Å; C116-V120 PolarHBondContact O-N 2.87Å; D117-V120 PolarHBondContact O-N 2.92Å; V120-R122 PolarHBondContact O-N 2.93Å; V120-R123 PolarHBondContact O-N 2.9Å; V120-L124 HydrophobicContact CG1-CD1 3.78Å; V120-L124 HydrophobicContact CG1-CG 4.34Å; V120-L124 WeakPolarHBondContact O-CB 3.39Å; V120-L124 PolarHBondContact O-N 3.15Å
121	A	61.7	Low	63.8	Low	0 Å²	0	50 Å²	50	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.4	-45.1	177.3	0	0	0	0	0	111.1	D117 H118 R123 F125 S126 F178	D117-A121 WeakPolarHBondContact O-CB 3.44Å; D117-A121 PolarHBondContact O-N 3.4Å; H118-A121 PolarHBondContact O-N 3.49Å; A121-R123 PolarHBondContact O-N 3.26Å; A121-F125 CarbonylContact O-C 3.49Å; A121-F125 WeakPolarHBondContact O-CA 3.49Å; A121-F125 VanDerWaalsContact O-CB 3.28Å; A121-F125 WeakPolarHBondContact O-CB 3.45Å; A121-F125 PolarHBondContact O-N 3.48Å; A121-S126 PolarHBondContact O-N 2.88Å; A121-F178 HydrophobicContact CB-CE2 4.17Å; A121-F178 HydrophobicContact CB-CZ 4.09Å
122	R	65.2	Low	63.8	Low	165 Å²	165	50.5 Å²	50.5	62%	0.623	24%	0.24	S	C	*	.	H	α-helix	trans	-61.7	-41.5	176.3	-176.8	179.2	176	-175.9	-0.5	112.4	H118 V119 V120 Y129	H118-R122 WeakPolarHBondContact O-CB 3.49Å; H118-R122 PolarHBondContact O-N 2.96Å; V119-R122 PolarHBondContact O-N 3.4Å; V120-R122 PolarHBondContact O-N 2.93Å; R122-Y129 HydrophobicContact CB-CD1 4.17Å; R122-Y129 HydrophobicContact CB-CD2 4.19Å; R122-Y129 HydrophobicContact CB-CE1 4.25Å; R122-Y129 HydrophobicContact CB-CE2 4.31Å; R122-Y129 HydrophobicContact CB-CG 4.14Å; R122-Y129 HydrophobicContact CG-CD1 3.99Å; R122-Y129 HydrophobicContact CG-CE1 4Å; R122-Y129 HydrophobicContact CG-CG 4.43Å
123	R	61.5	Low	63.7	Low	138 Å²	138	54 Å²	54	52%	0.521	26%	0.258	S	S	.	.	H	α-helix	trans	-77	-48.2	-176.8	-73.3	-178.7	-172	170.5	10.7	113.2	N78 V119 V120 A121	N78-R123 PolarHBondContact O-NH2 3.33Å; N78-R123 PolarHBondContact OD1-NH2 2.57Å; V119-R123 HydrophobicContact CG1-CG 4.47Å; V119-R123 WeakPolarHBondContact O-CB 2.81Å; V119-R123 VanDerWaalsContact O-CG 3.3Å; V119-R123 WeakPolarHBondContact O-CG 3.28Å; V119-R123 PolarHBondContact O-N 3.39Å; V120-R123 PolarHBondContact O-N 2.9Å; A121-R123 PolarHBondContact O-N 3.26Å
124	L	56.3	Low	63.8	Low	115 Å²	115	56.5 Å²	56.5	60%	0.602	28%	0.28	S	S	*	.	H	α-helix	trans	-96.3	-22.4	-170.8	-60.5	-176.8	0	0	0	113	V120	V120-L124 HydrophobicContact CG1-CD1 3.78Å; V120-L124 HydrophobicContact CG1-CG 4.34Å; V120-L124 WeakPolarHBondContact O-CB 3.39Å; V120-L124 PolarHBondContact O-N 3.15Å
125	F	59.5	Low	63.6	Low	32 Å²	32	57.2 Å²	57.2	14%	0.14	28%	0.284	C	S	.	.			trans	-134.9	42.3	-168	-61.6	-60.8	0	0	0	110.3	A121 H127 F128 Y129 C173 F178	A121-F125 CarbonylContact O-C 3.49Å; A121-F125 WeakPolarHBondContact O-CA 3.49Å; A121-F125 VanDerWaalsContact O-CB 3.28Å; A121-F125 WeakPolarHBondContact O-CB 3.45Å; A121-F125 PolarHBondContact O-N 3.48Å; F125-H127 PolarHBondContact O-N 2.87Å; F125-F128 HydrophobicContact CB-CD2 3.46Å; F125-F128 VanDerWaalsContact CB-CD2 3.46Å; F125-F128 HydrophobicContact CB-CE2 3.75Å; F125-F128 HydrophobicContact CB-CG 4.3Å; F125-F128 HydrophobicContact CD1-CD2 4.2Å; F125-F128 AromaticContact CD1-CE2 3.57Å; F125-F128 HydrophobicContact CD1-CE2 3.57Å; F125-F128 HydrophobicContact CD1-CZ 4.35Å; F125-F128 HydrophobicContact CE1-CE2 4.49Å; F125-F128 HydrophobicContact CG-CD2 4.18Å; F125-F128 AromaticContact CG-CE2 3.95Å; F125-F128 HydrophobicContact CG-CE2 3.95Å; F125-F128 WeakPolarHBondContact O-CB 3.47Å; F125-F128 WeakPolarHBondContact O-CD2 3.14Å; F125-F128 PolarHBondContact O-N 3.31Å; F125-Y129 PolarHBondContact O-N 3.26Å; F125-C173 HydrophobicContact CE1-CB 4.46Å; F125-F178 AromaticContact CD2-CD2 3.83Å; F125-F178 HydrophobicContact CD2-CD2 3.83Å; F125-F178 AromaticContact CD2-CE2 3.73Å; F125-F178 HydrophobicContact CD2-CE2 3.73Å; F125-F178 HydrophobicContact CD2-CG 4.38Å; F125-F178 HydrophobicContact CD2-CZ 4.16Å; F125-F178 HydrophobicContact CE2-CB 4.35Å; F125-F178 AromaticContact CE2-CD2 3.65Å; F125-F178 HydrophobicContact CE2-CD2 3.65Å; F125-F178 HydrophobicContact CE2-CE2 4.05Å; F125-F178 HydrophobicContact CE2-CG 4.11Å; F125-F178 HydrophobicContact CZ-CB 4.34Å; F125-F178 HydrophobicContact CZ-CD2 4.44Å; F125-F178 HydrophobicContact CZ-CG 4.48Å
126	S	61.9	Low	63.6	Low	67 Å²	67	62.1 Å²	62.1	47%	0.469	31%	0.305	S	S	.	.	H	α-helix	trans	-52.6	-32.7	-174.2	57.5	0	0	0	0	114	A121 F128 Y129	A121-S126 PolarHBondContact O-N 2.88Å; S126-F128 PolarHBondContact O-N 3.5Å; S126-Y129 PolarHBondContact O-N 3.28Å; S126-Y129 VanDerWaalsContact O-N 3.16Å
127	H	65	Low	63.8	Low	91 Å²	91	62.4 Å²	62.4	42%	0.421	31%	0.306	S	S	.	.	H	α-helix	trans	-70.8	-15.8	-179.6	15.1	-57	0	0	0	112.7	F125 P131 Y162	F125-H127 PolarHBondContact O-N 2.87Å; H127-P131 WeakPolarHBondContact O-CD 3.22Å; H127-Y162 PolarHBondContact O-OH 2.93Å
128	F	61.3	Low	63.8	Low	1 Å²	1	65.6 Å²	65.6	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-92.1	-33.6	169.3	-63.7	-103.8	0	0	0	113	F125 S126 E130 P131 I132 Y162 W163 Y166 F178	F125-F128 HydrophobicContact CB-CD2 3.46Å; F125-F128 VanDerWaalsContact CB-CD2 3.46Å; F125-F128 HydrophobicContact CB-CE2 3.75Å; F125-F128 HydrophobicContact CB-CG 4.3Å; F125-F128 HydrophobicContact CD1-CD2 4.2Å; F125-F128 AromaticContact CD1-CE2 3.57Å; F125-F128 HydrophobicContact CD1-CE2 3.57Å; F125-F128 HydrophobicContact CD1-CZ 4.35Å; F125-F128 HydrophobicContact CE1-CE2 4.49Å; F125-F128 HydrophobicContact CG-CD2 4.18Å; F125-F128 AromaticContact CG-CE2 3.95Å; F125-F128 HydrophobicContact CG-CE2 3.95Å; F125-F128 WeakPolarHBondContact O-CB 3.47Å; F125-F128 WeakPolarHBondContact O-CD2 3.14Å; F125-F128 PolarHBondContact O-N 3.31Å; S126-F128 PolarHBondContact O-N 3.5Å; F128-E130 PolarHBondContact O-N 3.36Å; F128-P131 WeakPolarHBondContact O-CD 3.34Å; F128-I132 HydrophobicContact CB-CD1 4.39Å; F128-I132 WeakPolarHBondContact O-CD1 3.32Å; F128-I132 VanDerWaalsContact O-CG1 3.3Å; F128-I132 WeakPolarHBondContact O-CG1 3.49Å; F128-I132 PolarHBondContact O-N 3.01Å; F128-Y162 WeakPolarHBondContact CA-OH 3.35Å; F128-Y162 HydrophobicContact CD1-CE1 4.14Å; F128-W163 HydrophobicContact CD1-CH2 4.06Å; F128-W163 AromaticContact CE1-CH2 3.9Å; F128-W163 HydrophobicContact CE1-CH2 3.9Å; F128-W163 HydrophobicContact CE1-CZ3 4.01Å; F128-Y166 HydrophobicContact CD1-CD2 4.05Å; F128-Y166 HydrophobicContact CD1-CE2 4.09Å; F128-Y166 AromaticContact CE1-CD1 3.83Å; F128-Y166 HydrophobicContact CE1-CD1 3.83Å; F128-Y166 AromaticContact CE1-CD2 3.3Å; F128-Y166 HydrophobicContact CE1-CD2 3.3Å; F128-Y166 AromaticContact CE1-CE1 3.68Å; F128-Y166 HydrophobicContact CE1-CE1 3.68Å; F128-Y166 AromaticContact CE1-CE2 3.08Å; F128-Y166 HydrophobicContact CE1-CE2 3.08Å; F128-Y166 AromaticContact CE1-CG 3.71Å; F128-Y166 HydrophobicContact CE1-CG 3.71Å; F128-Y166 AromaticContact CE1-CZ 3.33Å; F128-Y166 AromaticContact CE2-CE2 3.71Å; F128-Y166 HydrophobicContact CE2-CE2 3.71Å; F128-Y166 HydrophobicContact CZ-CD1 4.35Å; F128-Y166 AromaticContact CZ-CD2 3.72Å; F128-Y166 HydrophobicContact CZ-CD2 3.72Å; F128-Y166 AromaticContact CZ-CE1 3.73Å; F128-Y166 HydrophobicContact CZ-CE1 3.73Å; F128-Y166 AromaticContact CZ-CE2 2.95Å; F128-Y166 HydrophobicContact CZ-CE2 2.95Å; F128-Y166 HydrophobicContact CZ-CG 4.38Å; F128-Y166 AromaticContact CZ-CZ 2.99Å; F128-Y166 WeakPolarHBondContact CZ-OH 3.46Å; F128-F178 HydrophobicContact CD1-CE1 4.48Å; F128-F178 HydrophobicContact CE1-CE1 4.27Å; F128-F178 HydrophobicContact CZ-CD1 4.47Å; F128-F178 HydrophobicContact CZ-CE1 4.37Å
129	Y	62.1	Low	63.8	Low	55 Å²	55	65.4 Å²	65.4	22%	0.216	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-41.5	-170.1	-170.3	-111	0	0	0	111.2	H118 R122 F125 S126 L133	H118-Y129 AromaticContact ND1-CE2 3.76Å; R122-Y129 HydrophobicContact CB-CD1 4.17Å; R122-Y129 HydrophobicContact CB-CD2 4.19Å; R122-Y129 HydrophobicContact CB-CE1 4.25Å; R122-Y129 HydrophobicContact CB-CE2 4.31Å; R122-Y129 HydrophobicContact CB-CG 4.14Å; R122-Y129 HydrophobicContact CG-CD1 3.99Å; R122-Y129 HydrophobicContact CG-CE1 4Å; R122-Y129 HydrophobicContact CG-CG 4.43Å; F125-Y129 PolarHBondContact O-N 3.26Å; S126-Y129 PolarHBondContact O-N 3.28Å; S126-Y129 VanDerWaalsContact O-N 3.16Å; Y129-L133 HydrophobicContact CD1-CD1 3.51Å; Y129-L133 HydrophobicContact CD1-CG 4.12Å; Y129-L133 HydrophobicContact CE1-CD1 3.13Å; Y129-L133 HydrophobicContact CE1-CD2 4.4Å; Y129-L133 HydrophobicContact CE1-CG 3.86Å; Y129-L133 HydrophobicContact CE2-CD1 4.43Å; Y129-L133 HydrophobicContact CE2-CD2 4.45Å; Y129-L133 HydrophobicContact CE2-CG 4.29Å; Y129-L133 HydrophobicContact CG-CD1 4.31Å; Y129-L133 HydrophobicContact CG-CG 4.46Å; Y129-L133 VanDerWaalsContact O-CB 3.3Å; Y129-L133 WeakPolarHBondContact O-CB 3.37Å; Y129-L133 VanDerWaalsContact O-CG 3.27Å; Y129-L133 WeakPolarHBondContact O-CG 2.96Å; Y129-L133 PolarHBondContact O-N 2.72Å
130	E	64.4	Low	63.8	Low	150 Å²	150	66.7 Å²	66.7	70%	0.701	33%	0.333	S	S	*	.	H	α-helix	trans	-67	-50.4	-178.4	-179.1	175.6	-158.3	0	0	113.7	F128 I132 L133 S134	F128-E130 PolarHBondContact O-N 3.36Å; E130-I132 VanDerWaalsContact C-N 3.31Å; E130-I132 PolarHBondContact O-N 3Å; E130-L133 PolarHBondContact O-N 3.15Å; E130-S134 PolarHBondContact O-N 3.49Å
131	P	66	Low	63.5	Low	42 Å²	42	72.2 Å²	72.2	27%	0.273	36%	0.355	S	S	.	.	H	α-helix	trans	-56.2	-42.4	173.5	-27.4	34.3	0	0	0	113.3	H127 F128 S134 L135 Y162	H127-P131 WeakPolarHBondContact O-CD 3.22Å; F128-P131 WeakPolarHBondContact O-CD 3.34Å; P131-S134 WeakPolarHBondContact O-CB 3.29Å; P131-S134 PolarHBondContact O-N 3.32Å; P131-S134 PolarHBondContact O-OG 3.03Å; P131-L135 PolarHBondContact O-N 3.2Å; P131-Y162 HydrophobicContact CB-CD2 4.47Å; P131-Y162 HydrophobicContact CB-CE2 4.05Å; P131-Y162 HydrophobicContact CG-CE2 4.04Å
132	I	67.2	Low	63.5	Low	12 Å²	12	77.2 Å²	77.2	6%	0.062	38%	0.382	C	S	.	.	H	α-helix	trans	-71.3	-37.1	-177.6	-65.2	170.3	0	0	0	111.1	F128 E130 S134 L135 K136 L159 W163 F183 L184	F128-I132 HydrophobicContact CB-CD1 4.39Å; F128-I132 WeakPolarHBondContact O-CD1 3.32Å; F128-I132 VanDerWaalsContact O-CG1 3.3Å; F128-I132 WeakPolarHBondContact O-CG1 3.49Å; F128-I132 PolarHBondContact O-N 3.01Å; E130-I132 VanDerWaalsContact C-N 3.31Å; E130-I132 PolarHBondContact O-N 3Å; I132-S134 VanDerWaalsContact C-N 3.32Å; I132-L135 PolarHBondContact O-N 2.86Å; I132-K136 PolarHBondContact O-N 3.13Å; I132-L159 HydrophobicContact CG1-CD1 3.97Å; I132-W163 HydrophobicContact CD1-CZ2 4.05Å; I132-F183 HydrophobicContact CB-CE2 4.38Å; I132-F183 HydrophobicContact CD1-CE2 3.33Å; I132-F183 HydrophobicContact CD1-CZ 3.52Å; I132-F183 HydrophobicContact CG1-CE2 4.38Å; I132-F183 HydrophobicContact CG2-CD2 4.4Å; I132-F183 HydrophobicContact CG2-CE2 3.95Å; I132-L184 HydrophobicContact CD1-CD2 4.22Å; I132-L184 HydrophobicContact CG2-CD2 3.61Å
133	L	65.3	Low	63.2	Low	74 Å²	74	69.3 Å²	69.3	39%	0.387	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-37.5	170.9	-81.6	-177.5	0	0	0	112.4	Y129 E130 L135 K136	Y129-L133 HydrophobicContact CD1-CD1 3.51Å; Y129-L133 HydrophobicContact CD1-CG 4.12Å; Y129-L133 HydrophobicContact CE1-CD1 3.13Å; Y129-L133 HydrophobicContact CE1-CD2 4.4Å; Y129-L133 HydrophobicContact CE1-CG 3.86Å; Y129-L133 HydrophobicContact CE2-CD1 4.43Å; Y129-L133 HydrophobicContact CE2-CD2 4.45Å; Y129-L133 HydrophobicContact CE2-CG 4.29Å; Y129-L133 HydrophobicContact CG-CD1 4.31Å; Y129-L133 HydrophobicContact CG-CG 4.46Å; Y129-L133 VanDerWaalsContact O-CB 3.3Å; Y129-L133 WeakPolarHBondContact O-CB 3.37Å; Y129-L133 VanDerWaalsContact O-CG 3.27Å; Y129-L133 WeakPolarHBondContact O-CG 2.96Å; Y129-L133 PolarHBondContact O-N 2.72Å; E130-L133 PolarHBondContact O-N 3.15Å; L133-L135 PolarHBondContact O-N 2.97Å; L133-K136 WeakPolarHBondContact O-CB 3.14Å; L133-K136 PolarHBondContact O-N 3.32Å
134	S	66.7	Low	63.4	Low	89 Å²	89	64.8 Å²	64.8	62%	0.622	34%	0.34	S	S	*	.	H	α-helix	trans	-62.4	-29.3	178.9	79.2	0	0	0	0	112.2	E130 P131 I132	E130-S134 PolarHBondContact O-N 3.49Å; P131-S134 WeakPolarHBondContact O-CB 3.29Å; P131-S134 PolarHBondContact O-N 3.32Å; P131-S134 PolarHBondContact O-OG 3.03Å; I132-S134 VanDerWaalsContact C-N 3.32Å
135	L	63.8	Low	63.9	Low	20 Å²	20	60.3 Å²	60.3	11%	0.105	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-7.5	178.1	-63.7	173.1	0	0	0	113	P131 I132 L133 L137 R155 L159 W187	P131-L135 PolarHBondContact O-N 3.2Å; I132-L135 PolarHBondContact O-N 2.86Å; L133-L135 PolarHBondContact O-N 2.97Å; L135-L137 PolarHBondContact O-N 3.12Å; L135-R155 HydrophobicContact CD2-CB 4.21Å; L135-R155 HydrophobicContact CD2-CG 4.06Å; L135-R155 PolarHBondContact O-NH1 2.78Å; L135-L159 HydrophobicContact CD1-CB 3.97Å; L135-L159 HydrophobicContact CD1-CD1 4.15Å; L135-W187 HydrophobicContact CB-CH2 3.98Å; L135-W187 HydrophobicContact CB-CZ2 3.49Å; L135-W187 VanDerWaalsContact CB-CZ2 3.49Å; L135-W187 VanDerWaalsContact O-CH2 3.28Å; L135-W187 WeakPolarHBondContact O-CH2 3.41Å; L135-W187 WeakPolarHBondContact O-CZ2 3.3Å
136	K	68.5	Low	64.2	Low	120 Å²	120	63 Å²	63	52%	0.522	34%	0.338	S	S	.	.			trans	-36.8	128.3	-168	-177.7	178.3	178.4	-175.8	0	114.2	I132 L133	I132-K136 PolarHBondContact O-N 3.13Å; L133-K136 WeakPolarHBondContact O-CB 3.14Å; L133-K136 PolarHBondContact O-N 3.32Å
137	L	69.3	Low	64.8	Low	10 Å²	10	61.9 Å²	61.9	5%	0.052	33%	0.326	C	S	.	.			trans	-82.9	116.3	173.9	-65.5	175	0	0	0	109.9	L135 Y145 I147 L152 D186 W187 L190	L135-L137 PolarHBondContact O-N 3.12Å; L137-Y145 HydrophobicContact CD1-CE1 4.44Å; L137-I147 HydrophobicContact CD2-CD1 4.33Å; L137-L152 HydrophobicContact CD2-CD2 3.41Å; L137-L152 VanDerWaalsContact CD2-CD2 3.41Å; L137-D186 HydrophobicContact CD1-CB 4.37Å; L137-W187 HydrophobicContact CD1-CD2 3.6Å; L137-W187 HydrophobicContact CD1-CE3 3.49Å; L137-W187 VanDerWaalsContact CD1-CE3 3.49Å; L137-W187 HydrophobicContact CD1-CG 4.15Å; L137-W187 HydrophobicContact CD1-CH2 4.17Å; L137-W187 HydrophobicContact CD1-CZ2 4.29Å; L137-W187 HydrophobicContact CD1-CZ3 3.79Å; L137-W187 HydrophobicContact CD2-CE3 4.25Å; L137-W187 HydrophobicContact CD2-CH2 3.55Å; L137-W187 HydrophobicContact CD2-CZ2 4.14Å; L137-W187 HydrophobicContact CD2-CZ3 3.64Å; L137-W187 HydrophobicContact CG-CD2 3.96Å; L137-W187 HydrophobicContact CG-CE3 3.92Å; L137-W187 HydrophobicContact CG-CH2 3.62Å; L137-W187 HydrophobicContact CG-CZ2 3.71Å; L137-W187 HydrophobicContact CG-CZ3 3.75Å; L137-L190 HydrophobicContact CD1-CB 4.06Å; L137-L190 HydrophobicContact CD1-CD2 3.73Å; L137-L190 HydrophobicContact CD2-CD2 4.12Å
138	N	65.5	Low	65.6	Low	96 Å²	96	61.1 Å²	61.1	51%	0.513	33%	0.331	S	S	.	.			trans	-92.9	103.5	168.6	-68.7	-26.6	0	0	0	108.5	S146	N138-S146 PolarHBondContact O-N 2.9Å; N138-S146 PolarHBondContact O-OG 3.43Å
139	I	63.2	Low	66.5	Low	31 Å²	31	63.4 Å²	63.4	16%	0.159	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-94.7	122.1	174.2	-50.3	178.7	0	0	0	108	T144 Y145 D186	I139-T144 WeakPolarHBondContact CA-O 3.4Å; I139-Y145 HydrophobicContact CD1-CE1 3.81Å; I139-Y145 HydrophobicContact CG1-CD1 3.95Å; I139-Y145 HydrophobicContact CG1-CE1 3.61Å; I139-D186 HydrophobicContact CD1-CB 4.32Å
140	S	62.8	Low	67.5	Low	41 Å²	41	65.4 Å²	65.4	29%	0.287	35%	0.354	S	S	.	.			trans	-66.8	-176	175.8	64.9	0	0	0	0	112.7	K64 D142 G143 T144	K64-S140 PolarHBondContact NZ-O 3.28Å; K64-S140 VanDerWaalsContact NZ-O 3.09Å; S140-D142 WeakPolarHBondContact CB-OD1 3.26Å; S140-D142 PolarHBondContact OG-OD1 3.38Å; S140-G143 PolarHBondContact O-N 2.86Å; S140-T144 WeakPolarHBondContact CB-OG1 3.42Å; S140-T144 PolarHBondContact N-O 3.3Å; S140-T144 WeakPolarHBondContact OG-CA 2.8Å; S140-T144 PolarHBondContact OG-N 3.43Å; S140-T144 PolarHBondContact OG-O 2.89Å; S140-T144 PolarHBondContact OG-OG1 3.4Å
141	E	56.2	Low	68.4	Low	168 Å²	168	61.5 Å²	61.5	79%	0.785	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-32.4	176.2	-71.1	-178.6	178.9	0	0	114.9	L60 K64 G143	L60-E141 WeakPolarHBondContact CD2-O 3.34Å; K64-E141 VanDerWaalsContact NZ-CA 3.25Å; K64-E141 VanDerWaalsContact NZ-CG 3.32Å; E141-G143 PolarHBondContact O-N 3.44Å
142	D	61	Low	69.3	Low	104 Å²	104	59.7 Å²	59.7	56%	0.556	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	3.4	175	60.2	-10.4	0	0	0	112.9	S140 T144	S140-D142 WeakPolarHBondContact CB-OD1 3.26Å; S140-D142 PolarHBondContact OG-OD1 3.38Å; D142-T144 VanDerWaalsContact C-N 3.27Å; D142-T144 VanDerWaalsContact CG-CG2 3.41Å; D142-T144 WeakPolarHBondContact OD1-CB 3.18Å; D142-T144 VanDerWaalsContact OD1-CG2 3.32Å; D142-T144 WeakPolarHBondContact OD1-CG2 3.28Å; D142-T144 PolarHBondContact OD1-N 3.2Å; D142-T144 PolarHBondContact OD1-OG1 3.31Å; D142-T144 VanDerWaalsContact OD2-CG2 3.22Å; D142-T144 WeakPolarHBondContact OD2-CG2 3.03Å
143	G	59.6	Low	70.2	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	80.1	7.9	-176.6	0	0	0	0	0	113.5	S140 E141 N369	S140-G143 PolarHBondContact O-N 2.86Å; E141-G143 PolarHBondContact O-N 3.44Å; G143-N369 VanDerWaalsContact C-ND2 3.29Å; G143-N369 PolarHBondContact O-ND2 3.02Å
144	T	65.2	Low	71.3	Confident	42 Å²	42	58.2 Å²	58.2	26%	0.258	32%	0.317	S	S	.	.			trans	-71.6	144.4	173.6	63.7	0	0	0	0	111.9	I139 S140 D142 N369	I139-T144 WeakPolarHBondContact CA-O 3.4Å; S140-T144 WeakPolarHBondContact CB-OG1 3.42Å; S140-T144 PolarHBondContact N-O 3.3Å; S140-T144 WeakPolarHBondContact OG-CA 2.8Å; S140-T144 PolarHBondContact OG-N 3.43Å; S140-T144 PolarHBondContact OG-O 2.89Å; S140-T144 PolarHBondContact OG-OG1 3.4Å; D142-T144 VanDerWaalsContact C-N 3.27Å; D142-T144 VanDerWaalsContact CG-CG2 3.41Å; D142-T144 WeakPolarHBondContact OD1-CB 3.18Å; D142-T144 VanDerWaalsContact OD1-CG2 3.32Å; D142-T144 WeakPolarHBondContact OD1-CG2 3.28Å; D142-T144 PolarHBondContact OD1-N 3.2Å; D142-T144 PolarHBondContact OD1-OG1 3.31Å; D142-T144 VanDerWaalsContact OD2-CG2 3.22Å; D142-T144 WeakPolarHBondContact OD2-CG2 3.03Å; T144-N369 VanDerWaalsContact CA-ND2 3.26Å; T144-N369 WeakPolarHBondContact CA-ND2 3.28Å; T144-N369 VanDerWaalsContact CG2-OD1 3.26Å; T144-N369 WeakPolarHBondContact CG2-OD1 3.41Å; T144-N369 PolarHBondContact N-ND2 3.05Å
145	Y	66.6	Low	72.3	Confident	22 Å²	22	56.6 Å²	56.6	9%	0.086	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-92	135.4	171.4	-62.6	-84.3	0	0	0	108.1	L137 I139 I147 L152 L190 P366 F370	L137-Y145 HydrophobicContact CD1-CE1 4.44Å; I139-Y145 HydrophobicContact CD1-CE1 3.81Å; I139-Y145 HydrophobicContact CG1-CD1 3.95Å; I139-Y145 HydrophobicContact CG1-CE1 3.61Å; Y145-I147 PolarHBondContact O-N 3.23Å; Y145-I147 VanDerWaalsContact O-N 3.07Å; Y145-L152 HydrophobicContact CD1-CD1 4.16Å; Y145-L152 HydrophobicContact CD1-CD2 3.69Å; Y145-L152 HydrophobicContact CD2-CD1 3.65Å; Y145-L152 HydrophobicContact CE1-CD2 4.24Å; Y145-L152 HydrophobicContact CE2-CD1 4.33Å; Y145-L152 HydrophobicContact CG-CD1 3.56Å; Y145-L152 HydrophobicContact CG-CD2 3.91Å; Y145-L152 HydrophobicContact CG-CG 4.38Å; Y145-L190 HydrophobicContact CE1-CD1 4.34Å; Y145-L190 HydrophobicContact CE2-CD1 4.3Å; Y145-P366 HydrophobicContact CE2-CB 3.63Å; Y145-F370 HydrophobicContact CD2-CE2 4.23Å; Y145-F370 HydrophobicContact CD2-CZ 4.38Å; Y145-F370 AromaticContact CE2-CE2 3.67Å; Y145-F370 HydrophobicContact CE2-CE2 3.67Å; Y145-F370 HydrophobicContact CE2-CZ 4.09Å
146	S	67.5	Low	73.5	Confident	89 Å²	89	55.6 Å²	55.6	62%	0.622	29%	0.292	S	S	*	.	S	Bend	trans	-67.8	-1.7	175.7	49	0	0	0	0	114.4	N138	N138-S146 PolarHBondContact O-N 2.9Å; N138-S146 PolarHBondContact O-OG 3.43Å
147	I	74.5	Confident	74.5	Confident	43 Å²	43	54 Å²	54	22%	0.221	29%	0.286	C	S	.	.	S	Bend	trans	-128.4	156.5	-174.3	52.9	164.4	0	0	0	110.8	L137 Y145 E151 L152	L137-I147 HydrophobicContact CD2-CD1 4.33Å; Y145-I147 PolarHBondContact O-N 3.23Å; Y145-I147 VanDerWaalsContact O-N 3.07Å; I147-E151 HydrophobicContact CB-CB 4.32Å; I147-E151 HydrophobicContact CB-CG 4.05Å; I147-E151 HydrophobicContact CD1-CB 4.44Å; I147-E151 HydrophobicContact CD1-CG 3.91Å; I147-E151 HydrophobicContact CG2-CG 4.42Å; I147-L152 HydrophobicContact CD1-CD2 3.35Å; I147-L152 HydrophobicContact CD1-CG 3.75Å; I147-L152 HydrophobicContact CG1-CD2 3.62Å; I147-L152 HydrophobicContact CG1-CG 3.81Å
148	S	80.1	Confident	75.4	Confident	74 Å²	74	58.9 Å²	58.9	52%	0.517	31%	0.309	S	S	.	.			trans	-63.4	156.1	-178.8	75.7	0	0	0	0	112.7	M150 E151 L152	S148-M150 VanDerWaalsContact C-N 3.27Å; S148-M150 PolarHBondContact O-N 2.98Å; S148-E151 WeakPolarHBondContact O-CB 3.35Å; S148-E151 PolarHBondContact O-N 3.3Å; S148-E151 VanDerWaalsContact O-N 3.14Å; S148-E151 WeakPolarHBondContact OG-CB 3.5Å; S148-E151 PolarHBondContact OG-N 3.48Å; S148-L152 WeakPolarHBondContact O-CG 3.48Å; S148-L152 PolarHBondContact O-N 2.91Å
149	Q	80.3	Confident	76.5	Confident	49 Å²	49	54.3 Å²	54.3	23%	0.229	28%	0.284	C	S	.	.	H	α-helix	trans	-55.7	-41.4	175.8	-65.4	179.5	8.1	0	0	112.4	L152 V153 R203 Y206 N369 F370	Q149-L152 WeakPolarHBondContact O-CB 3.21Å; Q149-L152 PolarHBondContact O-N 3.02Å; Q149-V153 WeakPolarHBondContact O-CG2 3.29Å; Q149-V153 PolarHBondContact O-N 3.47Å; Q149-V153 VanDerWaalsContact O-N 3.07Å; Q149-R203 VanDerWaalsContact OE1-NH1 3.11Å; Q149-Y206 PolarHBondContact OE1-OH 3.42Å; Q149-N369 PolarHBondContact NE2-O 3.4Å; Q149-F370 HydrophobicContact CB-CD1 4.41Å; Q149-F370 HydrophobicContact CB-CE1 4.3Å; Q149-F370 HydrophobicContact CG-CD1 3.86Å; Q149-F370 HydrophobicContact CG-CE1 4.06Å; Q149-F370 VanDerWaalsContact NE2-C 3.33Å; Q149-F370 PolarHBondContact NE2-O 3.48Å
150	M	83	Confident	77.6	Confident	97 Å²	97	53.2 Å²	53.2	48%	0.478	28%	0.279	S	S	.	.	H	α-helix	trans	-66.9	-38.8	179.5	-167.2	67.7	-152.4	0	0	111.7	S148 L152 V153 N154	S148-M150 VanDerWaalsContact C-N 3.27Å; S148-M150 PolarHBondContact O-N 2.98Å; M150-L152 VanDerWaalsContact C-N 3.35Å; M150-V153 PolarHBondContact O-N 3.28Å; M150-N154 WeakPolarHBondContact CE-OD1 3.29Å; M150-N154 WeakPolarHBondContact O-CB 3.45Å; M150-N154 PolarHBondContact O-N 3.48Å; M150-N154 PolarHBondContact O-ND2 3.35Å
151	E	83.9	Confident	78.7	Confident	69 Å²	69	54.3 Å²	54.3	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-64.9	-38.8	175.2	-178.4	62.7	-169.6	0	0	111.6	I147 S148 V153 N154 R155	I147-E151 HydrophobicContact CB-CB 4.32Å; I147-E151 HydrophobicContact CB-CG 4.05Å; I147-E151 HydrophobicContact CD1-CB 4.44Å; I147-E151 HydrophobicContact CD1-CG 3.91Å; I147-E151 HydrophobicContact CG2-CG 4.42Å; S148-E151 WeakPolarHBondContact O-CB 3.35Å; S148-E151 PolarHBondContact O-N 3.3Å; S148-E151 VanDerWaalsContact O-N 3.14Å; S148-E151 WeakPolarHBondContact OG-CB 3.5Å; S148-E151 PolarHBondContact OG-N 3.48Å; E151-V153 VanDerWaalsContact C-N 3.35Å; E151-V153 PolarHBondContact O-N 3.43Å; E151-N154 PolarHBondContact O-N 3.09Å; E151-R155 WeakPolarHBondContact O-CB 3.26Å; E151-R155 VanDerWaalsContact O-CG 3.32Å; E151-R155 WeakPolarHBondContact O-CG 3.3Å; E151-R155 PolarHBondContact O-N 3.21Å; E151-R155 IonicContact OE1-CZ 3.42Å; E151-R155 IonicContact OE1-NE 3.11Å; E151-R155 PolarHBondContact OE1-NE 3.09Å; E151-R155 IonicContact OE1-NH2 3.23Å; E151-R155 PolarHBondContact OE1-NH2 2.89Å
152	L	84.1	Confident	80	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-45.3	173.7	-71	166.3	0	0	0	111.8	L137 Y145 I147 S148 Q149 M150 R155 L156 L190 F370	L137-L152 HydrophobicContact CD2-CD2 3.41Å; L137-L152 VanDerWaalsContact CD2-CD2 3.41Å; Y145-L152 HydrophobicContact CD1-CD1 4.16Å; Y145-L152 HydrophobicContact CD1-CD2 3.69Å; Y145-L152 HydrophobicContact CD2-CD1 3.65Å; Y145-L152 HydrophobicContact CE1-CD2 4.24Å; Y145-L152 HydrophobicContact CE2-CD1 4.33Å; Y145-L152 HydrophobicContact CG-CD1 3.56Å; Y145-L152 HydrophobicContact CG-CD2 3.91Å; Y145-L152 HydrophobicContact CG-CG 4.38Å; I147-L152 HydrophobicContact CD1-CD2 3.35Å; I147-L152 HydrophobicContact CD1-CG 3.75Å; I147-L152 HydrophobicContact CG1-CD2 3.62Å; I147-L152 HydrophobicContact CG1-CG 3.81Å; S148-L152 WeakPolarHBondContact O-CG 3.48Å; S148-L152 PolarHBondContact O-N 2.91Å; Q149-L152 WeakPolarHBondContact O-CB 3.21Å; Q149-L152 PolarHBondContact O-N 3.02Å; M150-L152 VanDerWaalsContact C-N 3.35Å; L152-R155 PolarHBondContact O-N 3.47Å; L152-L156 WeakPolarHBondContact O-CB 3.48Å; L152-L156 PolarHBondContact O-N 3.38Å; L152-L190 HydrophobicContact CB-CD1 4.27Å; L152-L190 HydrophobicContact CB-CD2 4.14Å; L152-L190 HydrophobicContact CD1-CD1 4.26Å; L152-L190 HydrophobicContact CD2-CD1 4.28Å; L152-L190 HydrophobicContact CD2-CD2 3.9Å; L152-F370 HydrophobicContact CD1-CE1 4.1Å; L152-F370 HydrophobicContact CD1-CZ 3.7Å
153	V	87.9	Confident	80.9	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-48.6	177.2	174.1	0	0	0	0	110.5	Q149 M150 E151 R155 L156 E157 L194 Y206 V209	Q149-V153 WeakPolarHBondContact O-CG2 3.29Å; Q149-V153 PolarHBondContact O-N 3.47Å; Q149-V153 VanDerWaalsContact O-N 3.07Å; M150-V153 PolarHBondContact O-N 3.28Å; E151-V153 VanDerWaalsContact C-N 3.35Å; E151-V153 PolarHBondContact O-N 3.43Å; V153-R155 PolarHBondContact O-N 3.39Å; V153-L156 PolarHBondContact O-N 2.88Å; V153-E157 WeakPolarHBondContact O-CB 3.48Å; V153-E157 PolarHBondContact O-N 2.93Å; V153-L194 HydrophobicContact CG2-CD1 4.08Å; V153-L194 HydrophobicContact CG2-CD2 3.72Å; V153-Y206 HydrophobicContact CG2-CD1 3.79Å; V153-Y206 HydrophobicContact CG2-CE1 3.76Å; V153-Y206 HydrophobicContact CG2-CG 4.37Å; V153-V209 HydrophobicContact CG1-CB 4.32Å; V153-V209 HydrophobicContact CG1-CG1 4.33Å; V153-V209 HydrophobicContact CG1-CG2 3.93Å
154	N	87.7	Confident	81.9	Confident	53 Å²	53	45.1 Å²	45.1	28%	0.283	24%	0.24	S	C	.	.	H	α-helix	trans	-59.1	-44.4	179	-72.1	-18.8	0	0	0	112.1	M150 E151 E157 Q158	M150-N154 WeakPolarHBondContact CE-OD1 3.29Å; M150-N154 WeakPolarHBondContact O-CB 3.45Å; M150-N154 PolarHBondContact O-N 3.48Å; M150-N154 PolarHBondContact O-ND2 3.35Å; E151-N154 PolarHBondContact O-N 3.09Å; N154-E157 PolarHBondContact O-N 3.1Å; N154-Q158 VanDerWaalsContact O-CG 3.31Å; N154-Q158 WeakPolarHBondContact O-CG 3.35Å; N154-Q158 PolarHBondContact O-N 3.07Å
155	R	87.7	Confident	82.5	Confident	54 Å²	54	45.9 Å²	45.9	20%	0.204	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-38.8	178.4	-70.3	-178	-176.9	-159.7	1.2	112.4	L135 E151 L152 V153 E157 Q158 L159 W187	L135-R155 HydrophobicContact CD2-CB 4.21Å; L135-R155 HydrophobicContact CD2-CG 4.06Å; L135-R155 PolarHBondContact O-NH1 2.78Å; E151-R155 WeakPolarHBondContact O-CB 3.26Å; E151-R155 VanDerWaalsContact O-CG 3.32Å; E151-R155 WeakPolarHBondContact O-CG 3.3Å; E151-R155 PolarHBondContact O-N 3.21Å; E151-R155 IonicContact OE1-CZ 3.42Å; E151-R155 IonicContact OE1-NE 3.11Å; E151-R155 PolarHBondContact OE1-NE 3.09Å; E151-R155 IonicContact OE1-NH2 3.23Å; E151-R155 PolarHBondContact OE1-NH2 2.89Å; L152-R155 PolarHBondContact O-N 3.47Å; V153-R155 PolarHBondContact O-N 3.39Å; R155-E157 VanDerWaalsContact C-N 3.3Å; R155-Q158 PolarHBondContact O-N 2.87Å; R155-L159 WeakPolarHBondContact O-CB 3.41Å; R155-L159 PolarHBondContact O-N 3.43Å; R155-W187 HydrophobicContact CB-CH2 3.64Å; R155-W187 HydrophobicContact CB-CZ3 3.96Å
156	L	89.2	Confident	82.8	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-36.5	175.8	-170.8	68.3	0	0	0	111.1	L152 V153 L159 T160 W187 A191 L194 V209 F213	L152-L156 WeakPolarHBondContact O-CB 3.48Å; L152-L156 PolarHBondContact O-N 3.38Å; V153-L156 PolarHBondContact O-N 2.88Å; L156-L159 PolarHBondContact O-N 3.49Å; L156-T160 WeakPolarHBondContact O-CB 3.47Å; L156-T160 PolarHBondContact O-N 3.21Å; L156-T160 PolarHBondContact O-OG1 3.04Å; L156-W187 HydrophobicContact CB-CE3 4.43Å; L156-W187 HydrophobicContact CB-CZ3 4.34Å; L156-W187 HydrophobicContact CD1-CB 4.38Å; L156-W187 HydrophobicContact CD1-CD2 4.48Å; L156-W187 HydrophobicContact CD1-CE3 3.67Å; L156-W187 HydrophobicContact CD1-CZ3 4.39Å; L156-A191 HydrophobicContact CD2-CB 3.95Å; L156-L194 HydrophobicContact CD2-CD1 3.58Å; L156-V209 HydrophobicContact CB-CG1 4.02Å; L156-V209 HydrophobicContact CD2-CG1 3.96Å; L156-V209 HydrophobicContact CG-CG1 4.03Å; L156-F213 HydrophobicContact CD1-CB 4.04Å; L156-F213 HydrophobicContact CD1-CD1 3.68Å; L156-F213 HydrophobicContact CD1-CD2 3.73Å; L156-F213 HydrophobicContact CD1-CE1 3.98Å; L156-F213 HydrophobicContact CD1-CE2 4.07Å; L156-F213 HydrophobicContact CD1-CG 3.52Å; L156-F213 HydrophobicContact CD1-CZ 4.16Å; L156-F213 HydrophobicContact CD2-CB 4.26Å; L156-F213 HydrophobicContact CG-CB 4.07Å; L156-F213 HydrophobicContact CG-CD2 4.43Å; L156-F213 HydrophobicContact CG-CG 4.1Å
157	E	90.1	Very high	83	Confident	86 Å²	86	42.1 Å²	42.1	40%	0.402	22%	0.219	S	C	.	.	H	α-helix	trans	-67.6	-42.1	174.7	-173.7	168.1	-150.6	0	0	112.3	V153 N154 R155 L159 T160 S161 V209	V153-E157 WeakPolarHBondContact O-CB 3.48Å; V153-E157 PolarHBondContact O-N 2.93Å; N154-E157 PolarHBondContact O-N 3.1Å; R155-E157 VanDerWaalsContact C-N 3.3Å; E157-L159 VanDerWaalsContact C-N 3.34Å; E157-L159 PolarHBondContact O-N 3.38Å; E157-T160 WeakPolarHBondContact O-CB 3.31Å; E157-T160 PolarHBondContact O-N 3.49Å; E157-S161 WeakPolarHBondContact O-CB 3.24Å; E157-S161 PolarHBondContact O-N 2.72Å; E157-S161 PolarHBondContact O-OG 2.77Å; E157-V209 HydrophobicContact CB-CG1 4.1Å; E157-V209 HydrophobicContact CB-CG2 4.49Å
158	Q	88.2	Confident	82.9	Confident	112 Å²	112	42.1 Å²	42.1	52%	0.523	22%	0.223	S	C	.	.	H	α-helix	trans	-60.2	-44.8	172	-73.7	172.9	6.8	0	0	111.4	N154 R155 T160 S161 Y162	N154-Q158 VanDerWaalsContact O-CG 3.31Å; N154-Q158 WeakPolarHBondContact O-CG 3.35Å; N154-Q158 PolarHBondContact O-N 3.07Å; R155-Q158 PolarHBondContact O-N 2.87Å; Q158-T160 VanDerWaalsContact C-N 3.34Å; Q158-T160 PolarHBondContact O-N 3.2Å; Q158-S161 PolarHBondContact O-N 2.95Å; Q158-Y162 WeakPolarHBondContact O-CB 3.49Å; Q158-Y162 PolarHBondContact O-N 3.32Å
159	L	86.8	Confident	82.1	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-64	-40.2	176.8	-175	62.1	0	0	0	111.6	I132 L135 R155 L156 E157 Y162 W163 L184 W187 F213	I132-L159 HydrophobicContact CG1-CD1 3.97Å; L135-L159 HydrophobicContact CD1-CB 3.97Å; L135-L159 HydrophobicContact CD1-CD1 4.15Å; R155-L159 WeakPolarHBondContact O-CB 3.41Å; R155-L159 PolarHBondContact O-N 3.43Å; L156-L159 PolarHBondContact O-N 3.49Å; E157-L159 VanDerWaalsContact C-N 3.34Å; E157-L159 PolarHBondContact O-N 3.38Å; L159-Y162 WeakPolarHBondContact O-CB 3.49Å; L159-Y162 PolarHBondContact O-N 3.46Å; L159-W163 PolarHBondContact O-N 3.44Å; L159-L184 HydrophobicContact CD2-CD2 4.14Å; L159-W187 HydrophobicContact CD2-CB 4.07Å; L159-W187 HydrophobicContact CD2-CD2 3.55Å; L159-W187 HydrophobicContact CD2-CE3 4.08Å; L159-W187 HydrophobicContact CD2-CG 3.54Å; L159-W187 HydrophobicContact CD2-CZ2 4.46Å; L159-F213 HydrophobicContact CD2-CD2 4.41Å; L159-F213 HydrophobicContact CD2-CE2 3.47Å; L159-F213 VanDerWaalsContact CD2-CE2 3.47Å; L159-F213 HydrophobicContact CD2-CZ 3.82Å; L159-F213 HydrophobicContact CG-CD2 4.49Å; L159-F213 HydrophobicContact CG-CE2 3.77Å
160	T	87.9	Confident	81	Confident	8 Å²	8	48.1 Å²	48.1	5%	0.049	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-47.6	174.8	-58.7	0	0	0	0	110.7	L156 E157 Q158 Y162 W163 V164 R212 F213 V216	L156-T160 WeakPolarHBondContact O-CB 3.47Å; L156-T160 PolarHBondContact O-N 3.21Å; L156-T160 PolarHBondContact O-OG1 3.04Å; E157-T160 WeakPolarHBondContact O-CB 3.31Å; E157-T160 PolarHBondContact O-N 3.49Å; Q158-T160 VanDerWaalsContact C-N 3.34Å; Q158-T160 PolarHBondContact O-N 3.2Å; T160-Y162 VanDerWaalsContact C-N 3.34Å; T160-Y162 PolarHBondContact O-N 3.13Å; T160-W163 WeakPolarHBondContact O-CB 3.4Å; T160-W163 PolarHBondContact O-N 3.04Å; T160-W163 VanDerWaalsContact O-N 3.12Å; T160-V164 WeakPolarHBondContact O-CG2 2.99Å; T160-V164 PolarHBondContact O-N 2.98Å; T160-R212 HydrophobicContact CG2-CB 4.08Å; T160-F213 WeakPolarHBondContact OG1-CB 3.18Å; T160-V216 HydrophobicContact CG2-CG1 3.99Å
161	S	85.5	Confident	79.7	Confident	63 Å²	63	46.5 Å²	46.5	44%	0.441	25%	0.246	S	C	.	.	H	α-helix	trans	-61.1	-44.2	178.5	-57.3	0	0	0	0	111.2	E157 Q158 W163 V164 T165	E157-S161 WeakPolarHBondContact O-CB 3.24Å; E157-S161 PolarHBondContact O-N 2.72Å; E157-S161 PolarHBondContact O-OG 2.77Å; Q158-S161 PolarHBondContact O-N 2.95Å; S161-W163 VanDerWaalsContact C-N 3.29Å; S161-W163 PolarHBondContact O-N 3.42Å; S161-V164 PolarHBondContact O-N 3.39Å; S161-T165 PolarHBondContact O-N 3.27Å; S161-T165 PolarHBondContact O-OG1 2.81Å; S161-T165 VanDerWaalsContact O-OG1 3.12Å
162	Y	82.5	Confident	78.2	Confident	45 Å²	45	49.3 Å²	49.3	18%	0.176	27%	0.27	C	S	.	.	H	α-helix	trans	-55.1	-44.5	173.1	175.3	-95	0	0	0	111.8	H127 F128 P131 Q158 L159 T160 Y166	H127-Y162 PolarHBondContact O-OH 2.93Å; F128-Y162 WeakPolarHBondContact CA-OH 3.35Å; F128-Y162 HydrophobicContact CD1-CE1 4.14Å; P131-Y162 HydrophobicContact CB-CD2 4.47Å; P131-Y162 HydrophobicContact CB-CE2 4.05Å; P131-Y162 HydrophobicContact CG-CE2 4.04Å; Q158-Y162 WeakPolarHBondContact O-CB 3.49Å; Q158-Y162 PolarHBondContact O-N 3.32Å; L159-Y162 WeakPolarHBondContact O-CB 3.49Å; L159-Y162 PolarHBondContact O-N 3.46Å; T160-Y162 VanDerWaalsContact C-N 3.34Å; T160-Y162 PolarHBondContact O-N 3.13Å; Y162-Y166 WeakPolarHBondContact O-CB 3.28Å; Y162-Y166 PolarHBondContact O-N 3.32Å
163	W	80	Confident	76.8	Confident	3 Å²	3	51 Å²	51	1%	0.011	28%	0.281	C	S	.	.	H	α-helix	trans	-67.5	-38.2	177.3	-83.4	111.2	0	0	0	113.9	F128 I132 L159 T160 S161 Y166 L167 F178 P180 F183 L184 V216 I217	F128-W163 HydrophobicContact CD1-CH2 4.06Å; F128-W163 AromaticContact CE1-CH2 3.9Å; F128-W163 HydrophobicContact CE1-CH2 3.9Å; F128-W163 HydrophobicContact CE1-CZ3 4.01Å; I132-W163 HydrophobicContact CD1-CZ2 4.05Å; L159-W163 PolarHBondContact O-N 3.44Å; T160-W163 WeakPolarHBondContact O-CB 3.4Å; T160-W163 PolarHBondContact O-N 3.04Å; T160-W163 VanDerWaalsContact O-N 3.12Å; S161-W163 VanDerWaalsContact C-N 3.29Å; S161-W163 PolarHBondContact O-N 3.42Å; W163-Y166 HydrophobicContact CE3-CD1 4.01Å; W163-Y166 HydrophobicContact CE3-CG 4.44Å; W163-Y166 AromaticContact CZ3-CD1 3.79Å; W163-Y166 HydrophobicContact CZ3-CD1 3.79Å; W163-Y166 HydrophobicContact CZ3-CE1 4.36Å; W163-Y166 HydrophobicContact CZ3-CG 4.36Å; W163-Y166 PolarHBondContact O-N 2.87Å; W163-L167 WeakPolarHBondContact O-CB 3.26Å; W163-L167 VanDerWaalsContact O-CG 3.29Å; W163-L167 WeakPolarHBondContact O-CG 3.37Å; W163-L167 PolarHBondContact O-N 2.92Å; W163-F178 HydrophobicContact CH2-CD1 4.22Å; W163-F178 AromaticContact CH2-CE1 3.86Å; W163-F178 HydrophobicContact CH2-CE1 3.86Å; W163-P180 HydrophobicContact CE3-CG 4.39Å; W163-P180 HydrophobicContact CH2-CB 3.26Å; W163-P180 HydrophobicContact CH2-CG 3.61Å; W163-P180 HydrophobicContact CZ2-CB 3.21Å; W163-P180 HydrophobicContact CZ2-CG 3.81Å; W163-P180 HydrophobicContact CZ3-CB 4.08Å; W163-P180 HydrophobicContact CZ3-CG 3.9Å; W163-F183 HydrophobicContact CZ2-CZ 4.21Å; W163-L184 HydrophobicContact CZ2-CD1 3.89Å; W163-L184 VanDerWaalsContact NE1-CD1 3.32Å; W163-V216 HydrophobicContact CB-CG1 3.83Å; W163-V216 HydrophobicContact CB-CG2 3.93Å; W163-I217 HydrophobicContact CG-CG2 4.43Å
164	V	80.9	Confident	75.3	Confident	31 Å²	31	56.4 Å²	56.4	19%	0.188	31%	0.31	C	S	.	.	H	α-helix	trans	-62.6	-52.6	175	172.8	0	0	0	0	109.8	T160 S161 Y166 L167 S168 V216 V222 Y225	T160-V164 WeakPolarHBondContact O-CG2 2.99Å; T160-V164 PolarHBondContact O-N 2.98Å; S161-V164 PolarHBondContact O-N 3.39Å; V164-Y166 VanDerWaalsContact C-N 3.25Å; V164-Y166 PolarHBondContact O-N 3.38Å; V164-L167 PolarHBondContact O-N 3.13Å; V164-S168 WeakPolarHBondContact O-CB 3.31Å; V164-S168 PolarHBondContact O-N 2.9Å; V164-S168 VanDerWaalsContact O-N 3.08Å; V164-V216 HydrophobicContact CG2-CB 4.46Å; V164-V216 HydrophobicContact CG2-CG2 3.69Å; V164-V222 HydrophobicContact CG1-CG1 4.03Å; V164-V222 VanDerWaalsContact O-CG2 3.28Å; V164-V222 WeakPolarHBondContact O-CG2 3.06Å; V164-Y225 HydrophobicContact CG2-CD1 4.21Å; V164-Y225 HydrophobicContact CG2-CE1 3.69Å
165	T	77.9	Confident	73.7	Confident	59 Å²	59	55.4 Å²	55.4	36%	0.362	31%	0.306	S	S	.	.	H	α-helix	trans	-55.2	-45.3	175.7	-60.2	0	0	0	0	110.6	S161 L167 S168 E170	S161-T165 PolarHBondContact O-N 3.27Å; S161-T165 PolarHBondContact O-OG1 2.81Å; S161-T165 VanDerWaalsContact O-OG1 3.12Å; T165-L167 PolarHBondContact O-N 2.93Å; T165-S168 WeakPolarHBondContact O-CB 3.24Å; T165-S168 PolarHBondContact O-N 2.86Å; T165-S168 VanDerWaalsContact O-N 3.12Å; T165-S168 PolarHBondContact O-OG 3.27Å; T165-E170 WeakPolarHBondContact CG2-OE2 3.44Å
166	Y	72.7	Confident	72.2	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.016	32%	0.317	C	S	.	.	I	π-helix	trans	-59.2	-45.8	179.8	179.3	-86.3	0	0	0	113.2	F128 Y162 W163 V164 S168 F171 V175	F128-Y166 HydrophobicContact CD1-CD2 4.05Å; F128-Y166 HydrophobicContact CD1-CE2 4.09Å; F128-Y166 AromaticContact CE1-CD1 3.83Å; F128-Y166 HydrophobicContact CE1-CD1 3.83Å; F128-Y166 AromaticContact CE1-CD2 3.3Å; F128-Y166 HydrophobicContact CE1-CD2 3.3Å; F128-Y166 AromaticContact CE1-CE1 3.68Å; F128-Y166 HydrophobicContact CE1-CE1 3.68Å; F128-Y166 AromaticContact CE1-CE2 3.08Å; F128-Y166 HydrophobicContact CE1-CE2 3.08Å; F128-Y166 AromaticContact CE1-CG 3.71Å; F128-Y166 HydrophobicContact CE1-CG 3.71Å; F128-Y166 AromaticContact CE1-CZ 3.33Å; F128-Y166 AromaticContact CE2-CE2 3.71Å; F128-Y166 HydrophobicContact CE2-CE2 3.71Å; F128-Y166 HydrophobicContact CZ-CD1 4.35Å; F128-Y166 AromaticContact CZ-CD2 3.72Å; F128-Y166 HydrophobicContact CZ-CD2 3.72Å; F128-Y166 AromaticContact CZ-CE1 3.73Å; F128-Y166 HydrophobicContact CZ-CE1 3.73Å; F128-Y166 AromaticContact CZ-CE2 2.95Å; F128-Y166 HydrophobicContact CZ-CE2 2.95Å; F128-Y166 HydrophobicContact CZ-CG 4.38Å; F128-Y166 AromaticContact CZ-CZ 2.99Å; F128-Y166 WeakPolarHBondContact CZ-OH 3.46Å; Y162-Y166 WeakPolarHBondContact O-CB 3.28Å; Y162-Y166 PolarHBondContact O-N 3.32Å; W163-Y166 HydrophobicContact CE3-CD1 4.01Å; W163-Y166 HydrophobicContact CE3-CG 4.44Å; W163-Y166 AromaticContact CZ3-CD1 3.79Å; W163-Y166 HydrophobicContact CZ3-CD1 3.79Å; W163-Y166 HydrophobicContact CZ3-CE1 4.36Å; W163-Y166 HydrophobicContact CZ3-CG 4.36Å; W163-Y166 PolarHBondContact O-N 2.87Å; V164-Y166 VanDerWaalsContact C-N 3.25Å; V164-Y166 PolarHBondContact O-N 3.38Å; Y166-S168 VanDerWaalsContact C-N 3.26Å; Y166-S168 PolarHBondContact O-N 3.23Å; Y166-F171 HydrophobicContact CD2-CB 3.77Å; Y166-F171 AromaticContact CD2-CD1 3.74Å; Y166-F171 HydrophobicContact CD2-CD1 3.74Å; Y166-F171 AromaticContact CD2-CD2 3.29Å; Y166-F171 HydrophobicContact CD2-CD2 3.29Å; Y166-F171 HydrophobicContact CD2-CE1 4.1Å; Y166-F171 AromaticContact CD2-CE2 3.68Å; Y166-F171 HydrophobicContact CD2-CE2 3.68Å; Y166-F171 AromaticContact CD2-CG 3.29Å; Y166-F171 HydrophobicContact CD2-CG 3.29Å; Y166-F171 HydrophobicContact CD2-CZ 4.07Å; Y166-F171 HydrophobicContact CE2-CB 3.27Å; Y166-F171 AromaticContact CE2-CD1 3.64Å; Y166-F171 HydrophobicContact CE2-CD1 3.64Å; Y166-F171 AromaticContact CE2-CD2 3.78Å; Y166-F171 HydrophobicContact CE2-CD2 3.78Å; Y166-F171 HydrophobicContact CE2-CE1 4.39Å; Y166-F171 HydrophobicContact CE2-CE2 4.49Å; Y166-F171 AromaticContact CE2-CG 3.27Å; Y166-F171 HydrophobicContact CE2-CG 3.27Å; Y166-F171 HydrophobicContact CG-CD2 4.01Å; Y166-F171 HydrophobicContact CG-CE2 4.36Å; Y166-F171 HydrophobicContact CG-CG 4.35Å; Y166-V175 HydrophobicContact CD1-CG1 4.35Å; Y166-V175 HydrophobicContact CE1-CB 4.07Å; Y166-V175 HydrophobicContact CE1-CG1 3.35Å; Y166-V175 HydrophobicContact CE1-CG2 3.59Å
167	L	72.5	Confident	70.5	Confident	27 Å²	27	65 Å²	65	14%	0.141	36%	0.357	C	S	.	.	I	π-helix	trans	-75.2	-13.7	-179.7	-68.2	173.5	0	0	0	112.9	W163 V164 T165 S169 V175 V216 V222	W163-L167 WeakPolarHBondContact O-CB 3.26Å; W163-L167 VanDerWaalsContact O-CG 3.29Å; W163-L167 WeakPolarHBondContact O-CG 3.37Å; W163-L167 PolarHBondContact O-N 2.92Å; V164-L167 PolarHBondContact O-N 3.13Å; T165-L167 PolarHBondContact O-N 2.93Å; L167-S169 PolarHBondContact O-N 2.93Å; L167-S169 VanDerWaalsContact O-N 3.13Å; L167-V175 HydrophobicContact CD2-CG1 4.45Å; L167-V175 HydrophobicContact CD2-CG2 4.44Å; L167-V216 HydrophobicContact CD1-CG2 3.89Å; L167-V222 HydrophobicContact CB-CG2 3.24Å
168	S	72.3	Confident	69	Low	44 Å²	44	61.6 Å²	61.6	31%	0.308	34%	0.341	S	S	.	.	I	π-helix	trans	-79.2	12.9	-170.9	73.4	0	0	0	0	115.3	V164 T165 Y166	V164-S168 WeakPolarHBondContact O-CB 3.31Å; V164-S168 PolarHBondContact O-N 2.9Å; V164-S168 VanDerWaalsContact O-N 3.08Å; T165-S168 WeakPolarHBondContact O-CB 3.24Å; T165-S168 PolarHBondContact O-N 2.86Å; T165-S168 VanDerWaalsContact O-N 3.12Å; T165-S168 PolarHBondContact O-OG 3.27Å; Y166-S168 VanDerWaalsContact C-N 3.26Å; Y166-S168 PolarHBondContact O-N 3.23Å
169	S	62.7	Low	67.8	Low	111 Å²	111	57.8 Å²	57.8	78%	0.776	32%	0.324	S	S	*	.	I	π-helix	trans	84.4	2.4	-176.3	76.3	0	0	0	0	117.2	L167 F171	L167-S169 PolarHBondContact O-N 2.93Å; L167-S169 VanDerWaalsContact O-N 3.13Å; S169-F171 PolarHBondContact O-N 2.95Å
170	E	57.4	Low	66.8	Low	137 Å²	137	58 Å²	58	64%	0.64	33%	0.326	S	S	*	.	I	π-helix	trans	-67.6	-20.4	176.9	-68.8	-168.9	175.6	0	0	113.9	T165	T165-E170 WeakPolarHBondContact CG2-OE2 3.44Å
171	F	56	Low	65.7	Low	64 Å²	64	57.6 Å²	57.6	28%	0.281	32%	0.323	S	S	.	.	S	Bend	trans	-107	134.5	-176.3	-71.7	-97.4	0	0	0	112.7	Y166 S169 C173	Y166-F171 HydrophobicContact CD2-CB 3.77Å; Y166-F171 AromaticContact CD2-CD1 3.74Å; Y166-F171 HydrophobicContact CD2-CD1 3.74Å; Y166-F171 AromaticContact CD2-CD2 3.29Å; Y166-F171 HydrophobicContact CD2-CD2 3.29Å; Y166-F171 HydrophobicContact CD2-CE1 4.1Å; Y166-F171 AromaticContact CD2-CE2 3.68Å; Y166-F171 HydrophobicContact CD2-CE2 3.68Å; Y166-F171 AromaticContact CD2-CG 3.29Å; Y166-F171 HydrophobicContact CD2-CG 3.29Å; Y166-F171 HydrophobicContact CD2-CZ 4.07Å; Y166-F171 HydrophobicContact CE2-CB 3.27Å; Y166-F171 AromaticContact CE2-CD1 3.64Å; Y166-F171 HydrophobicContact CE2-CD1 3.64Å; Y166-F171 AromaticContact CE2-CD2 3.78Å; Y166-F171 HydrophobicContact CE2-CD2 3.78Å; Y166-F171 HydrophobicContact CE2-CE1 4.39Å; Y166-F171 HydrophobicContact CE2-CE2 4.49Å; Y166-F171 AromaticContact CE2-CG 3.27Å; Y166-F171 HydrophobicContact CE2-CG 3.27Å; Y166-F171 HydrophobicContact CG-CD2 4.01Å; Y166-F171 HydrophobicContact CG-CE2 4.36Å; Y166-F171 HydrophobicContact CG-CG 4.35Å; S169-F171 PolarHBondContact O-N 2.95Å; F171-C173 PolarHBondContact O-N 2.45Å; F171-C173 VanDerWaalsContact O-N 3.09Å
172	P	51.8	Low	64.5	Low	128 Å²	128	55.3 Å²	55.3	83%	0.831	31%	0.306	S	S	*	.			trans	-75.5	4.8	-173.6	29.9	-35.5	0	0	0	114.9
173	C	55.6	Low	63.8	Low	37 Å²	37	53.6 Å²	53.6	25%	0.25	30%	0.299	C	S	.	.	S	Bend	trans	-97.1	135.1	-171.7	-62.6	0	0	0	0	112.4	F125 F171 V175	F125-C173 HydrophobicContact CE1-CB 4.46Å; F171-C173 PolarHBondContact O-N 2.45Å; F171-C173 VanDerWaalsContact O-N 3.09Å; C173-V175 WeakPolarHBondContact O-CG2 3.42Å; C173-V175 PolarHBondContact O-N 2.66Å
174	N	55.8	Low	63.6	Low	118 Å²	118	53.5 Å²	53.5	63%	0.631	30%	0.299	S	S	*	.			trans	-69.4	94.4	172.6	-173.6	-11.6	0	0	0	110.6	S176	N174-S176 PolarHBondContact O-N 3.13Å; N174-S176 WeakPolarHBondContact OD1-CB 3.25Å; N174-S176 PolarHBondContact OD1-N 3.39Å; N174-S176 PolarHBondContact OD1-OG 2.84Å
175	V	53.8	Low	63.4	Low	31 Å²	31	52.5 Å²	52.5	19%	0.188	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-70.2	-13.2	-176.6	-138.8	0	0	0	0	114	Y166 L167 C173 K177 F178	Y166-V175 HydrophobicContact CD1-CG1 4.35Å; Y166-V175 HydrophobicContact CE1-CB 4.07Å; Y166-V175 HydrophobicContact CE1-CG1 3.35Å; Y166-V175 HydrophobicContact CE1-CG2 3.59Å; L167-V175 HydrophobicContact CD2-CG1 4.45Å; L167-V175 HydrophobicContact CD2-CG2 4.44Å; C173-V175 WeakPolarHBondContact O-CG2 3.42Å; C173-V175 PolarHBondContact O-N 2.66Å; V175-K177 PolarHBondContact O-N 3.08Å; V175-F178 HydrophobicContact CG1-CB 4.23Å; V175-F178 PolarHBondContact O-N 3.12Å
176	S	56.1	Low	63.3	Low	64 Å²	64	51 Å²	51	45%	0.448	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-57.6	-27.9	-172.1	63.3	0	0	0	0	112.9	N174	N174-S176 PolarHBondContact O-N 3.13Å; N174-S176 WeakPolarHBondContact OD1-CB 3.25Å; N174-S176 PolarHBondContact OD1-N 3.39Å; N174-S176 PolarHBondContact OD1-OG 2.84Å
177	K	54.7	Low	63.8	Low	192 Å²	192	51.2 Å²	51.2	84%	0.835	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-87.3	-16.4	177.8	-63.3	-172.6	179	-177.6	0	114.6	V175	V175-K177 PolarHBondContact O-N 3.08Å
178	F	58.6	Low	64.4	Low	14 Å²	14	50.2 Å²	50.2	6%	0.061	28%	0.277	C	S	.	.			trans	-90.9	132.2	179.7	-168	-131.5	0	0	0	110	A121 F125 F128 W163 V175 P180 F183 K220	A121-F178 HydrophobicContact CB-CE2 4.17Å; A121-F178 HydrophobicContact CB-CZ 4.09Å; F125-F178 AromaticContact CD2-CD2 3.83Å; F125-F178 HydrophobicContact CD2-CD2 3.83Å; F125-F178 AromaticContact CD2-CE2 3.73Å; F125-F178 HydrophobicContact CD2-CE2 3.73Å; F125-F178 HydrophobicContact CD2-CG 4.38Å; F125-F178 HydrophobicContact CD2-CZ 4.16Å; F125-F178 HydrophobicContact CE2-CB 4.35Å; F125-F178 AromaticContact CE2-CD2 3.65Å; F125-F178 HydrophobicContact CE2-CD2 3.65Å; F125-F178 HydrophobicContact CE2-CE2 4.05Å; F125-F178 HydrophobicContact CE2-CG 4.11Å; F125-F178 HydrophobicContact CZ-CB 4.34Å; F125-F178 HydrophobicContact CZ-CD2 4.44Å; F125-F178 HydrophobicContact CZ-CG 4.48Å; F128-F178 HydrophobicContact CD1-CE1 4.48Å; F128-F178 HydrophobicContact CE1-CE1 4.27Å; F128-F178 HydrophobicContact CZ-CD1 4.47Å; F128-F178 HydrophobicContact CZ-CE1 4.37Å; W163-F178 HydrophobicContact CH2-CD1 4.22Å; W163-F178 AromaticContact CH2-CE1 3.86Å; W163-F178 HydrophobicContact CH2-CE1 3.86Å; V175-F178 HydrophobicContact CG1-CB 4.23Å; V175-F178 PolarHBondContact O-N 3.12Å; F178-P180 HydrophobicContact CD1-CB 4.48Å; F178-P180 HydrophobicContact CE1-CB 4.22Å; F178-F183 AromaticContact CE1-CE1 3.63Å; F178-F183 HydrophobicContact CE1-CE1 3.63Å; F178-F183 HydrophobicContact CE1-CZ 4.02Å; F178-F183 HydrophobicContact CE2-CD1 4.35Å; F178-F183 AromaticContact CE2-CE1 3.88Å; F178-F183 HydrophobicContact CE2-CE1 3.88Å; F178-F183 AromaticContact CZ-CD1 3.97Å; F178-F183 HydrophobicContact CZ-CD1 3.97Å; F178-F183 AromaticContact CZ-CE1 3.11Å; F178-F183 HydrophobicContact CZ-CE1 3.11Å; F178-F183 AromaticContact CZ-CZ 3.69Å; F178-F183 HydrophobicContact CZ-CZ 3.69Å; F178-K220 PolarHBondContact O-NZ 3.47Å
179	D	62.8	Low	65	Low	32 Å²	32	48.2 Å²	48.2	17%	0.171	26%	0.263	C	S	.	.			trans	-118.4	102.6	169.2	-175.8	-5.2	0	0	0	108	A181 H182	D179-A181 PolarHBondContact O-N 3.4Å; D179-A181 WeakPolarHBondContact OD1-CB 3.44Å; D179-A181 PolarHBondContact OD1-N 2.87Å; D179-H182 PolarHBondContact O-CD2 3.32Å; D179-H182 IonicContact OD2-NE2 3.55Å; D179-H182 PolarHBondContact OD2-NE2 2.79Å
180	P	64.8	Low	66.1	Low	5 Å²	5	42.9 Å²	42.9	3%	0.032	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-71.3	-11.4	-175.7	31.2	-36.2	0	0	0	113.6	W163 F178 H182 F183 L184 I217	W163-P180 HydrophobicContact CE3-CG 4.39Å; W163-P180 HydrophobicContact CH2-CB 3.26Å; W163-P180 HydrophobicContact CH2-CG 3.61Å; W163-P180 HydrophobicContact CZ2-CB 3.21Å; W163-P180 HydrophobicContact CZ2-CG 3.81Å; W163-P180 HydrophobicContact CZ3-CB 4.08Å; W163-P180 HydrophobicContact CZ3-CG 3.9Å; F178-P180 HydrophobicContact CD1-CB 4.48Å; F178-P180 HydrophobicContact CE1-CB 4.22Å; P180-H182 PolarHBondContact O-N 3.32Å; P180-F183 VanDerWaalsContact CA-CE1 3.44Å; P180-F183 HydrophobicContact CB-CE1 3.69Å; P180-F183 HydrophobicContact CB-CZ 4.17Å; P180-F183 WeakPolarHBondContact O-CD1 3.06Å; P180-F183 PolarHBondContact O-N 3Å; P180-L184 HydrophobicContact CB-CD1 3.88Å; P180-L184 WeakPolarHBondContact O-CB 3.22Å; P180-L184 VanDerWaalsContact O-CG 3.27Å; P180-L184 WeakPolarHBondContact O-CG 3.32Å; P180-L184 PolarHBondContact O-N 3.12Å; P180-I217 HydrophobicContact CG-CB 4.36Å
181	A	64.7	Low	67.6	Low	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-62.1	-20.2	-178.9	0	0	0	0	0	113.4	P3 D179 I188	P3-A181 HydrophobicContact CB-CB 3.98Å; P3-A181 HydrophobicContact CG-CB 4.46Å; D179-A181 PolarHBondContact O-N 3.4Å; D179-A181 WeakPolarHBondContact OD1-CB 3.44Å; D179-A181 PolarHBondContact OD1-N 2.87Å; A181-I188 HydrophobicContact CB-CD1 3.64Å; A181-I188 VanDerWaalsContact O-CD1 3.25Å; A181-I188 WeakPolarHBondContact O-CD1 3.41Å
182	H	61.8	Low	69.3	Low	16 Å²	16	34.1 Å²	34.1	7%	0.074	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-75.6	-38.9	-177	-65.6	-51.4	0	0	0	113.8	P3 K4 K113 E114 D117 D179 P180	P3-H182 WeakPolarHBondContact CB-CE1 3.25Å; P3-H182 WeakPolarHBondContact CB-ND1 3.17Å; K4-H182 PolarHBondContact N-CE1 3.11Å; K113-H182 VanDerWaalsContact CD-CE1 3.49Å; K113-H182 WeakPolarHBondContact CD-CE1 2.78Å; K113-H182 WeakPolarHBondContact CD-ND1 3.39Å; K113-H182 VanDerWaalsContact CE-CD2 3.41Å; K113-H182 WeakPolarHBondContact CE-CD2 2.89Å; K113-H182 WeakPolarHBondContact CE-CE1 3.19Å; K113-H182 WeakPolarHBondContact CE-NE2 2.72Å; K113-H182 HydrophobicContact CG-CB 4.34Å; K113-H182 PolarHBondContact NZ-CE1 2.85Å; K113-H182 PolarHBondContact NZ-NE2 2.92Å; E114-H182 VanDerWaalsContact CA-O 3.29Å; E114-H182 WeakPolarHBondContact CA-O 3.36Å; E114-H182 VanDerWaalsContact CB-O 3.23Å; E114-H182 WeakPolarHBondContact CB-O 3.39Å; E114-H182 VanDerWaalsContact CG-O 3.29Å; E114-H182 WeakPolarHBondContact CG-O 3.16Å; D117-H182 HydrophobicContact CB-CB 3.98Å; D117-H182 WeakPolarHBondContact OD2-CB 3.37Å; D117-H182 IonicContact OD2-CD2 3.58Å; D117-H182 PolarHBondContact OD2-CD2 3.4Å; D117-H182 VanDerWaalsContact OD2-CD2 3.23Å; D117-H182 IonicContact OD2-CG 3.63Å; D179-H182 PolarHBondContact O-CD2 3.32Å; D179-H182 IonicContact OD2-NE2 3.55Å; D179-H182 PolarHBondContact OD2-NE2 2.79Å; P180-H182 PolarHBondContact O-N 3.32Å
183	F	67.5	Low	71	Confident	9 Å²	9	28 Å²	28	4%	0.039	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-2.3	-177.9	77	-88.6	0	0	0	112.8	H118 I132 W163 F178 P180	H118-F183 PolarHBondContact CE1-O 3.08Å; I132-F183 HydrophobicContact CB-CE2 4.38Å; I132-F183 HydrophobicContact CD1-CE2 3.33Å; I132-F183 HydrophobicContact CD1-CZ 3.52Å; I132-F183 HydrophobicContact CG1-CE2 4.38Å; I132-F183 HydrophobicContact CG2-CD2 4.4Å; I132-F183 HydrophobicContact CG2-CE2 3.95Å; W163-F183 HydrophobicContact CZ2-CZ 4.21Å; F178-F183 AromaticContact CE1-CE1 3.63Å; F178-F183 HydrophobicContact CE1-CE1 3.63Å; F178-F183 HydrophobicContact CE1-CZ 4.02Å; F178-F183 HydrophobicContact CE2-CD1 4.35Å; F178-F183 AromaticContact CE2-CE1 3.88Å; F178-F183 HydrophobicContact CE2-CE1 3.88Å; F178-F183 AromaticContact CZ-CD1 3.97Å; F178-F183 HydrophobicContact CZ-CD1 3.97Å; F178-F183 AromaticContact CZ-CE1 3.11Å; F178-F183 HydrophobicContact CZ-CE1 3.11Å; F178-F183 AromaticContact CZ-CZ 3.69Å; F178-F183 HydrophobicContact CZ-CZ 3.69Å; P180-F183 VanDerWaalsContact CA-CE1 3.44Å; P180-F183 HydrophobicContact CB-CE1 3.69Å; P180-F183 HydrophobicContact CB-CZ 4.17Å; P180-F183 WeakPolarHBondContact O-CD1 3.06Å; P180-F183 PolarHBondContact O-N 3Å
184	L	75.8	Confident	72.7	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.134	C	C	.	.			trans	-98.6	23.8	170.6	-63.8	177.9	0	0	0	112	I132 L159 W163 P180 D186 W187 I188 F213 I217	I132-L184 HydrophobicContact CD1-CD2 4.22Å; I132-L184 HydrophobicContact CG2-CD2 3.61Å; L159-L184 HydrophobicContact CD2-CD2 4.14Å; W163-L184 HydrophobicContact CZ2-CD1 3.89Å; W163-L184 VanDerWaalsContact NE1-CD1 3.32Å; P180-L184 HydrophobicContact CB-CD1 3.88Å; P180-L184 WeakPolarHBondContact O-CB 3.22Å; P180-L184 VanDerWaalsContact O-CG 3.27Å; P180-L184 WeakPolarHBondContact O-CG 3.32Å; P180-L184 PolarHBondContact O-N 3.12Å; L184-D186 PolarHBondContact O-N 3.22Å; L184-W187 HydrophobicContact CB-CB 4.33Å; L184-W187 HydrophobicContact CD2-CG 4.42Å; L184-W187 WeakPolarHBondContact O-CB 3.45Å; L184-W187 PolarHBondContact O-N 3.19Å; L184-I188 WeakPolarHBondContact O-CG1 3.21Å; L184-I188 PolarHBondContact O-N 3.2Å; L184-F213 HydrophobicContact CB-CZ 4.39Å; L184-F213 HydrophobicContact CD1-CE2 4.41Å; L184-F213 HydrophobicContact CD1-CZ 4.06Å; L184-I217 HydrophobicContact CD1-CG2 4.24Å
185	F	75.5	Confident	74.4	Confident	11 Å²	11	20.7 Å²	20.7	5%	0.048	10%	0.104	C	C	.	.	H	α-helix	trans	-54.3	-49	-173.4	-177.2	-97.9	0	0	0	112.7	I6 Y63 W187 I188 R189 W359 F362	I6-F185 HydrophobicContact CD1-CE2 3.82Å; Y63-F185 HydrophobicContact CE1-CD1 4.44Å; Y63-F185 HydrophobicContact CE2-CD1 4.1Å; Y63-F185 HydrophobicContact CE2-CE1 4.21Å; Y63-F185 AromaticContact CZ-CD1 3.69Å; Y63-F185 WeakPolarHBondContact OH-CD1 3.23Å; F185-W187 VanDerWaalsContact C-N 3.28Å; F185-W187 PolarHBondContact O-N 2.94Å; F185-I188 WeakPolarHBondContact O-CB 3.49Å; F185-I188 PolarHBondContact O-N 3.37Å; F185-R189 WeakPolarHBondContact O-CB 3.42Å; F185-R189 PolarHBondContact O-N 2.93Å; F185-W359 HydrophobicContact CE2-CZ3 4.41Å; F185-W359 HydrophobicContact CZ-CZ3 4.25Å; F185-F362 AromaticContact CE1-CE1 3.81Å; F185-F362 HydrophobicContact CE1-CE1 3.81Å; F185-F362 HydrophobicContact CE1-CZ 4.03Å; F185-F362 HydrophobicContact CZ-CD1 4.45Å; F185-F362 AromaticContact CZ-CE1 3.55Å; F185-F362 HydrophobicContact CZ-CE1 3.55Å; F185-F362 HydrophobicContact CZ-CZ 4.24Å
186	D	77.4	Confident	76.3	Confident	27 Å²	27	19.3 Å²	19.3	14%	0.144	10%	0.095	C	C	.	.	H	α-helix	trans	-62.2	-34.7	179	-68.3	-42.3	0	0	0	112.4	R67 L137 I139 L184 L190	R67-D186 IonicContact CZ-OD2 3.93Å; R67-D186 IonicContact NH1-OD1 3.28Å; R67-D186 IonicContact NH1-OD2 3.05Å; R67-D186 PolarHBondContact NH1-OD2 3.18Å; R67-D186 IonicContact NH2-OD2 3.05Å; L137-D186 HydrophobicContact CD1-CB 4.37Å; I139-D186 HydrophobicContact CD1-CB 4.32Å; L184-D186 PolarHBondContact O-N 3.22Å; D186-L190 WeakPolarHBondContact O-CB 3.5Å; D186-L190 PolarHBondContact O-N 2.96Å
187	W	83	Confident	77.8	Confident	9 Å²	9	16.2 Å²	16.2	3%	0.034	7%	0.074	C	C	.	.	H	α-helix	trans	-71.8	-39.3	175	-68.8	106.6	0	0	0	113	L135 L137 R155 L156 L159 L184 F185 R189 L190 A191 F213	L135-W187 HydrophobicContact CB-CH2 3.98Å; L135-W187 HydrophobicContact CB-CZ2 3.49Å; L135-W187 VanDerWaalsContact CB-CZ2 3.49Å; L135-W187 VanDerWaalsContact O-CH2 3.28Å; L135-W187 WeakPolarHBondContact O-CH2 3.41Å; L135-W187 WeakPolarHBondContact O-CZ2 3.3Å; L137-W187 HydrophobicContact CD1-CD2 3.6Å; L137-W187 HydrophobicContact CD1-CE3 3.49Å; L137-W187 VanDerWaalsContact CD1-CE3 3.49Å; L137-W187 HydrophobicContact CD1-CG 4.15Å; L137-W187 HydrophobicContact CD1-CH2 4.17Å; L137-W187 HydrophobicContact CD1-CZ2 4.29Å; L137-W187 HydrophobicContact CD1-CZ3 3.79Å; L137-W187 HydrophobicContact CD2-CE3 4.25Å; L137-W187 HydrophobicContact CD2-CH2 3.55Å; L137-W187 HydrophobicContact CD2-CZ2 4.14Å; L137-W187 HydrophobicContact CD2-CZ3 3.64Å; L137-W187 HydrophobicContact CG-CD2 3.96Å; L137-W187 HydrophobicContact CG-CE3 3.92Å; L137-W187 HydrophobicContact CG-CH2 3.62Å; L137-W187 HydrophobicContact CG-CZ2 3.71Å; L137-W187 HydrophobicContact CG-CZ3 3.75Å; R155-W187 HydrophobicContact CB-CH2 3.64Å; R155-W187 HydrophobicContact CB-CZ3 3.96Å; L156-W187 HydrophobicContact CB-CE3 4.43Å; L156-W187 HydrophobicContact CB-CZ3 4.34Å; L156-W187 HydrophobicContact CD1-CB 4.38Å; L156-W187 HydrophobicContact CD1-CD2 4.48Å; L156-W187 HydrophobicContact CD1-CE3 3.67Å; L156-W187 HydrophobicContact CD1-CZ3 4.39Å; L159-W187 HydrophobicContact CD2-CB 4.07Å; L159-W187 HydrophobicContact CD2-CD2 3.55Å; L159-W187 HydrophobicContact CD2-CE3 4.08Å; L159-W187 HydrophobicContact CD2-CG 3.54Å; L159-W187 HydrophobicContact CD2-CZ2 4.46Å; L184-W187 HydrophobicContact CB-CB 4.33Å; L184-W187 HydrophobicContact CD2-CG 4.42Å; L184-W187 WeakPolarHBondContact O-CB 3.45Å; L184-W187 PolarHBondContact O-N 3.19Å; F185-W187 VanDerWaalsContact C-N 3.28Å; F185-W187 PolarHBondContact O-N 2.94Å; W187-R189 VanDerWaalsContact C-N 3.3Å; W187-L190 HydrophobicContact CE3-CD2 3.84Å; W187-L190 HydrophobicContact CZ3-CD2 3.85Å; W187-L190 PolarHBondContact O-N 3.24Å; W187-A191 WeakPolarHBondContact O-CB 3.5Å; W187-A191 PolarHBondContact O-N 3.47Å; W187-F213 HydrophobicContact CB-CE1 3.83Å; W187-F213 HydrophobicContact CB-CZ 3.65Å
188	I	84.6	Confident	79.5	Confident	6 Å²	6	7.1 Å²	7.1	3%	0.031	3%	0.034	C	C	.	.	H	α-helix	trans	-62.5	-44.1	174.7	-72.2	170.9	0	0	0	109.7	A181 L184 F185 A191 Y192 F213 L214 I217	A181-I188 HydrophobicContact CB-CD1 3.64Å; A181-I188 VanDerWaalsContact O-CD1 3.25Å; A181-I188 WeakPolarHBondContact O-CD1 3.41Å; L184-I188 WeakPolarHBondContact O-CG1 3.21Å; L184-I188 PolarHBondContact O-N 3.2Å; F185-I188 WeakPolarHBondContact O-CB 3.49Å; F185-I188 PolarHBondContact O-N 3.37Å; I188-A191 WeakPolarHBondContact O-CB 3.35Å; I188-A191 PolarHBondContact O-N 3.15Å; I188-Y192 HydrophobicContact CG2-CD2 3.77Å; I188-Y192 HydrophobicContact CG2-CE2 3.42Å; I188-Y192 VanDerWaalsContact CG2-CE2 3.42Å; I188-Y192 WeakPolarHBondContact O-CD2 3.44Å; I188-Y192 PolarHBondContact O-N 3.08Å; I188-F213 HydrophobicContact CG1-CE1 3.94Å; I188-L214 HydrophobicContact CG1-CD2 4.46Å; I188-L214 HydrophobicContact CG2-CD2 4.03Å; I188-I217 HydrophobicContact CD1-CD1 3.79Å; I188-I217 HydrophobicContact CG1-CD1 3.58Å
189	R	83.7	Confident	81.1	Confident	1 Å²	1	6.8 Å²	6.8	0%	0.004	3%	0.033	C	C	.	.	H	α-helix	trans	-61	-46.4	175.7	-172.6	175.1	177.7	-152.5	3.4	111.4	F185 W187 A191 Y192 C193 F362 L363	F185-R189 WeakPolarHBondContact O-CB 3.42Å; F185-R189 PolarHBondContact O-N 2.93Å; W187-R189 VanDerWaalsContact C-N 3.3Å; R189-A191 VanDerWaalsContact C-N 3.31Å; R189-A191 PolarHBondContact O-N 3.4Å; R189-Y192 PolarHBondContact O-N 3.35Å; R189-C193 PolarHBondContact O-N 3.47Å; R189-C193 PolarHBondContact O-SG 3.43Å; R189-F362 VanDerWaalsContact CZ-O 3.25Å; R189-F362 PolarHBondContact NE-O 3.31Å; R189-F362 PolarHBondContact NH2-O 2.81Å; R189-L363 HydrophobicContact CB-CD2 4.33Å; R189-L363 HydrophobicContact CG-CD2 4.07Å
190	L	86.1	Confident	82.4	Confident	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-57.2	-43.9	172.9	173.9	64	0	0	0	112	L137 Y145 L152 D186 W187 Y192 C193 L194 F370	L137-L190 HydrophobicContact CD1-CB 4.06Å; L137-L190 HydrophobicContact CD1-CD2 3.73Å; L137-L190 HydrophobicContact CD2-CD2 4.12Å; Y145-L190 HydrophobicContact CE1-CD1 4.34Å; Y145-L190 HydrophobicContact CE2-CD1 4.3Å; L152-L190 HydrophobicContact CB-CD1 4.27Å; L152-L190 HydrophobicContact CB-CD2 4.14Å; L152-L190 HydrophobicContact CD1-CD1 4.26Å; L152-L190 HydrophobicContact CD2-CD1 4.28Å; L152-L190 HydrophobicContact CD2-CD2 3.9Å; D186-L190 WeakPolarHBondContact O-CB 3.5Å; D186-L190 PolarHBondContact O-N 2.96Å; W187-L190 HydrophobicContact CE3-CD2 3.84Å; W187-L190 HydrophobicContact CZ3-CD2 3.85Å; W187-L190 PolarHBondContact O-N 3.24Å; L190-Y192 PolarHBondContact O-N 3.12Å; L190-C193 WeakPolarHBondContact O-CB 3.11Å; L190-C193 PolarHBondContact O-N 2.88Å; L190-L194 HydrophobicContact CD1-CD1 4.22Å; L190-L194 HydrophobicContact CD1-CG 4.13Å; L190-L194 HydrophobicContact CG-CD1 4.09Å; L190-L194 HydrophobicContact CG-CG 4.41Å; L190-L194 WeakPolarHBondContact O-CG 3.48Å; L190-L194 PolarHBondContact O-N 3.49Å; L190-F370 HydrophobicContact CD1-CE1 4.45Å; L190-F370 HydrophobicContact CD1-CE2 3.99Å; L190-F370 HydrophobicContact CD1-CZ 3.42Å; L190-F370 VanDerWaalsContact CD1-CZ 3.42Å
191	A	90.1	Very high	83.6	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-61.5	-43.9	178.9	0	0	0	0	0	111.6	L156 W187 I188 R189 C193 L194 I195 F213 L214	L156-A191 HydrophobicContact CD2-CB 3.95Å; W187-A191 WeakPolarHBondContact O-CB 3.5Å; W187-A191 PolarHBondContact O-N 3.47Å; I188-A191 WeakPolarHBondContact O-CB 3.35Å; I188-A191 PolarHBondContact O-N 3.15Å; R189-A191 VanDerWaalsContact C-N 3.31Å; R189-A191 PolarHBondContact O-N 3.4Å; A191-C193 PolarHBondContact O-N 3.36Å; A191-L194 PolarHBondContact O-N 2.95Å; A191-I195 WeakPolarHBondContact O-CD1 3.33Å; A191-I195 WeakPolarHBondContact O-CG1 3.16Å; A191-I195 PolarHBondContact O-N 3.4Å; A191-F213 HydrophobicContact CB-CD1 3.67Å; A191-F213 HydrophobicContact CB-CE1 4.41Å; A191-L214 HydrophobicContact CB-CD2 4.02Å; A191-L214 HydrophobicContact CB-CG 4.05Å
192	Y	90.8	Very high	84.8	Confident	16 Å²	16	18.3 Å²	18.3	6%	0.063	8%	0.082	C	C	.	.	H	α-helix	trans	-59.4	-44.5	173	-75.4	-59.4	0	0	0	112.3	I188 R189 L190 L194 I195 V196 L214 H324 L325 L328 L363	I188-Y192 HydrophobicContact CG2-CD2 3.77Å; I188-Y192 HydrophobicContact CG2-CE2 3.42Å; I188-Y192 VanDerWaalsContact CG2-CE2 3.42Å; I188-Y192 WeakPolarHBondContact O-CD2 3.44Å; I188-Y192 PolarHBondContact O-N 3.08Å; R189-Y192 PolarHBondContact O-N 3.35Å; L190-Y192 PolarHBondContact O-N 3.12Å; Y192-L194 PolarHBondContact O-N 3.03Å; Y192-I195 PolarHBondContact O-N 2.73Å; Y192-V196 WeakPolarHBondContact O-CG2 3.5Å; Y192-V196 PolarHBondContact O-N 3.22Å; Y192-L214 HydrophobicContact CD1-CD1 3.83Å; Y192-L214 HydrophobicContact CE1-CD1 3.54Å; Y192-L214 HydrophobicContact CE2-CD2 4.43Å; Y192-L214 HydrophobicContact CG-CD1 4.49Å; Y192-H324 HydrophobicContact CE1-CB 4.35Å; Y192-H324 PolarHBondContact OH-ND1 2.62Å; Y192-L325 HydrophobicContact CD1-CD2 3.65Å; Y192-L325 HydrophobicContact CE1-CD2 3.98Å; Y192-L328 HydrophobicContact CD1-CD1 3.54Å; Y192-L328 HydrophobicContact CE1-CD1 4.19Å; Y192-L328 HydrophobicContact CG-CD1 3.96Å; Y192-L363 HydrophobicContact CD2-CD1 4.27Å; Y192-L363 HydrophobicContact CD2-CD2 4.15Å; Y192-L363 HydrophobicContact CE2-CD1 4.48Å
193	C	88.3	Confident	86.2	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.5	-46.1	175.2	-69.5	0	0	0	0	112.3	R189 L190 A191 I195 V196 S197 L363 L367 F370	R189-C193 PolarHBondContact O-N 3.47Å; R189-C193 PolarHBondContact O-SG 3.43Å; L190-C193 WeakPolarHBondContact O-CB 3.11Å; L190-C193 PolarHBondContact O-N 2.88Å; A191-C193 PolarHBondContact O-N 3.36Å; C193-I195 VanDerWaalsContact C-N 3.31Å; C193-I195 PolarHBondContact O-N 3.09Å; C193-V196 PolarHBondContact O-N 2.84Å; C193-S197 WeakPolarHBondContact O-CB 3.42Å; C193-S197 PolarHBondContact O-N 2.89Å; C193-L363 PolarHBondContact SG-O 2.84Å; C193-L367 HydrophobicContact CB-CD1 4.06Å; C193-L367 WeakPolarHBondContact O-CD1 3.34Å; C193-F370 HydrophobicContact CB-CD2 4.15Å; C193-F370 HydrophobicContact CB-CE2 3.93Å
194	L	90.1	Very high	87.2	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.1	-37	178.9	-74.7	174.7	0	0	0	112.2	V153 L156 L190 A191 Y192 G198 Y206 F370	V153-L194 HydrophobicContact CG2-CD1 4.08Å; V153-L194 HydrophobicContact CG2-CD2 3.72Å; L156-L194 HydrophobicContact CD2-CD1 3.58Å; L190-L194 HydrophobicContact CD1-CD1 4.22Å; L190-L194 HydrophobicContact CD1-CG 4.13Å; L190-L194 HydrophobicContact CG-CD1 4.09Å; L190-L194 HydrophobicContact CG-CG 4.41Å; L190-L194 WeakPolarHBondContact O-CG 3.48Å; L190-L194 PolarHBondContact O-N 3.49Å; A191-L194 PolarHBondContact O-N 2.95Å; Y192-L194 PolarHBondContact O-N 3.03Å; L194-G198 WeakPolarHBondContact O-CA 3.08Å; L194-G198 PolarHBondContact O-N 3.42Å; L194-Y206 HydrophobicContact CD2-CD2 3.86Å; L194-Y206 HydrophobicContact CD2-CE2 4.33Å; L194-Y206 HydrophobicContact CD2-CG 4.07Å; L194-Y206 WeakPolarHBondContact O-CB 3.41Å; L194-F370 HydrophobicContact CD2-CD1 3.96Å; L194-F370 HydrophobicContact CD2-CE1 3.42Å; L194-F370 VanDerWaalsContact CD2-CE1 3.42Å; L194-F370 HydrophobicContact CD2-CZ 3.97Å; L194-F370 HydrophobicContact CG-CE1 4.32Å; L194-F370 HydrophobicContact CG-CZ 4.41Å
195	I	92.7	Very high	87.9	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-64.6	-51.7	176.8	-67.9	164.1	0	0	0	110.5	A191 Y192 C193 G198 I199 F207 V211 L214 L325	A191-I195 WeakPolarHBondContact O-CD1 3.33Å; A191-I195 WeakPolarHBondContact O-CG1 3.16Å; A191-I195 PolarHBondContact O-N 3.4Å; Y192-I195 PolarHBondContact O-N 2.73Å; C193-I195 VanDerWaalsContact C-N 3.31Å; C193-I195 PolarHBondContact O-N 3.09Å; I195-G198 WeakPolarHBondContact O-CA 3.18Å; I195-G198 PolarHBondContact O-N 2.76Å; I195-G198 VanDerWaalsContact O-N 3.15Å; I195-I199 WeakPolarHBondContact O-CG1 3.37Å; I195-I199 PolarHBondContact O-N 3.41Å; I195-F207 HydrophobicContact CB-CD2 4.47Å; I195-F207 HydrophobicContact CG2-CD2 3.66Å; I195-F207 HydrophobicContact CG2-CE2 3.75Å; I195-V211 HydrophobicContact CD1-CG2 3.92Å; I195-V211 HydrophobicContact CG1-CG2 3.97Å; I195-V211 HydrophobicContact CG2-CG2 4.49Å; I195-L214 HydrophobicContact CD1-CD1 3.42Å; I195-L214 VanDerWaalsContact CD1-CD1 3.42Å; I195-L214 HydrophobicContact CD1-CG 4.22Å; I195-L325 HydrophobicContact CB-CD2 4.06Å; I195-L325 HydrophobicContact CD1-CD1 4.28Å; I195-L325 HydrophobicContact CD1-CD2 3.93Å; I195-L325 HydrophobicContact CG2-CD1 3.8Å; I195-L325 HydrophobicContact CG2-CD2 3.5Å; I195-L325 HydrophobicContact CG2-CG 4.2Å
196	V	92.4	Very high	88.6	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-44.3	-179.5	174.6	0	0	0	0	110.9	Y192 C193 G198 I199 V200 L328 Q332 L364 L367	Y192-V196 WeakPolarHBondContact O-CG2 3.5Å; Y192-V196 PolarHBondContact O-N 3.22Å; C193-V196 PolarHBondContact O-N 2.84Å; V196-G198 VanDerWaalsContact C-N 3.26Å; V196-G198 PolarHBondContact O-N 3.34Å; V196-I199 PolarHBondContact O-N 2.91Å; V196-I199 VanDerWaalsContact O-N 3.16Å; V196-V200 HydrophobicContact CG1-CG2 4.1Å; V196-V200 WeakPolarHBondContact O-CB 3.32Å; V196-V200 WeakPolarHBondContact O-CG2 3.45Å; V196-V200 PolarHBondContact O-N 3.04Å; V196-L328 HydrophobicContact CG2-CB 3.79Å; V196-L328 HydrophobicContact CG2-CD1 4.43Å; V196-Q332 HydrophobicContact CG1-CB 3.87Å; V196-Q332 HydrophobicContact CG1-CG 3.72Å; V196-L364 HydrophobicContact CB-CD2 3.98Å; V196-L364 HydrophobicContact CG1-CD1 4.37Å; V196-L364 HydrophobicContact CG1-CD2 4.22Å; V196-L364 HydrophobicContact CG2-CD2 3.8Å; V196-L367 HydrophobicContact CB-CD1 4.26Å; V196-L367 HydrophobicContact CG1-CD1 4.34Å; V196-L367 HydrophobicContact CG1-CD2 4.08Å
197	S	89.3	Confident	89.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.4	-41.4	172.2	177.5	0	0	0	0	111.4	C193 I199 V200 Y201	C193-S197 WeakPolarHBondContact O-CB 3.42Å; C193-S197 PolarHBondContact O-N 2.89Å; S197-I199 PolarHBondContact O-N 3.17Å; S197-V200 PolarHBondContact O-N 2.87Å; S197-Y201 WeakPolarHBondContact O-CB 3.16Å; S197-Y201 VanDerWaalsContact O-CD2 3.26Å; S197-Y201 WeakPolarHBondContact O-CD2 3.17Å; S197-Y201 PolarHBondContact O-N 3.18Å; S197-Y201 WeakPolarHBondContact OG-CD2 3.17Å
198	G	90.4	Very high	89.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-56.9	-46.1	174.7	0	0	0	0	0	112.6	L194 I195 V196 K202 R203 W237	L194-G198 WeakPolarHBondContact O-CA 3.08Å; L194-G198 PolarHBondContact O-N 3.42Å; I195-G198 WeakPolarHBondContact O-CA 3.18Å; I195-G198 PolarHBondContact O-N 2.76Å; I195-G198 VanDerWaalsContact O-N 3.15Å; V196-G198 VanDerWaalsContact C-N 3.26Å; V196-G198 PolarHBondContact O-N 3.34Å; G198-K202 CarbonylContact O-C 3.48Å; G198-K202 WeakPolarHBondContact O-CA 3.35Å; G198-K202 PolarHBondContact O-N 2.84Å; G198-R203 WeakPolarHBondContact CA-O 3.49Å; G198-R203 PolarHBondContact O-N 3.21Å; G198-W237 VanDerWaalsContact O-CH2 3.28Å; G198-W237 WeakPolarHBondContact O-CH2 3.13Å; G198-W237 WeakPolarHBondContact O-CZ3 3.21Å
199	I	92.2	Very high	90.2	Very high	7 Å²	7	29 Å²	29	4%	0.036	13%	0.133	C	C	.	.	H	α-helix	trans	-67.1	-51.8	177.1	-65.6	-64.9	0	0	0	111.2	I195 V196 S197 Y201 K202 F207 W237 L240 A241 Y244	I195-I199 WeakPolarHBondContact O-CG1 3.37Å; I195-I199 PolarHBondContact O-N 3.41Å; V196-I199 PolarHBondContact O-N 2.91Å; V196-I199 VanDerWaalsContact O-N 3.16Å; S197-I199 PolarHBondContact O-N 3.17Å; I199-Y201 PolarHBondContact O-N 3.41Å; I199-K202 PolarHBondContact O-N 3.37Å; I199-F207 HydrophobicContact CD1-CD2 3.77Å; I199-F207 HydrophobicContact CD1-CE2 3.73Å; I199-F207 HydrophobicContact CG1-CD2 3.91Å; I199-F207 HydrophobicContact CG1-CE2 4.08Å; I199-W237 HydrophobicContact CD1-CD2 4.18Å; I199-W237 HydrophobicContact CD1-CE3 3.61Å; I199-W237 HydrophobicContact CD1-CZ3 3.86Å; I199-L240 HydrophobicContact CD1-CB 3.9Å; I199-L240 HydrophobicContact CG1-CB 4.28Å; I199-A241 HydrophobicContact CD1-CB 4.39Å; I199-Y244 HydrophobicContact CG2-CD1 3.88Å; I199-Y244 HydrophobicContact CG2-CD2 4.46Å; I199-Y244 HydrophobicContact CG2-CG 3.7Å
200	V	90	Very high	90.5	Very high	29 Å²	29	28.9 Å²	28.9	18%	0.176	13%	0.133	C	C	.	.	H	α-helix	trans	-58.4	-48.2	-177.2	173.4	0	0	0	0	111.3	V196 S197 Y244 Q332	V196-V200 HydrophobicContact CG1-CG2 4.1Å; V196-V200 WeakPolarHBondContact O-CB 3.32Å; V196-V200 WeakPolarHBondContact O-CG2 3.45Å; V196-V200 PolarHBondContact O-N 3.04Å; S197-V200 PolarHBondContact O-N 2.87Å; V200-Y244 HydrophobicContact CB-CE1 4.46Å; V200-Y244 HydrophobicContact CG2-CE1 4.22Å; V200-Y244 HydrophobicContact CG2-CE2 3.78Å; V200-Q332 HydrophobicContact CG2-CG 3.74Å
201	Y	89.5	Confident	90.7	Very high	86 Å²	86	28.9 Å²	28.9	34%	0.337	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	9.3	-175	-59.6	-66.7	0	0	0	113.8	S197 I199 R203 T371	S197-Y201 WeakPolarHBondContact O-CB 3.16Å; S197-Y201 VanDerWaalsContact O-CD2 3.26Å; S197-Y201 WeakPolarHBondContact O-CD2 3.17Å; S197-Y201 PolarHBondContact O-N 3.18Å; S197-Y201 WeakPolarHBondContact OG-CD2 3.17Å; I199-Y201 PolarHBondContact O-N 3.41Å; Y201-R203 PolarHBondContact O-N 3.42Å; Y201-T371 HydrophobicContact CE2-CG2 4.35Å; Y201-T371 WeakPolarHBondContact OH-CB 3.39Å; Y201-T371 WeakPolarHBondContact OH-CG2 3.45Å
202	K	89.8	Confident	90.7	Very high	165 Å²	165	34 Å²	34	72%	0.717	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	35	-177.7	-57.1	-177.7	-179.7	180	0	113.3	G198 I199 I204	G198-K202 CarbonylContact O-C 3.48Å; G198-K202 WeakPolarHBondContact O-CA 3.35Å; G198-K202 PolarHBondContact O-N 2.84Å; I199-K202 PolarHBondContact O-N 3.37Å; K202-I204 PolarHBondContact O-N 3.26Å
203	R	90	Very high	90.7	Very high	83 Å²	83	33.2 Å²	33.2	31%	0.313	15%	0.149	S	C	.	.			trans	-94.6	86.2	177.8	-64.8	-175.5	-173.8	175	7.9	110.3	Q149 G198 Y201 N205 Y206 F207	Q149-R203 VanDerWaalsContact OE1-NH1 3.11Å; G198-R203 WeakPolarHBondContact CA-O 3.49Å; G198-R203 PolarHBondContact O-N 3.21Å; Y201-R203 PolarHBondContact O-N 3.42Å; R203-N205 PolarHBondContact O-N 3.08Å; R203-Y206 HydrophobicContact CB-CD1 4.46Å; R203-Y206 HydrophobicContact CB-CD2 4.26Å; R203-Y206 HydrophobicContact CB-CG 4.06Å; R203-Y206 VanDerWaalsContact NH1-CE2 3.3Å; R203-Y206 PolarHBondContact NH1-OH 3.49Å; R203-Y206 PolarHBondContact O-N 2.85Å; R203-Y206 VanDerWaalsContact O-N 3.11Å; R203-F207 PolarHBondContact O-N 3.36Å
204	I	89.7	Confident	90.5	Very high	76 Å²	76	33.5 Å²	33.5	39%	0.39	15%	0.151	S	C	.	.	H	α-helix	trans	-61.1	-29	-176.3	-163.1	164.1	0	0	0	113.2	K202 F207 N208 W237	K202-I204 PolarHBondContact O-N 3.26Å; I204-F207 PolarHBondContact O-N 2.92Å; I204-N208 VanDerWaalsContact O-CB 3.29Å; I204-N208 WeakPolarHBondContact O-CB 3.27Å; I204-N208 PolarHBondContact O-N 3.43Å; I204-N208 PolarHBondContact O-ND2 3.44Å; I204-N208 PolarHBondContact O-OD1 2.83Å; I204-W237 HydrophobicContact CB-CH2 4.17Å; I204-W237 HydrophobicContact CB-CZ2 4.42Å; I204-W237 HydrophobicContact CB-CZ3 4.34Å; I204-W237 HydrophobicContact CD1-CD2 4.47Å; I204-W237 HydrophobicContact CG1-CD2 4.36Å; I204-W237 HydrophobicContact CG1-CE3 4.3Å; I204-W237 HydrophobicContact CG1-CZ3 4.42Å
205	N	90	Very high	90.1	Very high	72 Å²	72	33.5 Å²	33.5	39%	0.385	15%	0.151	S	C	.	.	H	α-helix	trans	-63.1	-43.3	175.1	62.1	-33.6	0	0	0	112.1	R203 F207 N208 V209	R203-N205 PolarHBondContact O-N 3.08Å; N205-F207 VanDerWaalsContact C-N 3.34Å; N205-N208 PolarHBondContact O-N 2.95Å; N205-V209 WeakPolarHBondContact O-CG2 3.32Å; N205-V209 PolarHBondContact O-N 3Å
206	Y	91	Very high	89.6	Confident	16 Å²	16	33.4 Å²	33.4	6%	0.063	15%	0.15	C	C	.	.	H	α-helix	trans	-65.3	-43.6	179.5	-71.7	14.3	0	0	0	110.5	Q149 V153 L194 R203 G210 F370	Q149-Y206 PolarHBondContact OE1-OH 3.42Å; V153-Y206 HydrophobicContact CG2-CD1 3.79Å; V153-Y206 HydrophobicContact CG2-CE1 3.76Å; V153-Y206 HydrophobicContact CG2-CG 4.37Å; L194-Y206 HydrophobicContact CD2-CD2 3.86Å; L194-Y206 HydrophobicContact CD2-CE2 4.33Å; L194-Y206 HydrophobicContact CD2-CG 4.07Å; L194-Y206 WeakPolarHBondContact O-CB 3.41Å; R203-Y206 HydrophobicContact CB-CD1 4.46Å; R203-Y206 HydrophobicContact CB-CD2 4.26Å; R203-Y206 HydrophobicContact CB-CG 4.06Å; R203-Y206 VanDerWaalsContact NH1-CE2 3.3Å; R203-Y206 PolarHBondContact NH1-OH 3.49Å; R203-Y206 PolarHBondContact O-N 2.85Å; R203-Y206 VanDerWaalsContact O-N 3.11Å; Y206-G210 PolarHBondContact O-N 3.15Å; Y206-F370 HydrophobicContact CE2-CD1 4.45Å
207	F	92.6	Very high	88.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.4	-50.7	174	-179.8	-91.4	0	0	0	112.1	I195 I199 R203 I204 N205 V209 G210 V211 I233 L236 W237 L240	I195-F207 HydrophobicContact CB-CD2 4.47Å; I195-F207 HydrophobicContact CG2-CD2 3.66Å; I195-F207 HydrophobicContact CG2-CE2 3.75Å; I199-F207 HydrophobicContact CD1-CD2 3.77Å; I199-F207 HydrophobicContact CD1-CE2 3.73Å; I199-F207 HydrophobicContact CG1-CD2 3.91Å; I199-F207 HydrophobicContact CG1-CE2 4.08Å; R203-F207 PolarHBondContact O-N 3.36Å; I204-F207 PolarHBondContact O-N 2.92Å; N205-F207 VanDerWaalsContact C-N 3.34Å; F207-V209 PolarHBondContact O-N 2.75Å; F207-G210 PolarHBondContact O-N 3.37Å; F207-V211 HydrophobicContact CD1-CG2 4.06Å; F207-V211 HydrophobicContact CD2-CG2 4.29Å; F207-V211 HydrophobicContact CE1-CG2 3.72Å; F207-V211 HydrophobicContact CE2-CG2 3.96Å; F207-V211 HydrophobicContact CG-CG2 4.32Å; F207-V211 HydrophobicContact CZ-CG2 3.67Å; F207-V211 WeakPolarHBondContact O-CB 2.92Å; F207-V211 WeakPolarHBondContact O-CG2 3.35Å; F207-V211 PolarHBondContact O-N 2.96Å; F207-I233 HydrophobicContact CE1-CG2 4.34Å; F207-L236 HydrophobicContact CZ-CB 4.17Å; F207-L236 HydrophobicContact CZ-CD2 4.11Å; F207-L236 HydrophobicContact CZ-CG 3.95Å; F207-W237 HydrophobicContact CB-CE3 3.69Å; F207-W237 HydrophobicContact CB-CZ3 3.55Å; F207-W237 HydrophobicContact CD1-CB 4.27Å; F207-W237 AromaticContact CD1-CE3 3.64Å; F207-W237 HydrophobicContact CD1-CE3 3.64Å; F207-W237 HydrophobicContact CD1-CZ3 4.39Å; F207-W237 AromaticContact CD2-CE3 3.67Å; F207-W237 HydrophobicContact CD2-CE3 3.67Å; F207-W237 HydrophobicContact CD2-CZ3 4.07Å; F207-W237 HydrophobicContact CE1-CB 3.71Å; F207-W237 HydrophobicContact CE1-CE3 4.13Å; F207-W237 HydrophobicContact CE2-CE3 4.16Å; F207-W237 AromaticContact CG-CE3 3.39Å; F207-W237 HydrophobicContact CG-CE3 3.39Å; F207-W237 AromaticContact CG-CZ3 3.78Å; F207-W237 HydrophobicContact CG-CZ3 3.78Å; F207-W237 HydrophobicContact CZ-CB 3.94Å; F207-W237 HydrophobicContact CZ-CE3 4.37Å; F207-L240 HydrophobicContact CE2-CD1 3.89Å; F207-L240 HydrophobicContact CZ-CD1 4.29Å
208	N	92.4	Very high	88.1	Confident	41 Å²	41	35 Å²	35	22%	0.219	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-47.8	-177.9	-73.4	-7.5	0	0	0	111.8	I204 N205 R212 I233	I204-N208 VanDerWaalsContact O-CB 3.29Å; I204-N208 WeakPolarHBondContact O-CB 3.27Å; I204-N208 PolarHBondContact O-N 3.43Å; I204-N208 PolarHBondContact O-ND2 3.44Å; I204-N208 PolarHBondContact O-OD1 2.83Å; N205-N208 PolarHBondContact O-N 2.95Å; N208-R212 WeakPolarHBondContact O-CB 3.17Å; N208-R212 WeakPolarHBondContact O-CG 3.49Å; N208-R212 PolarHBondContact O-N 3.45Å; N208-I233 WeakPolarHBondContact OD1-CG2 3.34Å
209	V	92.1	Very high	87.1	Confident	13 Å²	13	35.1 Å²	35.1	8%	0.079	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-45	-179.8	176.3	0	0	0	0	110.6	V153 L156 E157 N205 F207 F213	V153-V209 HydrophobicContact CG1-CB 4.32Å; V153-V209 HydrophobicContact CG1-CG1 4.33Å; V153-V209 HydrophobicContact CG1-CG2 3.93Å; L156-V209 HydrophobicContact CB-CG1 4.02Å; L156-V209 HydrophobicContact CD2-CG1 3.96Å; L156-V209 HydrophobicContact CG-CG1 4.03Å; E157-V209 HydrophobicContact CB-CG1 4.1Å; E157-V209 HydrophobicContact CB-CG2 4.49Å; N205-V209 WeakPolarHBondContact O-CG2 3.32Å; N205-V209 PolarHBondContact O-N 3Å; F207-V209 PolarHBondContact O-N 2.75Å; V209-F213 WeakPolarHBondContact O-CB 3.43Å; V209-F213 PolarHBondContact O-N 3Å
210	G	91.6	Very high	85.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.5	-48	178.6	0	0	0	0	0	113.3	Y206 F207 F213 L214	Y206-G210 PolarHBondContact O-N 3.15Å; F207-G210 PolarHBondContact O-N 3.37Å; G210-F213 PolarHBondContact O-N 3Å; G210-L214 WeakPolarHBondContact O-CG 3.28Å; G210-L214 PolarHBondContact O-N 3.48Å
211	V	90.6	Very high	84.6	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-45.4	178.9	172.6	0	0	0	0	110.7	I195 F207 F213 L214 V215 I229 L232 I233 L236	I195-V211 HydrophobicContact CD1-CG2 3.92Å; I195-V211 HydrophobicContact CG1-CG2 3.97Å; I195-V211 HydrophobicContact CG2-CG2 4.49Å; F207-V211 HydrophobicContact CD1-CG2 4.06Å; F207-V211 HydrophobicContact CD2-CG2 4.29Å; F207-V211 HydrophobicContact CE1-CG2 3.72Å; F207-V211 HydrophobicContact CE2-CG2 3.96Å; F207-V211 HydrophobicContact CG-CG2 4.32Å; F207-V211 HydrophobicContact CZ-CG2 3.67Å; F207-V211 WeakPolarHBondContact O-CB 2.92Å; F207-V211 WeakPolarHBondContact O-CG2 3.35Å; F207-V211 PolarHBondContact O-N 2.96Å; V211-F213 VanDerWaalsContact C-N 3.29Å; V211-F213 PolarHBondContact O-N 3.27Å; V211-L214 PolarHBondContact O-N 3.3Å; V211-V215 HydrophobicContact CG1-CG2 4.02Å; V211-V215 WeakPolarHBondContact O-CB 3.27Å; V211-V215 VanDerWaalsContact O-CG2 3.24Å; V211-V215 WeakPolarHBondContact O-CG2 3.3Å; V211-V215 PolarHBondContact O-N 3.41Å; V211-I229 HydrophobicContact CG1-CD1 4.48Å; V211-L232 HydrophobicContact CG1-CD2 4.42Å; V211-I233 HydrophobicContact CG1-CG1 4.33Å; V211-L236 HydrophobicContact CG1-CD2 3.95Å; V211-L236 HydrophobicContact CG2-CD2 3.93Å
212	R	89.9	Confident	83.5	Confident	106 Å²	106	33.6 Å²	33.6	40%	0.4	15%	0.153	S	C	.	.	H	α-helix	trans	-57.5	-43.7	177.2	-79.1	178.5	173	-167.9	-3.3	111.8	T160 N208 V215 V216 Y225 I229 I233	T160-R212 HydrophobicContact CG2-CB 4.08Å; N208-R212 WeakPolarHBondContact O-CB 3.17Å; N208-R212 WeakPolarHBondContact O-CG 3.49Å; N208-R212 PolarHBondContact O-N 3.45Å; R212-V215 PolarHBondContact O-N 2.7Å; R212-V216 WeakPolarHBondContact O-CB 3.29Å; R212-V216 PolarHBondContact O-N 2.88Å; R212-Y225 WeakPolarHBondContact CB-OH 3.49Å; R212-Y225 WeakPolarHBondContact O-CE2 3.48Å; R212-I229 HydrophobicContact CG-CD1 4.17Å; R212-I229 HydrophobicContact CG-CG2 4.19Å; R212-I233 HydrophobicContact CG-CD1 3.96Å
213	F	89.1	Confident	82.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.4	-49.8	175.6	-179.8	-107.2	0	0	0	111.8	L156 L159 T160 L184 W187 I188 A191 V209 G210 V211 V215 V216 I217	L156-F213 HydrophobicContact CD1-CB 4.04Å; L156-F213 HydrophobicContact CD1-CD1 3.68Å; L156-F213 HydrophobicContact CD1-CD2 3.73Å; L156-F213 HydrophobicContact CD1-CE1 3.98Å; L156-F213 HydrophobicContact CD1-CE2 4.07Å; L156-F213 HydrophobicContact CD1-CG 3.52Å; L156-F213 HydrophobicContact CD1-CZ 4.16Å; L156-F213 HydrophobicContact CD2-CB 4.26Å; L156-F213 HydrophobicContact CG-CB 4.07Å; L156-F213 HydrophobicContact CG-CD2 4.43Å; L156-F213 HydrophobicContact CG-CG 4.1Å; L159-F213 HydrophobicContact CD2-CD2 4.41Å; L159-F213 HydrophobicContact CD2-CE2 3.47Å; L159-F213 VanDerWaalsContact CD2-CE2 3.47Å; L159-F213 HydrophobicContact CD2-CZ 3.82Å; L159-F213 HydrophobicContact CG-CD2 4.49Å; L159-F213 HydrophobicContact CG-CE2 3.77Å; T160-F213 WeakPolarHBondContact OG1-CB 3.18Å; L184-F213 HydrophobicContact CB-CZ 4.39Å; L184-F213 HydrophobicContact CD1-CE2 4.41Å; L184-F213 HydrophobicContact CD1-CZ 4.06Å; W187-F213 HydrophobicContact CB-CE1 3.83Å; W187-F213 HydrophobicContact CB-CZ 3.65Å; I188-F213 HydrophobicContact CG1-CE1 3.94Å; A191-F213 HydrophobicContact CB-CD1 3.67Å; A191-F213 HydrophobicContact CB-CE1 4.41Å; V209-F213 WeakPolarHBondContact O-CB 3.43Å; V209-F213 PolarHBondContact O-N 3Å; G210-F213 PolarHBondContact O-N 3Å; V211-F213 VanDerWaalsContact C-N 3.29Å; V211-F213 PolarHBondContact O-N 3.27Å; F213-V215 VanDerWaalsContact C-N 3.3Å; F213-V215 PolarHBondContact O-N 3.49Å; F213-V216 WeakPolarHBondContact O-CG1 3.23Å; F213-V216 PolarHBondContact O-N 3.04Å; F213-I217 HydrophobicContact CD1-CD1 4.23Å; F213-I217 HydrophobicContact CD2-CG2 4.18Å; F213-I217 HydrophobicContact CE1-CD1 3.89Å; F213-I217 HydrophobicContact CE1-CG2 4.43Å; F213-I217 HydrophobicContact CE2-CG2 3.74Å; F213-I217 HydrophobicContact CZ-CD1 4.28Å; F213-I217 HydrophobicContact CZ-CG2 3.91Å; F213-I217 WeakPolarHBondContact O-CG1 3.29Å; F213-I217 WeakPolarHBondContact O-CG2 3.32Å; F213-I217 PolarHBondContact O-N 3.07Å
214	L	85.8	Confident	81.2	Confident	6 Å²	6	30 Å²	30	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-62.1	-37.1	179.8	-69.3	-175.4	0	0	0	112.6	I188 A191 Y192 I195 G210 V211 I217 K218	I188-L214 HydrophobicContact CG1-CD2 4.46Å; I188-L214 HydrophobicContact CG2-CD2 4.03Å; A191-L214 HydrophobicContact CB-CD2 4.02Å; A191-L214 HydrophobicContact CB-CG 4.05Å; Y192-L214 HydrophobicContact CD1-CD1 3.83Å; Y192-L214 HydrophobicContact CE1-CD1 3.54Å; Y192-L214 HydrophobicContact CE2-CD2 4.43Å; Y192-L214 HydrophobicContact CG-CD1 4.49Å; I195-L214 HydrophobicContact CD1-CD1 3.42Å; I195-L214 VanDerWaalsContact CD1-CD1 3.42Å; I195-L214 HydrophobicContact CD1-CG 4.22Å; G210-L214 WeakPolarHBondContact O-CG 3.28Å; G210-L214 PolarHBondContact O-N 3.48Å; V211-L214 PolarHBondContact O-N 3.3Å; L214-I217 HydrophobicContact CD2-CD1 4.22Å; L214-I217 VanDerWaalsContact O-CG1 3.32Å; L214-I217 WeakPolarHBondContact O-CG1 3.44Å; L214-K218 WeakPolarHBondContact O-CB 3.41Å; L214-K218 WeakPolarHBondContact O-CG 3.48Å; L214-K218 PolarHBondContact O-N 3.34Å
215	V	81.5	Confident	80.3	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-74.9	-40.6	179.5	178.3	0	0	0	0	111.1	V211 R212 F213 K218 S219 Y225 F228 I229 L232 L317 I321	V211-V215 HydrophobicContact CG1-CG2 4.02Å; V211-V215 WeakPolarHBondContact O-CB 3.27Å; V211-V215 VanDerWaalsContact O-CG2 3.24Å; V211-V215 WeakPolarHBondContact O-CG2 3.3Å; V211-V215 PolarHBondContact O-N 3.41Å; R212-V215 PolarHBondContact O-N 2.7Å; F213-V215 VanDerWaalsContact C-N 3.3Å; F213-V215 PolarHBondContact O-N 3.49Å; V215-K218 PolarHBondContact O-N 3.5Å; V215-S219 WeakPolarHBondContact O-CB 3.18Å; V215-S219 PolarHBondContact O-N 2.72Å; V215-S219 PolarHBondContact O-OG 2.67Å; V215-Y225 HydrophobicContact CB-CD2 4.38Å; V215-Y225 HydrophobicContact CB-CE2 4.31Å; V215-Y225 HydrophobicContact CG1-CD2 3.88Å; V215-Y225 HydrophobicContact CG1-CE2 4.26Å; V215-F228 HydrophobicContact CG1-CD1 3.87Å; V215-F228 HydrophobicContact CG1-CE1 3.95Å; V215-I229 HydrophobicContact CB-CD1 3.77Å; V215-I229 HydrophobicContact CB-CG1 4.47Å; V215-I229 HydrophobicContact CG1-CD1 3.85Å; V215-I229 HydrophobicContact CG1-CG1 4.13Å; V215-I229 HydrophobicContact CG2-CD1 3.82Å; V215-L232 HydrophobicContact CG2-CD2 3.86Å; V215-L317 HydrophobicContact CG1-CD2 4.44Å; V215-I321 HydrophobicContact CG2-CD1 3.56Å
216	V	81.1	Confident	79.5	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.5	-45.2	-178.5	74.4	0	0	0	0	111.3	T160 W163 V164 L167 R212 F213 K218 S219 Y225	T160-V216 HydrophobicContact CG2-CG1 3.99Å; W163-V216 HydrophobicContact CB-CG1 3.83Å; W163-V216 HydrophobicContact CB-CG2 3.93Å; V164-V216 HydrophobicContact CG2-CB 4.46Å; V164-V216 HydrophobicContact CG2-CG2 3.69Å; L167-V216 HydrophobicContact CD1-CG2 3.89Å; R212-V216 WeakPolarHBondContact O-CB 3.29Å; R212-V216 PolarHBondContact O-N 2.88Å; F213-V216 WeakPolarHBondContact O-CG1 3.23Å; F213-V216 PolarHBondContact O-N 3.04Å; V216-K218 PolarHBondContact O-N 2.89Å; V216-S219 PolarHBondContact O-OG 2.89Å; V216-Y225 HydrophobicContact CB-CD2 3.87Å; V216-Y225 HydrophobicContact CB-CE2 3.55Å; V216-Y225 HydrophobicContact CG2-CD2 4.2Å; V216-Y225 HydrophobicContact CG2-CE2 4.18Å
217	I	78.4	Confident	78.5	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-22.3	-179.8	67.8	-176.5	0	0	0	112.3	W163 P180 L184 I188 F213 L214	W163-I217 HydrophobicContact CG-CG2 4.43Å; P180-I217 HydrophobicContact CG-CB 4.36Å; L184-I217 HydrophobicContact CD1-CG2 4.24Å; I188-I217 HydrophobicContact CD1-CD1 3.79Å; I188-I217 HydrophobicContact CG1-CD1 3.58Å; F213-I217 HydrophobicContact CD1-CD1 4.23Å; F213-I217 HydrophobicContact CD2-CG2 4.18Å; F213-I217 HydrophobicContact CE1-CD1 3.89Å; F213-I217 HydrophobicContact CE1-CG2 4.43Å; F213-I217 HydrophobicContact CE2-CG2 3.74Å; F213-I217 HydrophobicContact CZ-CD1 4.28Å; F213-I217 HydrophobicContact CZ-CG2 3.91Å; F213-I217 WeakPolarHBondContact O-CG1 3.29Å; F213-I217 WeakPolarHBondContact O-CG2 3.32Å; F213-I217 PolarHBondContact O-N 3.07Å; L214-I217 HydrophobicContact CD2-CD1 4.22Å; L214-I217 VanDerWaalsContact O-CG1 3.32Å; L214-I217 WeakPolarHBondContact O-CG1 3.44Å
218	K	73.1	Confident	77.5	Confident	34 Å²	34	30.8 Å²	30.8	15%	0.148	15%	0.147	C	C	.	.	H	α-helix	trans	-97	-36.3	-179.2	-67	-58	177.2	-174.3	0	114.6	M1 P3 L214 V215 V216 K220 L317	M1-K218 WeakPolarHBondContact O-CD 3.45Å; M1-K218 WeakPolarHBondContact O-CE 3.46Å; M1-K218 PolarHBondContact O-NZ 2.94Å; P3-K218 VanDerWaalsContact N-NZ 3.11Å; L214-K218 WeakPolarHBondContact O-CB 3.41Å; L214-K218 WeakPolarHBondContact O-CG 3.48Å; L214-K218 PolarHBondContact O-N 3.34Å; V215-K218 PolarHBondContact O-N 3.5Å; V216-K218 PolarHBondContact O-N 2.89Å; K218-K220 VanDerWaalsContact C-N 3.33Å; K218-K220 PolarHBondContact O-N 3.27Å; K218-L317 HydrophobicContact CB-CD1 3.62Å; K218-L317 HydrophobicContact CB-CD2 4.06Å; K218-L317 HydrophobicContact CG-CD1 4.11Å
219	S	68.6	Low	76.9	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-69.6	-28.7	-175.5	57.6	0	0	0	0	112.7	V215 V216 N221 I309	V215-S219 WeakPolarHBondContact O-CB 3.18Å; V215-S219 PolarHBondContact O-N 2.72Å; V215-S219 PolarHBondContact O-OG 2.67Å; V216-S219 PolarHBondContact O-OG 2.89Å; S219-N221 PolarHBondContact O-N 3.39Å; S219-I309 WeakPolarHBondContact O-CD1 2.98Å
220	K	64.9	Low	76.2	Confident	51 Å²	51	35.8 Å²	35.8	22%	0.222	17%	0.166	C	C	.	.			trans	50.8	15.4	-179.2	-54	-168.3	-177.2	-160.1	0	114.5	F178 K218 I309	F178-K220 PolarHBondContact O-NZ 3.47Å; K218-K220 VanDerWaalsContact C-N 3.33Å; K218-K220 PolarHBondContact O-N 3.27Å; K220-I309 HydrophobicContact CD-CG2 4.44Å
221	N	64.3	Low	75.3	Confident	25 Å²	25	41.1 Å²	41.1	13%	0.134	19%	0.186	C	C	.	.			trans	-151.7	115	-177.2	-179.1	-15.6	0	0	0	110.3	S219 Q223 Q224 Y225	S219-N221 PolarHBondContact O-N 3.39Å; N221-Q223 PolarHBondContact OD1-N 2.47Å; N221-Q223 VanDerWaalsContact OD1-N 3.08Å; N221-Q224 HydrophobicContact CB-CB 4.4Å; N221-Y225 WeakPolarHBondContact O-CB 3.44Å; N221-Y225 PolarHBondContact O-N 3.33Å
222	V	67.1	Low	74.9	Confident	15 Å²	15	41.5 Å²	41.5	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-67.1	-41.5	-176.1	-178.3	0	0	0	0	113.4	V164 L167 Q224 Y225 D226	V164-V222 HydrophobicContact CG1-CG1 4.03Å; V164-V222 VanDerWaalsContact O-CG2 3.28Å; V164-V222 WeakPolarHBondContact O-CG2 3.06Å; L167-V222 HydrophobicContact CB-CG2 3.24Å; V222-Q224 VanDerWaalsContact C-N 3.26Å; V222-Q224 PolarHBondContact O-N 3.32Å; V222-Y225 WeakPolarHBondContact O-CA 3.27Å; V222-Y225 VanDerWaalsContact O-CB 3.31Å; V222-Y225 WeakPolarHBondContact O-CB 3.46Å; V222-Y225 PolarHBondContact O-N 3.34Å; V222-D226 PolarHBondContact O-N 2.93Å
223	Q	66.4	Low	74.9	Confident	155 Å²	155	37 Å²	37	72%	0.724	17%	0.172	S	C	*	.	H	α-helix	trans	-63.4	-38	-175.9	-67.7	-179.1	-8.1	0	0	111.3	N221	N221-Q223 PolarHBondContact OD1-N 2.47Å; N221-Q223 VanDerWaalsContact OD1-N 3.08Å
224	Q	64.3	Low	74.7	Confident	16 Å²	16	41.4 Å²	41.4	8%	0.075	20%	0.196	C	C	.	.	H	α-helix	trans	-72.7	-39.7	173.1	-72.2	-178.9	-7.1	0	0	111.3	N221 V222 F228 L314	N221-Q224 HydrophobicContact CB-CB 4.4Å; V222-Q224 VanDerWaalsContact C-N 3.26Å; V222-Q224 PolarHBondContact O-N 3.32Å; Q224-F228 WeakPolarHBondContact O-CB 3.5Å; Q224-F228 PolarHBondContact O-N 3.24Å; Q224-L314 HydrophobicContact CB-CD1 4.25Å; Q224-L314 HydrophobicContact CG-CD1 4.26Å
225	Y	71.7	Confident	74.7	Confident	12 Å²	12	44.3 Å²	44.3	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-54.2	-53.3	177.3	169.4	-92.7	0	0	0	112.4	V164 R212 V215 V216 N221 V222 I227 F228 I229	V164-Y225 HydrophobicContact CG2-CD1 4.21Å; V164-Y225 HydrophobicContact CG2-CE1 3.69Å; R212-Y225 WeakPolarHBondContact CB-OH 3.49Å; R212-Y225 WeakPolarHBondContact O-CE2 3.48Å; V215-Y225 HydrophobicContact CB-CD2 4.38Å; V215-Y225 HydrophobicContact CB-CE2 4.31Å; V215-Y225 HydrophobicContact CG1-CD2 3.88Å; V215-Y225 HydrophobicContact CG1-CE2 4.26Å; V216-Y225 HydrophobicContact CB-CD2 3.87Å; V216-Y225 HydrophobicContact CB-CE2 3.55Å; V216-Y225 HydrophobicContact CG2-CD2 4.2Å; V216-Y225 HydrophobicContact CG2-CE2 4.18Å; N221-Y225 WeakPolarHBondContact O-CB 3.44Å; N221-Y225 PolarHBondContact O-N 3.33Å; V222-Y225 WeakPolarHBondContact O-CA 3.27Å; V222-Y225 VanDerWaalsContact O-CB 3.31Å; V222-Y225 WeakPolarHBondContact O-CB 3.46Å; V222-Y225 PolarHBondContact O-N 3.34Å; Y225-I227 PolarHBondContact O-N 3.04Å; Y225-F228 PolarHBondContact O-N 2.79Å; Y225-I229 HydrophobicContact CD2-CG1 3.77Å; Y225-I229 HydrophobicContact CE1-CG1 4.33Å; Y225-I229 HydrophobicContact CE2-CD1 4.1Å; Y225-I229 HydrophobicContact CE2-CG1 3.5Å; Y225-I229 VanDerWaalsContact CE2-CG1 3.5Å; Y225-I229 HydrophobicContact CG-CG1 4.29Å; Y225-I229 VanDerWaalsContact O-CB 3.24Å; Y225-I229 WeakPolarHBondContact O-CB 3.38Å; Y225-I229 WeakPolarHBondContact O-CG1 3.49Å; Y225-I229 PolarHBondContact O-N 3.27Å
226	D	73.6	Confident	75.1	Confident	90 Å²	90	44.3 Å²	44.3	48%	0.481	21%	0.209	S	C	.	.	H	α-helix	trans	-63.7	-46.3	-173.6	-72.6	-30.2	0	0	0	112.5	V222 K230	V222-D226 PolarHBondContact O-N 2.93Å; D226-K230 PolarHBondContact O-N 2.93Å
227	I	69	Low	75.6	Confident	75 Å²	75	46.3 Å²	46.3	39%	0.385	22%	0.217	S	C	.	.	H	α-helix	trans	-64.7	-46.6	179	-63.2	173.1	0	0	0	109.5	Y225 Y231 L301	Y225-I227 PolarHBondContact O-N 3.04Å; I227-Y231 HydrophobicContact CG2-CE2 4.24Å; I227-Y231 WeakPolarHBondContact O-CD2 3.06Å; I227-L301 HydrophobicContact CG2-CD1 4.16Å
228	F	72	Confident	76.2	Confident	5 Å²	5	50.4 Å²	50.4	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-69.6	-43.5	-174.8	176.7	-111.4	0	0	0	112.9	V215 Q224 Y225 K230 Y231 L232 L314 T318	V215-F228 HydrophobicContact CG1-CD1 3.87Å; V215-F228 HydrophobicContact CG1-CE1 3.95Å; Q224-F228 WeakPolarHBondContact O-CB 3.5Å; Q224-F228 PolarHBondContact O-N 3.24Å; Y225-F228 PolarHBondContact O-N 2.79Å; F228-K230 PolarHBondContact O-N 2.74Å; F228-Y231 PolarHBondContact O-N 3.06Å; F228-Y231 VanDerWaalsContact O-N 3.12Å; F228-L232 HydrophobicContact CD1-CB 4.4Å; F228-L232 HydrophobicContact CD1-CD2 4.12Å; F228-L232 HydrophobicContact CE1-CB 4.18Å; F228-L232 HydrophobicContact CE1-CD2 3.3Å; F228-L232 HydrophobicContact CE1-CG 4.2Å; F228-L232 HydrophobicContact CE2-CB 4.38Å; F228-L232 HydrophobicContact CZ-CB 4.15Å; F228-L232 HydrophobicContact CZ-CD1 4.08Å; F228-L232 HydrophobicContact CZ-CD2 3.56Å; F228-L232 HydrophobicContact CZ-CG 4.12Å; F228-L232 VanDerWaalsContact O-CB 3.29Å; F228-L232 WeakPolarHBondContact O-CB 3.42Å; F228-L232 PolarHBondContact O-N 2.82Å; F228-L314 HydrophobicContact CB-CD2 3.9Å; F228-L314 HydrophobicContact CD1-CD2 3.76Å; F228-L314 HydrophobicContact CD2-CB 4.25Å; F228-L314 HydrophobicContact CD2-CD2 3.66Å; F228-L314 HydrophobicContact CD2-CG 4.44Å; F228-L314 HydrophobicContact CE1-CD2 4.1Å; F228-L314 HydrophobicContact CE2-CB 4.15Å; F228-L314 HydrophobicContact CE2-CD2 4.03Å; F228-L314 HydrophobicContact CG-CD2 3.51Å; F228-L314 HydrophobicContact CZ-CD2 4.22Å; F228-T318 WeakPolarHBondContact CE2-OG1 3.45Å; F228-T318 WeakPolarHBondContact CZ-OG1 3.4Å
229	I	80.4	Confident	77.1	Confident	9 Å²	9	48.9 Å²	48.9	5%	0.046	23%	0.232	C	C	.	.	H	α-helix	trans	-58.1	-38	178.8	-83.2	-62.7	0	0	0	111.8	V211 R212 V215 Y225 Y231 L232 I233	V211-I229 HydrophobicContact CG1-CD1 4.48Å; R212-I229 HydrophobicContact CG-CD1 4.17Å; R212-I229 HydrophobicContact CG-CG2 4.19Å; V215-I229 HydrophobicContact CB-CD1 3.77Å; V215-I229 HydrophobicContact CB-CG1 4.47Å; V215-I229 HydrophobicContact CG1-CD1 3.85Å; V215-I229 HydrophobicContact CG1-CG1 4.13Å; V215-I229 HydrophobicContact CG2-CD1 3.82Å; Y225-I229 HydrophobicContact CD2-CG1 3.77Å; Y225-I229 HydrophobicContact CE1-CG1 4.33Å; Y225-I229 HydrophobicContact CE2-CD1 4.1Å; Y225-I229 HydrophobicContact CE2-CG1 3.5Å; Y225-I229 VanDerWaalsContact CE2-CG1 3.5Å; Y225-I229 HydrophobicContact CG-CG1 4.29Å; Y225-I229 VanDerWaalsContact O-CB 3.24Å; Y225-I229 WeakPolarHBondContact O-CB 3.38Å; Y225-I229 WeakPolarHBondContact O-CG1 3.49Å; Y225-I229 PolarHBondContact O-N 3.27Å; I229-Y231 PolarHBondContact O-N 3.34Å; I229-L232 PolarHBondContact O-N 3.43Å; I229-I233 HydrophobicContact CD1-CD1 4.48Å; I229-I233 HydrophobicContact CD1-CG1 4.37Å; I229-I233 HydrophobicContact CG2-CD1 3.66Å; I229-I233 HydrophobicContact CG2-CG1 4.23Å; I229-I233 WeakPolarHBondContact O-CG1 3.1Å; I229-I233 PolarHBondContact O-N 3.47Å
230	K	75.9	Confident	78.3	Confident	150 Å²	150	48.8 Å²	48.8	65%	0.652	23%	0.232	S	C	*	.	H	α-helix	trans	-58.7	-34.6	179	-174.6	179.3	177.8	-178.7	0	112.9	D226 F228	D226-K230 PolarHBondContact O-N 2.93Å; F228-K230 PolarHBondContact O-N 2.74Å
231	Y	73.9	Confident	79.6	Confident	111 Å²	111	47.5 Å²	47.5	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-97.7	-29.5	-179.2	-62.4	-74.1	0	0	0	112.8	I227 F228 I229 T298 L301	I227-Y231 HydrophobicContact CG2-CE2 4.24Å; I227-Y231 WeakPolarHBondContact O-CD2 3.06Å; F228-Y231 PolarHBondContact O-N 3.06Å; F228-Y231 VanDerWaalsContact O-N 3.12Å; I229-Y231 PolarHBondContact O-N 3.34Å; Y231-T298 HydrophobicContact CD2-CG2 4Å; Y231-T298 HydrophobicContact CG-CG2 4.27Å; Y231-L301 HydrophobicContact CE2-CD1 4.36Å
232	L	82.6	Confident	80.9	Confident	8 Å²	8	47.7 Å²	47.7	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-72.5	-43.2	-175.6	176.7	66.6	0	0	0	112.4	V211 V215 F228 I229 D234 E235 L236 T318	V211-L232 HydrophobicContact CG1-CD2 4.42Å; V215-L232 HydrophobicContact CG2-CD2 3.86Å; F228-L232 HydrophobicContact CD1-CB 4.4Å; F228-L232 HydrophobicContact CD1-CD2 4.12Å; F228-L232 HydrophobicContact CE1-CB 4.18Å; F228-L232 HydrophobicContact CE1-CD2 3.3Å; F228-L232 HydrophobicContact CE1-CG 4.2Å; F228-L232 HydrophobicContact CE2-CB 4.38Å; F228-L232 HydrophobicContact CZ-CB 4.15Å; F228-L232 HydrophobicContact CZ-CD1 4.08Å; F228-L232 HydrophobicContact CZ-CD2 3.56Å; F228-L232 HydrophobicContact CZ-CG 4.12Å; F228-L232 VanDerWaalsContact O-CB 3.29Å; F228-L232 WeakPolarHBondContact O-CB 3.42Å; F228-L232 PolarHBondContact O-N 2.82Å; I229-L232 PolarHBondContact O-N 3.43Å; L232-D234 PolarHBondContact O-N 3.19Å; L232-E235 PolarHBondContact O-N 3.36Å; L232-L236 HydrophobicContact CD1-CB 4.14Å; L232-L236 HydrophobicContact CD2-CD2 4.49Å; L232-L236 HydrophobicContact CG-CB 4.32Å; L232-L236 HydrophobicContact CG-CD2 4.4Å; L232-L236 WeakPolarHBondContact O-CB 3.11Å; L232-L236 PolarHBondContact O-N 3.33Å; L232-T318 HydrophobicContact CD1-CG2 3.53Å
233	I	88.5	Confident	82	Confident	11 Å²	11	47 Å²	47	6%	0.056	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-52.8	-167.5	-78	-178.7	0	0	0	112	F207 N208 V211 R212 I229 E235 L236 W237	F207-I233 HydrophobicContact CE1-CG2 4.34Å; N208-I233 WeakPolarHBondContact OD1-CG2 3.34Å; V211-I233 HydrophobicContact CG1-CG1 4.33Å; R212-I233 HydrophobicContact CG-CD1 3.96Å; I229-I233 HydrophobicContact CD1-CD1 4.48Å; I229-I233 HydrophobicContact CD1-CG1 4.37Å; I229-I233 HydrophobicContact CG2-CD1 3.66Å; I229-I233 HydrophobicContact CG2-CG1 4.23Å; I229-I233 WeakPolarHBondContact O-CG1 3.1Å; I229-I233 PolarHBondContact O-N 3.47Å; I233-E235 VanDerWaalsContact C-N 3.33Å; I233-E235 PolarHBondContact O-N 3.43Å; I233-L236 PolarHBondContact O-N 3.33Å; I233-W237 VanDerWaalsContact O-CB 3.26Å; I233-W237 WeakPolarHBondContact O-CB 3.39Å; I233-W237 PolarHBondContact O-N 2.79Å
234	D	86.5	Confident	83.3	Confident	94 Å²	94	41.3 Å²	41.3	50%	0.503	20%	0.202	S	C	.	.	H	α-helix	trans	-65.4	-40.3	-173.9	-66.8	-19.3	0	0	0	111.3	L232 W237 N238	L232-D234 PolarHBondContact O-N 3.19Å; D234-W237 WeakPolarHBondContact O-CB 3.37Å; D234-W237 PolarHBondContact O-N 3.38Å; D234-N238 WeakPolarHBondContact O-CB 3.42Å; D234-N238 PolarHBondContact O-N 3.14Å; D234-N238 PolarHBondContact O-ND2 3.05Å
235	E	85.2	Confident	84.6	Confident	66 Å²	66	45 Å²	45	31%	0.308	22%	0.221	S	C	.	.	H	α-helix	trans	-71.5	-43.9	-179.1	-65.5	-70.8	164.8	0	0	111.3	L232 I233 W237 N238 S239 L291 L294	L232-E235 PolarHBondContact O-N 3.36Å; I233-E235 VanDerWaalsContact C-N 3.33Å; I233-E235 PolarHBondContact O-N 3.43Å; E235-W237 VanDerWaalsContact C-N 3.31Å; E235-W237 PolarHBondContact O-N 3.33Å; E235-N238 PolarHBondContact O-N 3.23Å; E235-S239 WeakPolarHBondContact O-CB 3.49Å; E235-S239 PolarHBondContact O-N 3.32Å; E235-S239 PolarHBondContact O-OG 3.29Å; E235-L291 HydrophobicContact CB-CD2 3.94Å; E235-L294 HydrophobicContact CB-CD1 3.49Å; E235-L294 VanDerWaalsContact CB-CD1 3.49Å; E235-L294 HydrophobicContact CG-CD1 3.31Å; E235-L294 HydrophobicContact CG-CD2 3.98Å; E235-L294 HydrophobicContact CG-CG 4.26Å
236	L	89	Confident	85.5	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-39.4	175.4	-172.7	66	0	0	0	111.1	F207 V211 L232 I233 L240 L291 I321 F322 L325	F207-L236 HydrophobicContact CZ-CB 4.17Å; F207-L236 HydrophobicContact CZ-CD2 4.11Å; F207-L236 HydrophobicContact CZ-CG 3.95Å; V211-L236 HydrophobicContact CG1-CD2 3.95Å; V211-L236 HydrophobicContact CG2-CD2 3.93Å; L232-L236 HydrophobicContact CD1-CB 4.14Å; L232-L236 HydrophobicContact CD2-CD2 4.49Å; L232-L236 HydrophobicContact CG-CB 4.32Å; L232-L236 HydrophobicContact CG-CD2 4.4Å; L232-L236 WeakPolarHBondContact O-CB 3.11Å; L232-L236 PolarHBondContact O-N 3.33Å; I233-L236 PolarHBondContact O-N 3.33Å; L236-L240 HydrophobicContact CD1-CD1 3.81Å; L236-L240 HydrophobicContact CD1-CG 4.16Å; L236-L240 HydrophobicContact CD2-CD1 4.46Å; L236-L240 HydrophobicContact CG-CD1 3.73Å; L236-L240 HydrophobicContact CG-CG 4.41Å; L236-L240 VanDerWaalsContact O-CB 3.28Å; L236-L240 WeakPolarHBondContact O-CB 3.19Å; L236-L240 WeakPolarHBondContact O-CD1 3.28Å; L236-L240 VanDerWaalsContact O-CG 3.24Å; L236-L240 WeakPolarHBondContact O-CG 3.18Å; L236-L240 PolarHBondContact O-N 2.78Å; L236-L291 HydrophobicContact CD1-CD1 3.98Å; L236-I321 HydrophobicContact CD2-CG2 3.77Å; L236-F322 HydrophobicContact CD1-CB 3.92Å; L236-F322 HydrophobicContact CD1-CD2 4.16Å; L236-L325 HydrophobicContact CD2-CD1 4.06Å
237	W	92.6	Very high	86.3	Confident	42 Å²	42	44.7 Å²	44.7	16%	0.159	21%	0.213	C	C	.	.	H	α-helix	trans	-59.4	-53.1	174	170.6	-93.9	0	0	0	111.1	G198 I199 I204 F207 I233 D234 E235 S239 L240 A241	G198-W237 VanDerWaalsContact O-CH2 3.28Å; G198-W237 WeakPolarHBondContact O-CH2 3.13Å; G198-W237 WeakPolarHBondContact O-CZ3 3.21Å; I199-W237 HydrophobicContact CD1-CD2 4.18Å; I199-W237 HydrophobicContact CD1-CE3 3.61Å; I199-W237 HydrophobicContact CD1-CZ3 3.86Å; I204-W237 HydrophobicContact CB-CH2 4.17Å; I204-W237 HydrophobicContact CB-CZ2 4.42Å; I204-W237 HydrophobicContact CB-CZ3 4.34Å; I204-W237 HydrophobicContact CD1-CD2 4.47Å; I204-W237 HydrophobicContact CG1-CD2 4.36Å; I204-W237 HydrophobicContact CG1-CE3 4.3Å; I204-W237 HydrophobicContact CG1-CZ3 4.42Å; F207-W237 HydrophobicContact CB-CE3 3.69Å; F207-W237 HydrophobicContact CB-CZ3 3.55Å; F207-W237 HydrophobicContact CD1-CB 4.27Å; F207-W237 AromaticContact CD1-CE3 3.64Å; F207-W237 HydrophobicContact CD1-CE3 3.64Å; F207-W237 HydrophobicContact CD1-CZ3 4.39Å; F207-W237 AromaticContact CD2-CE3 3.67Å; F207-W237 HydrophobicContact CD2-CE3 3.67Å; F207-W237 HydrophobicContact CD2-CZ3 4.07Å; F207-W237 HydrophobicContact CE1-CB 3.71Å; F207-W237 HydrophobicContact CE1-CE3 4.13Å; F207-W237 HydrophobicContact CE2-CE3 4.16Å; F207-W237 AromaticContact CG-CE3 3.39Å; F207-W237 HydrophobicContact CG-CE3 3.39Å; F207-W237 AromaticContact CG-CZ3 3.78Å; F207-W237 HydrophobicContact CG-CZ3 3.78Å; F207-W237 HydrophobicContact CZ-CB 3.94Å; F207-W237 HydrophobicContact CZ-CE3 4.37Å; I233-W237 VanDerWaalsContact O-CB 3.26Å; I233-W237 WeakPolarHBondContact O-CB 3.39Å; I233-W237 PolarHBondContact O-N 2.79Å; D234-W237 WeakPolarHBondContact O-CB 3.37Å; D234-W237 PolarHBondContact O-N 3.38Å; E235-W237 VanDerWaalsContact C-N 3.31Å; E235-W237 PolarHBondContact O-N 3.33Å; W237-S239 PolarHBondContact O-N 3.32Å; W237-L240 PolarHBondContact O-N 3.29Å; W237-A241 WeakPolarHBondContact O-CB 3.22Å; W237-A241 PolarHBondContact O-N 3.13Å
238	N	91.3	Very high	87.2	Confident	88 Å²	88	43.3 Å²	43.3	47%	0.471	21%	0.209	S	C	.	.	H	α-helix	trans	-61.6	-46.8	-177.8	-70.7	-30.3	0	0	0	111.7	D234 E235 A241 S242	D234-N238 WeakPolarHBondContact O-CB 3.42Å; D234-N238 PolarHBondContact O-N 3.14Å; D234-N238 PolarHBondContact O-ND2 3.05Å; E235-N238 PolarHBondContact O-N 3.23Å; N238-A241 PolarHBondContact O-N 3.27Å; N238-S242 VanDerWaalsContact O-CB 3.28Å; N238-S242 WeakPolarHBondContact O-CB 3.16Å; N238-S242 PolarHBondContact O-N 2.63Å
239	S	90.5	Very high	88	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-43.9	179.8	-73	0	0	0	0	112.7	E235 W237 S242 I243 E287	E235-S239 WeakPolarHBondContact O-CB 3.49Å; E235-S239 PolarHBondContact O-N 3.32Å; E235-S239 PolarHBondContact O-OG 3.29Å; W237-S239 PolarHBondContact O-N 3.32Å; S239-S242 WeakPolarHBondContact O-CB 3.29Å; S239-S242 PolarHBondContact O-N 3.43Å; S239-I243 WeakPolarHBondContact O-CG1 3.26Å; S239-I243 PolarHBondContact O-N 3.37Å; S239-E287 WeakPolarHBondContact CA-OE2 3.17Å; S239-E287 VanDerWaalsContact CB-OE2 3.27Å; S239-E287 WeakPolarHBondContact CB-OE2 3.45Å; S239-E287 PolarHBondContact OG-OE2 3.46Å
240	L	93.7	Very high	88.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-71	-37.1	178.3	-69.9	171.2	0	0	0	112.4	I199 F207 L236 W237 I243 Y244 F322 L325 A326	I199-L240 HydrophobicContact CD1-CB 3.9Å; I199-L240 HydrophobicContact CG1-CB 4.28Å; F207-L240 HydrophobicContact CE2-CD1 3.89Å; F207-L240 HydrophobicContact CZ-CD1 4.29Å; L236-L240 HydrophobicContact CD1-CD1 3.81Å; L236-L240 HydrophobicContact CD1-CG 4.16Å; L236-L240 HydrophobicContact CD2-CD1 4.46Å; L236-L240 HydrophobicContact CG-CD1 3.73Å; L236-L240 HydrophobicContact CG-CG 4.41Å; L236-L240 VanDerWaalsContact O-CB 3.28Å; L236-L240 WeakPolarHBondContact O-CB 3.19Å; L236-L240 WeakPolarHBondContact O-CD1 3.28Å; L236-L240 VanDerWaalsContact O-CG 3.24Å; L236-L240 WeakPolarHBondContact O-CG 3.18Å; L236-L240 PolarHBondContact O-N 2.78Å; W237-L240 PolarHBondContact O-N 3.29Å; L240-I243 PolarHBondContact O-N 3.26Å; L240-Y244 VanDerWaalsContact O-CB 3.27Å; L240-Y244 WeakPolarHBondContact O-CB 3.28Å; L240-Y244 PolarHBondContact O-N 3Å; L240-F322 HydrophobicContact CD2-CD2 3.95Å; L240-F322 HydrophobicContact CD2-CE2 4.23Å; L240-F322 HydrophobicContact CG-CD2 4.35Å; L240-L325 HydrophobicContact CD1-CB 3.56Å; L240-L325 HydrophobicContact CD1-CD1 3.56Å; L240-L325 HydrophobicContact CD1-CG 4.19Å; L240-L325 HydrophobicContact CD2-CB 3.66Å; L240-L325 HydrophobicContact CG-CB 4.28Å; L240-A326 HydrophobicContact CD2-CB 4.19Å
241	A	93.3	Very high	88.6	Confident	24 Å²	24	42.6 Å²	42.6	20%	0.198	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-42	174.4	0	0	0	0	0	111.5	I199 W237 N238 Y244 L245	I199-A241 HydrophobicContact CD1-CB 4.39Å; W237-A241 WeakPolarHBondContact O-CB 3.22Å; W237-A241 PolarHBondContact O-N 3.13Å; N238-A241 PolarHBondContact O-N 3.27Å; A241-Y244 PolarHBondContact O-N 3.43Å; A241-L245 WeakPolarHBondContact O-CB 3.39Å; A241-L245 VanDerWaalsContact O-CG 3.26Å; A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.1Å
242	S	91.4	Very high	88.7	Confident	28 Å²	28	41.4 Å²	41.4	20%	0.196	22%	0.223	C	C	.	.	H	α-helix	trans	-57	-49.6	173.4	177.5	0	0	0	0	111.2	N238 S239 L245 R246 E287	N238-S242 VanDerWaalsContact O-CB 3.28Å; N238-S242 WeakPolarHBondContact O-CB 3.16Å; N238-S242 PolarHBondContact O-N 2.63Å; S239-S242 WeakPolarHBondContact O-CB 3.29Å; S239-S242 PolarHBondContact O-N 3.43Å; S242-L245 PolarHBondContact O-N 3.31Å; S242-R246 WeakPolarHBondContact O-CG 3.42Å; S242-R246 PolarHBondContact O-N 3.05Å; S242-R246 VanDerWaalsContact O-N 3.16Å; S242-E287 WeakPolarHBondContact CB-OE1 3.08Å; S242-E287 PolarHBondContact OG-OE1 3.43Å
243	I	90.6	Very high	87.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-47.2	178.2	-74.5	174.3	0	0	0	112	S239 L240 L245 R246 A247 Y284 E287 F322 A326 F330	S239-I243 WeakPolarHBondContact O-CG1 3.26Å; S239-I243 PolarHBondContact O-N 3.37Å; L240-I243 PolarHBondContact O-N 3.26Å; I243-L245 VanDerWaalsContact C-N 3.32Å; I243-L245 PolarHBondContact O-N 2.92Å; I243-R246 PolarHBondContact O-N 2.62Å; I243-A247 WeakPolarHBondContact O-CB 3.42Å; I243-A247 PolarHBondContact O-N 2.9Å; I243-Y284 HydrophobicContact CD1-CD2 4.5Å; I243-E287 HydrophobicContact CD1-CB 4.05Å; I243-E287 HydrophobicContact CD1-CG 4.23Å; I243-E287 HydrophobicContact CG1-CB 4.47Å; I243-E287 HydrophobicContact CG1-CG 4.09Å; I243-F322 HydrophobicContact CD1-CE1 4.38Å; I243-F322 HydrophobicContact CD1-CE2 3.47Å; I243-F322 VanDerWaalsContact CD1-CE2 3.47Å; I243-F322 HydrophobicContact CD1-CZ 3.28Å; I243-A326 HydrophobicContact CD1-CB 4.18Å; I243-F330 HydrophobicContact CG2-CD1 4.06Å; I243-F330 HydrophobicContact CG2-CE1 3.45Å; I243-F330 VanDerWaalsContact CG2-CE1 3.45Å; I243-F330 HydrophobicContact CG2-CZ 4.17Å
244	Y	93.2	Very high	86	Confident	36 Å²	36	51.1 Å²	51.1	14%	0.141	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-42.7	-179.1	176.6	-104.7	0	0	0	111.9	I199 V200 L240 A241 A247 T248 C329 Q332 S333	I199-Y244 HydrophobicContact CG2-CD1 3.88Å; I199-Y244 HydrophobicContact CG2-CD2 4.46Å; I199-Y244 HydrophobicContact CG2-CG 3.7Å; V200-Y244 HydrophobicContact CB-CE1 4.46Å; V200-Y244 HydrophobicContact CG2-CE1 4.22Å; V200-Y244 HydrophobicContact CG2-CE2 3.78Å; L240-Y244 VanDerWaalsContact O-CB 3.27Å; L240-Y244 WeakPolarHBondContact O-CB 3.28Å; L240-Y244 PolarHBondContact O-N 3Å; A241-Y244 PolarHBondContact O-N 3.43Å; Y244-A247 PolarHBondContact O-N 3.26Å; Y244-T248 WeakPolarHBondContact O-CB 3.39Å; Y244-T248 PolarHBondContact O-N 3.04Å; Y244-T248 PolarHBondContact O-OG1 3.33Å; Y244-C329 HydrophobicContact CD2-CB 4.21Å; Y244-Q332 HydrophobicContact CE2-CG 4.27Å; Y244-S333 WeakPolarHBondContact CD2-OG 3.19Å; Y244-S333 VanDerWaalsContact CE2-OG 3.23Å; Y244-S333 WeakPolarHBondContact CE2-OG 3.33Å
245	L	91.4	Very high	84.4	Confident	94 Å²	94	51.1 Å²	51.1	49%	0.492	28%	0.276	S	S	.	.	H	α-helix	trans	-60.5	-49.3	175.8	-73.5	169	0	0	0	111.5	A241 S242 I243 A247 T248 D249	A241-L245 WeakPolarHBondContact O-CB 3.39Å; A241-L245 VanDerWaalsContact O-CG 3.26Å; A241-L245 WeakPolarHBondContact O-CG 3.47Å; A241-L245 PolarHBondContact O-N 3.1Å; S242-L245 PolarHBondContact O-N 3.31Å; I243-L245 VanDerWaalsContact C-N 3.32Å; I243-L245 PolarHBondContact O-N 2.92Å; L245-A247 VanDerWaalsContact C-N 3.35Å; L245-A247 PolarHBondContact O-N 2.86Å; L245-T248 PolarHBondContact O-N 3.1Å; L245-D249 PolarHBondContact O-N 3.09Å
246	R	90.5	Very high	82.4	Confident	96 Å²	96	56.1 Å²	56.1	36%	0.362	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-38.3	179	-66.2	-173.7	-161.1	-163	12.1	112.8	S242 I243 T248 D249 L250 L280 S283	S242-R246 WeakPolarHBondContact O-CG 3.42Å; S242-R246 PolarHBondContact O-N 3.05Å; S242-R246 VanDerWaalsContact O-N 3.16Å; I243-R246 PolarHBondContact O-N 2.62Å; R246-T248 VanDerWaalsContact C-N 3.33Å; R246-D249 PolarHBondContact O-N 3.21Å; R246-L250 WeakPolarHBondContact O-CB 3.28Å; R246-L250 PolarHBondContact O-N 3.32Å; R246-L280 HydrophobicContact CB-CD1 3.91Å; R246-S283 VanDerWaalsContact CD-OG 3.24Å; R246-S283 WeakPolarHBondContact CD-OG 3.38Å; R246-S283 PolarHBondContact NE-OG 3.43Å; R246-S283 VanDerWaalsContact NE-OG 3.14Å; R246-S283 PolarHBondContact NH1-OG 3.09Å; R246-S283 VanDerWaalsContact NH1-OG 3.11Å
247	A	90.4	Very high	79.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-38.3	176.3	0	0	0	0	0	111.7	I243 Y244 L245 L250 S251 L280 F330 S333 I335	I243-A247 WeakPolarHBondContact O-CB 3.42Å; I243-A247 PolarHBondContact O-N 2.9Å; Y244-A247 PolarHBondContact O-N 3.26Å; L245-A247 VanDerWaalsContact C-N 3.35Å; L245-A247 PolarHBondContact O-N 2.86Å; A247-L250 PolarHBondContact O-N 3Å; A247-S251 PolarHBondContact O-N 2.9Å; A247-S251 PolarHBondContact O-OG 2.86Å; A247-L280 HydrophobicContact CB-CD1 4.18Å; A247-L280 HydrophobicContact CB-CD2 4.28Å; A247-F330 HydrophobicContact CB-CD1 4.02Å; A247-S333 WeakPolarHBondContact CB-OG 3.42Å; A247-I335 HydrophobicContact CB-CG1 4.07Å
248	T	89	Confident	77	Confident	46 Å²	46	63 Å²	63	28%	0.282	37%	0.369	S	S	.	.	H	α-helix	trans	-68.2	-41.3	175	-56.8	0	0	0	0	111.5	Y244 L245 R246 L250 S251 S252 S333	Y244-T248 WeakPolarHBondContact O-CB 3.39Å; Y244-T248 PolarHBondContact O-N 3.04Å; Y244-T248 PolarHBondContact O-OG1 3.33Å; L245-T248 PolarHBondContact O-N 3.1Å; R246-T248 VanDerWaalsContact C-N 3.33Å; T248-L250 VanDerWaalsContact C-N 3.27Å; T248-L250 PolarHBondContact O-N 2.88Å; T248-S251 PolarHBondContact O-N 3.42Å; T248-S251 PolarHBondContact O-OG 3.32Å; T248-S251 VanDerWaalsContact O-OG 3.1Å; T248-S252 WeakPolarHBondContact O-CB 3.34Å; T248-S252 PolarHBondContact O-N 3.45Å; T248-S252 PolarHBondContact O-OG 3.2Å; T248-S333 PolarHBondContact OG1-OG 3.41Å
249	D	87.4	Confident	74.1	Confident	97 Å²	97	63.3 Å²	63.3	52%	0.519	38%	0.378	S	S	.	.	H	α-helix	trans	-62.2	-37.2	174.9	-71.6	-19.1	0	0	0	111.5	L245 R246 S252 K253	L245-D249 PolarHBondContact O-N 3.09Å; R246-D249 PolarHBondContact O-N 3.21Å; D249-S252 PolarHBondContact O-OG 3.38Å; D249-K253 WeakPolarHBondContact O-CG 3.33Å
250	L	85.5	Confident	71.4	Confident	9 Å²	9	72.9 Å²	72.9	5%	0.047	42%	0.423	C	S	.	.	H	α-helix	trans	-66.9	-49.2	175.2	178.7	63.4	0	0	0	111.8	R246 A247 T248 S252 K253 T276 L280 I335	R246-L250 WeakPolarHBondContact O-CB 3.28Å; R246-L250 PolarHBondContact O-N 3.32Å; A247-L250 PolarHBondContact O-N 3Å; T248-L250 VanDerWaalsContact C-N 3.27Å; T248-L250 PolarHBondContact O-N 2.88Å; L250-S252 VanDerWaalsContact C-N 3.29Å; L250-S252 PolarHBondContact O-N 3.17Å; L250-K253 WeakPolarHBondContact O-CB 3.45Å; L250-K253 PolarHBondContact O-N 3.47Å; L250-T276 WeakPolarHBondContact CD1-OG1 3.28Å; L250-L280 HydrophobicContact CD2-CB 4.24Å; L250-L280 HydrophobicContact CD2-CD2 3.61Å; L250-I335 HydrophobicContact CB-CD1 4.14Å; L250-I335 HydrophobicContact CD2-CD1 3.76Å; L250-I335 HydrophobicContact CG-CD1 3.86Å
251	S	84.5	Confident	68.5	Low	42 Å²	42	79.5 Å²	79.5	29%	0.294	46%	0.458	S	S	.	.	H	α-helix	trans	-68.6	-27.2	-176.8	68	0	0	0	0	113.6	A247 T248 K253 S333	A247-S251 PolarHBondContact O-N 2.9Å; A247-S251 PolarHBondContact O-OG 2.86Å; T248-S251 PolarHBondContact O-N 3.42Å; T248-S251 PolarHBondContact O-OG 3.32Å; T248-S251 VanDerWaalsContact O-OG 3.1Å; S251-K253 PolarHBondContact O-N 2.82Å; S251-S333 WeakPolarHBondContact CB-O 3.36Å; S251-S333 PolarHBondContact OG-O 3.05Å
252	S	75.7	Confident	65.5	Low	86 Å²	86	83.2 Å²	83.2	60%	0.601	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-16.6	176.1	72.1	0	0	0	0	113.8	T248 D249 L250	T248-S252 WeakPolarHBondContact O-CB 3.34Å; T248-S252 PolarHBondContact O-N 3.45Å; T248-S252 PolarHBondContact O-OG 3.2Å; D249-S252 PolarHBondContact O-OG 3.38Å; L250-S252 VanDerWaalsContact C-N 3.29Å; L250-S252 PolarHBondContact O-N 3.17Å
253	K	64.1	Low	62.6	Low	108 Å²	108	87.2 Å²	87.2	47%	0.47	51%	0.51	S	S	.	.	S	Bend	trans	-77.6	131.7	176.7	-70	171.3	-175	174.1	0	108.9	D249 L250 S251 L255 T276	D249-K253 WeakPolarHBondContact O-CG 3.33Å; L250-K253 WeakPolarHBondContact O-CB 3.45Å; L250-K253 PolarHBondContact O-N 3.47Å; S251-K253 PolarHBondContact O-N 2.82Å; K253-L255 PolarHBondContact O-N 3.08Å; K253-T276 HydrophobicContact CD-CG2 4.36Å
254	P	49.5	Very low	59.8	Low	116 Å²	116	94.2 Å²	94.2	75%	0.753	55%	0.548	S	S	*	.			trans	-58.9	119.3	175.2	22.7	-30	0	0	0	108.3	L256	P254-L256 PolarHBondContact O-N 3.23Å
255	L	53.4	Low	56.8	Low	94 Å²	94	98.1 Å²	98.1	49%	0.492	58%	0.579	S	S	.	*			trans	-52.5	111.6	159.5	-85.9	113.6	0	0	0	104.8	K253 S257 N339	K253-L255 PolarHBondContact O-N 3.08Å; L255-S257 PolarHBondContact O-N 2.57Å; L255-N339 HydrophobicContact CD1-CB 4.25Å
256	L	42.6	Very low	54	Low	171 Å²	171	100 Å²	100	90%	0.895	59%	0.594	S	S	*	*			trans	-46.2	110.2	177.4	-77.1	160.5	0	0	0	106.4	P254 G258	P254-L256 PolarHBondContact O-N 3.23Å; L256-G258 PolarHBondContact O-N 3.05Å
257	S	33.3	Very low	51.2	Low	119 Å²	119	100.6 Å²	100.6	83%	0.832	61%	0.605	S	S	*	*			trans	-60.3	91.8	-178.8	51.3	0	0	0	0	107.2	L255 S259	L255-S257 PolarHBondContact O-N 2.57Å; S257-S259 PolarHBondContact O-N 2.9Å; S257-S259 VanDerWaalsContact O-N 3.13Å
258	G	36.4	Very low	48.8	Very low	67 Å²	67	106.5 Å²	106.5	69%	0.691	64%	0.635	S	S	*	*			trans	-60.3	112.4	163.5	0	0	0	0	0	106.1	L256 E260	L256-G258 PolarHBondContact O-N 3.05Å; G258-E260 PolarHBondContact O-N 3.46Å
259	S	30.7	Very low	46.5	Very low	95 Å²	95	109.1 Å²	109.1	66%	0.664	66%	0.655	S	S	*	*			trans	-29.6	128.9	172.1	50.3	0	0	0	0	113.3	S257 D261	S257-S259 PolarHBondContact O-N 2.9Å; S257-S259 VanDerWaalsContact O-N 3.13Å; S259-D261 PolarHBondContact O-N 3.16Å
260	E	31.8	Very low	44.4	Very low	202 Å²	202	108.5 Å²	108.5	94%	0.944	66%	0.658	S	S	*	*	S	Bend	trans	-63.1	13.3	177.3	-69.7	-174.8	143.3	0	0	115.3	G258	G258-E260 PolarHBondContact O-N 3.46Å
261	D	33	Very low	42.4	Very low	140 Å²	140	112.5 Å²	112.5	75%	0.749	67%	0.673	S	S	*	*			trans	-102	90.5	179.7	-73.1	-33.1	0	0	0	110.7	S259	S259-D261 PolarHBondContact O-N 3.16Å
262	S	30.6	Very low	40.6	Very low	102 Å²	102	117.2 Å²	117.2	71%	0.713	69%	0.694	S	S	*	*				157.1	116.8	127.8	53.5	0	0	0	0	111.5	N264	S262-N264 PolarHBondContact O-N 3.45Å
263	S	30.5	Very low	39.3	Very low	111 Å²	111	119.3 Å²	119.3	78%	0.776	69%	0.694	S	S	*	*			trans	-46.3	106.5	152.6	52.8	0	0	0	0	110.2
264	N	32.6	Very low	39	Very low	148 Å²	148	115.9 Å²	115.9	79%	0.791	68%	0.684	S	S	*	*	S	Bend	trans	176.4	127.3	148.6	-90.6	-27.5	0	0	0	108.6	S262 V266	S262-N264 PolarHBondContact O-N 3.45Å; N264-V266 PolarHBondContact O-N 2.77Å
265	C	29.6	Very low	39.7	Very low	117 Å²	117	114.6 Å²	114.6	79%	0.791	68%	0.677	S	S	*	*			trans	21.5	99.3	163.4	-68.1	0	0	0	0	115.1	N267	C265-N267 PolarHBondContact O-N 3.28Å
266	V	33.5	Very low	40.8	Very low	133 Å²	133	111.7 Å²	111.7	81%	0.806	66%	0.664	S	S	*	*			trans	-50.9	96.4	165.8	178	0	0	0	0	107.6	N264 I268	N264-V266 PolarHBondContact O-N 2.77Å; V266-I268 PolarHBondContact O-N 3.28Å; V266-I268 VanDerWaalsContact O-N 3.08Å
267	N	31.6	Very low	42.8	Very low	110 Å²	110	103.8 Å²	103.8	59%	0.588	62%	0.622	S	S	*	*			trans	-75.6	102.4	-179.4	-135.7	-5.8	0	0	0	103.9	C265 S269 S270	C265-N267 PolarHBondContact O-N 3.28Å; N267-S269 PolarHBondContact O-N 3.09Å; N267-S270 PolarHBondContact O-N 2.89Å; N267-S270 PolarHBondContact O-OG 3.05Å
268	I	40.4	Very low	45.3	Very low	123 Å²	123	101 Å²	101	63%	0.631	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-52.9	-23.6	-177.2	-63.7	170.4	0	0	0	111	V266 S270 Y271	V266-I268 PolarHBondContact O-N 3.28Å; V266-I268 VanDerWaalsContact O-N 3.08Å; I268-S270 VanDerWaalsContact C-N 3.31Å; I268-S270 PolarHBondContact O-N 2.53Å; I268-Y271 PolarHBondContact O-N 3.36Å
269	S	40.6	Very low	47.7	Very low	101 Å²	101	102.2 Å²	102.2	71%	0.706	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-71.1	-14.4	175.9	64.4	0	0	0	0	115.7	N267	N267-S269 PolarHBondContact O-N 3.09Å
270	S	41.9	Very low	50.4	Low	84 Å²	84	97.9 Å²	97.9	59%	0.587	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-98.9	5.2	177.3	71.6	0	0	0	0	113.8	N267 I268 I272	N267-S270 PolarHBondContact O-N 2.89Å; N267-S270 PolarHBondContact O-OG 3.05Å; I268-S270 VanDerWaalsContact C-N 3.31Å; I268-S270 PolarHBondContact O-N 2.53Å; S270-I272 PolarHBondContact O-N 3.07Å
271	Y	44.2	Very low	53	Low	93 Å²	93	88.4 Å²	88.4	37%	0.365	51%	0.512	S	S	.	.	S	Bend	trans	-67.2	82.6	154.9	-117	-89.3	0	0	0	106	I268 Q273 N339 P341	I268-Y271 PolarHBondContact O-N 3.36Å; Y271-Q273 PolarHBondContact O-N 3.15Å; Y271-N339 PolarHBondContact OH-O 3.24Å; Y271-N339 VanDerWaalsContact OH-O 3.04Å; Y271-P341 HydrophobicContact CD1-CG 3.87Å; Y271-P341 HydrophobicContact CD2-CG 3.94Å; Y271-P341 HydrophobicContact CE1-CG 3.8Å; Y271-P341 HydrophobicContact CE2-CG 3.86Å; Y271-P341 HydrophobicContact CG-CG 3.94Å
272	I	46.1	Very low	55.5	Low	141 Å²	141	85.6 Å²	85.6	72%	0.723	50%	0.497	S	S	*	.			trans	-41.6	118.8	169.4	-67.1	165.1	0	0	0	104.7	S270 S274	S270-I272 PolarHBondContact O-N 3.07Å; I272-S274 PolarHBondContact O-N 2.88Å
273	Q	49.8	Very low	58.2	Low	130 Å²	130	80.8 Å²	80.8	61%	0.607	46%	0.463	S	S	*	.			trans	-49.1	96.6	164.9	-78.3	174.8	-50.9	0	0	105.7	Y271 S275 F342	Y271-Q273 PolarHBondContact O-N 3.15Å; Q273-S275 PolarHBondContact O-N 3.31Å; Q273-F342 HydrophobicContact CG-CD2 4.4Å; Q273-F342 HydrophobicContact CG-CE2 4.1Å; Q273-F342 HydrophobicContact CG-CZ 4.48Å
274	S	57.5	Low	60.9	Low	36 Å²	36	76.1 Å²	76.1	25%	0.252	43%	0.429	S	S	.	.			trans	-65.2	124.8	171.9	80.3	0	0	0	0	102.4	I272 T276 D277 Q278	I272-S274 PolarHBondContact O-N 2.88Å; S274-T276 WeakPolarHBondContact CB-OG1 3.43Å; S274-T276 PolarHBondContact O-N 3.47Å; S274-T276 PolarHBondContact OG-OG1 3.49Å; S274-D277 PolarHBondContact O-N 2.85Å; S274-D277 WeakPolarHBondContact OG-CB 3.48Å; S274-D277 PolarHBondContact OG-N 3.04Å; S274-D277 PolarHBondContact OG-OD1 3.34Å; S274-Q278 PolarHBondContact O-N 3.42Å
275	S	62.8	Low	63.4	Low	89 Å²	89	74.6 Å²	74.6	62%	0.622	41%	0.413	S	S	*	.	H	α-helix	trans	-51.1	-27.8	177.9	56.9	0	0	0	0	110.8	Q273 Q278 D279	Q273-S275 PolarHBondContact O-N 3.31Å; S275-Q278 PolarHBondContact O-N 2.99Å; S275-D279 PolarHBondContact O-N 3.34Å
276	T	77.7	Confident	66	Low	34 Å²	34	74.6 Å²	74.6	21%	0.209	40%	0.401	C	S	.	.	H	α-helix	trans	-70.3	-34.1	176.5	53.9	0	0	0	0	115.3	L250 K253 S274 L280	L250-T276 WeakPolarHBondContact CD1-OG1 3.28Å; K253-T276 HydrophobicContact CD-CG2 4.36Å; S274-T276 WeakPolarHBondContact CB-OG1 3.43Å; S274-T276 PolarHBondContact O-N 3.47Å; S274-T276 PolarHBondContact OG-OG1 3.49Å; T276-L280 PolarHBondContact O-N 2.63Å
277	D	84.2	Confident	68.3	Low	4 Å²	4	69.3 Å²	69.3	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-69	-40.4	173.7	-79.3	17.9	0	0	0	110.1	S274 D279 L280 V281 H340 F342 V343	S274-D277 PolarHBondContact O-N 2.85Å; S274-D277 WeakPolarHBondContact OG-CB 3.48Å; S274-D277 PolarHBondContact OG-N 3.04Å; S274-D277 PolarHBondContact OG-OD1 3.34Å; D277-D279 VanDerWaalsContact C-N 3.35Å; D277-L280 PolarHBondContact O-N 2.64Å; D277-V281 WeakPolarHBondContact O-CG2 3.49Å; D277-V281 PolarHBondContact O-N 3.44Å; D277-V281 VanDerWaalsContact O-N 3.1Å; D277-H340 IonicContact OD1-CE1 3.78Å; D277-H340 IonicContact OD1-ND1 2.9Å; D277-H340 PolarHBondContact OD1-ND1 2.9Å; D277-H340 IonicContact OD2-ND1 3.53Å; D277-F342 HydrophobicContact CB-CD1 3.88Å; D277-V343 HydrophobicContact CB-CG2 3.99Å
278	Q	86.2	Confident	70.6	Confident	61 Å²	61	66.7 Å²	66.7	29%	0.285	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-42.3	175.4	-173.3	64.4	47.6	0	0	111.2	S274 S275 L280 V281 D282	S274-Q278 PolarHBondContact O-N 3.42Å; S275-Q278 PolarHBondContact O-N 2.99Å; Q278-L280 PolarHBondContact O-N 3.17Å; Q278-V281 PolarHBondContact O-N 3.03Å; Q278-V281 VanDerWaalsContact O-N 3.16Å; Q278-D282 PolarHBondContact NE2-OD1 2.73Å; Q278-D282 WeakPolarHBondContact O-CB 3.44Å; Q278-D282 VanDerWaalsContact O-CG 3.32Å; Q278-D282 PolarHBondContact O-N 3.29Å
279	D	87.1	Confident	72.3	Confident	93 Å²	93	62.1 Å²	62.1	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-57.8	-36.7	176.2	-67.7	-30	0	0	0	112.4	S275 D277 S283	S275-D279 PolarHBondContact O-N 3.34Å; D277-D279 VanDerWaalsContact C-N 3.35Å; D279-S283 WeakPolarHBondContact O-CB 3.15Å; D279-S283 PolarHBondContact O-N 3.04Å
280	L	87.6	Confident	74	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-70.7	-42.9	176.7	-176.1	62.4	0	0	0	111.7	R246 A247 L250 T276 D277 Q278 S283 Y284 F330 I335 V343	R246-L280 HydrophobicContact CB-CD1 3.91Å; A247-L280 HydrophobicContact CB-CD1 4.18Å; A247-L280 HydrophobicContact CB-CD2 4.28Å; L250-L280 HydrophobicContact CD2-CB 4.24Å; L250-L280 HydrophobicContact CD2-CD2 3.61Å; T276-L280 PolarHBondContact O-N 2.63Å; D277-L280 PolarHBondContact O-N 2.64Å; Q278-L280 PolarHBondContact O-N 3.17Å; L280-S283 WeakPolarHBondContact O-CB 3.36Å; L280-S283 PolarHBondContact O-N 3.36Å; L280-Y284 PolarHBondContact O-N 2.76Å; L280-F330 HydrophobicContact CD1-CE1 3.92Å; L280-F330 HydrophobicContact CD2-CD1 4.16Å; L280-F330 HydrophobicContact CD2-CE1 3.93Å; L280-F330 HydrophobicContact CG-CE1 3.96Å; L280-I335 HydrophobicContact CD2-CG1 4.49Å; L280-I335 HydrophobicContact CD2-CG2 4.43Å; L280-V343 HydrophobicContact CD2-CG1 4.23Å; L280-V343 HydrophobicContact CD2-CG2 4.28Å
281	V	85.2	Confident	75.5	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-44.6	176.4	171.8	0	0	0	0	110.9	D277 Q278 S283 Y284 Y285 F342 V343 A346	D277-V281 WeakPolarHBondContact O-CG2 3.49Å; D277-V281 PolarHBondContact O-N 3.44Å; D277-V281 VanDerWaalsContact O-N 3.1Å; Q278-V281 PolarHBondContact O-N 3.03Å; Q278-V281 VanDerWaalsContact O-N 3.16Å; V281-S283 VanDerWaalsContact C-N 3.31Å; V281-S283 PolarHBondContact O-N 3.36Å; V281-Y284 WeakPolarHBondContact O-CB 3.44Å; V281-Y284 PolarHBondContact O-N 3.49Å; V281-Y284 VanDerWaalsContact O-N 3.16Å; V281-Y285 HydrophobicContact CG1-CD2 3.83Å; V281-Y285 HydrophobicContact CG1-CE2 3.42Å; V281-Y285 VanDerWaalsContact CG1-CE2 3.42Å; V281-Y285 VanDerWaalsContact O-CD2 3.23Å; V281-Y285 WeakPolarHBondContact O-CD2 3.22Å; V281-Y285 PolarHBondContact O-N 3.33Å; V281-F342 HydrophobicContact CG2-CD1 4.43Å; V281-F342 HydrophobicContact CG2-CE1 4.18Å; V281-V343 HydrophobicContact CG2-CB 4.42Å; V281-V343 HydrophobicContact CG2-CG1 4.33Å; V281-V343 HydrophobicContact CG2-CG2 4.36Å; V281-A346 HydrophobicContact CG1-CB 4.01Å; V281-A346 HydrophobicContact CG2-CB 4.02Å
282	D	86.8	Confident	76.8	Confident	81 Å²	81	53.5 Å²	53.5	43%	0.433	28%	0.282	S	S	.	.	H	α-helix	trans	-63.5	-39.9	176.9	-70.8	-11.6	0	0	0	111	Q278 Y284 Y285 Q286	Q278-D282 PolarHBondContact NE2-OD1 2.73Å; Q278-D282 WeakPolarHBondContact O-CB 3.44Å; Q278-D282 VanDerWaalsContact O-CG 3.32Å; Q278-D282 PolarHBondContact O-N 3.29Å; D282-Y284 PolarHBondContact O-N 3.41Å; D282-Y285 PolarHBondContact O-N 2.71Å; D282-Q286 WeakPolarHBondContact O-CB 3.19Å; D282-Q286 PolarHBondContact O-N 3.48Å
283	S	86.1	Confident	77.8	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-45.5	172.1	-168.6	0	0	0	0	112.2	R246 D279 L280 V281 Y285 Q286 E287	R246-S283 VanDerWaalsContact CD-OG 3.24Å; R246-S283 WeakPolarHBondContact CD-OG 3.38Å; R246-S283 PolarHBondContact NE-OG 3.43Å; R246-S283 VanDerWaalsContact NE-OG 3.14Å; R246-S283 PolarHBondContact NH1-OG 3.09Å; R246-S283 VanDerWaalsContact NH1-OG 3.11Å; D279-S283 WeakPolarHBondContact O-CB 3.15Å; D279-S283 PolarHBondContact O-N 3.04Å; L280-S283 WeakPolarHBondContact O-CB 3.36Å; L280-S283 PolarHBondContact O-N 3.36Å; V281-S283 VanDerWaalsContact C-N 3.31Å; V281-S283 PolarHBondContact O-N 3.36Å; S283-Y285 VanDerWaalsContact C-N 3.32Å; S283-Y285 PolarHBondContact O-N 2.88Å; S283-Q286 PolarHBondContact O-N 3.41Å; S283-E287 VanDerWaalsContact O-CG 3.29Å; S283-E287 WeakPolarHBondContact O-CG 3.48Å; S283-E287 PolarHBondContact O-N 2.9Å
284	Y	87.5	Confident	78.6	Confident	14 Å²	14	49.4 Å²	49.4	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-48.6	177.9	169.7	-80.5	0	0	0	110.3	I243 L280 V281 D282 Q286 E287 F288 F322 D323 A326 F330 L347	I243-Y284 HydrophobicContact CD1-CD2 4.5Å; L280-Y284 PolarHBondContact O-N 2.76Å; V281-Y284 WeakPolarHBondContact O-CB 3.44Å; V281-Y284 PolarHBondContact O-N 3.49Å; V281-Y284 VanDerWaalsContact O-N 3.16Å; D282-Y284 PolarHBondContact O-N 3.41Å; Y284-Q286 PolarHBondContact O-N 2.85Å; Y284-E287 PolarHBondContact O-N 3.23Å; Y284-F288 HydrophobicContact CE1-CD2 4.45Å; Y284-F288 VanDerWaalsContact O-CB 3.22Å; Y284-F288 WeakPolarHBondContact O-CB 2.99Å; Y284-F288 PolarHBondContact O-N 2.88Å; Y284-F322 HydrophobicContact CD2-CE1 4.06Å; Y284-F322 HydrophobicContact CD2-CZ 4.39Å; Y284-F322 HydrophobicContact CE2-CD1 4.48Å; Y284-F322 AromaticContact CE2-CE1 3.78Å; Y284-F322 HydrophobicContact CE2-CE1 3.78Å; Y284-D323 PolarHBondContact OH-OD1 3.49Å; Y284-A326 HydrophobicContact CD2-CB 4Å; Y284-A326 HydrophobicContact CE2-CB 3.88Å; Y284-F330 HydrophobicContact CD2-CE2 4.2Å; Y284-F330 AromaticContact CD2-CZ 3.92Å; Y284-F330 HydrophobicContact CD2-CZ 3.92Å; Y284-L347 HydrophobicContact CD1-CD2 3.51Å; Y284-L347 HydrophobicContact CD2-CD1 4.24Å; Y284-L347 HydrophobicContact CE1-CD2 3.59Å; Y284-L347 HydrophobicContact CE2-CD1 4.32Å; Y284-L347 HydrophobicContact CG-CD1 4.37Å; Y284-L347 HydrophobicContact CG-CD2 4.08Å
285	Y	85.4	Confident	78.8	Confident	116 Å²	116	47.8 Å²	47.8	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-66.9	-35.3	179.6	-71.3	-56.2	0	0	0	113.1	V281 D282 S283 G289 A346 L347	V281-Y285 HydrophobicContact CG1-CD2 3.83Å; V281-Y285 HydrophobicContact CG1-CE2 3.42Å; V281-Y285 VanDerWaalsContact CG1-CE2 3.42Å; V281-Y285 VanDerWaalsContact O-CD2 3.23Å; V281-Y285 WeakPolarHBondContact O-CD2 3.22Å; V281-Y285 PolarHBondContact O-N 3.33Å; D282-Y285 PolarHBondContact O-N 2.71Å; S283-Y285 VanDerWaalsContact C-N 3.32Å; S283-Y285 PolarHBondContact O-N 2.88Å; Y285-G289 PolarHBondContact O-N 3.36Å; Y285-A346 PolarHBondContact OH-O 3.2Å; Y285-L347 HydrophobicContact CE1-CD2 4.3Å; Y285-L347 HydrophobicContact CE2-CD2 4.49Å
286	Q	84.4	Confident	78.8	Confident	116 Å²	116	50.5 Å²	50.5	54%	0.542	24%	0.244	S	C	.	.	H	α-helix	trans	-61.9	-52.9	175.1	-178.9	-178	-6.8	0	0	111.1	D282 S283 Y284 G289 V290	D282-Q286 WeakPolarHBondContact O-CB 3.19Å; D282-Q286 PolarHBondContact O-N 3.48Å; S283-Q286 PolarHBondContact O-N 3.41Å; Y284-Q286 PolarHBondContact O-N 2.85Å; Q286-G289 WeakPolarHBondContact O-CA 3.29Å; Q286-G289 PolarHBondContact O-N 3.12Å; Q286-G289 VanDerWaalsContact O-N 3.14Å; Q286-V290 PolarHBondContact O-N 2.97Å; Q286-V290 VanDerWaalsContact O-N 3.09Å
287	E	82.3	Confident	77.7	Confident	23 Å²	23	54.4 Å²	54.4	11%	0.107	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-40.8	-179.5	-64.7	-63.9	168.8	0	0	111.4	S239 S242 I243 S283 Y284 G289 V290 L291 F322	S239-E287 WeakPolarHBondContact CA-OE2 3.17Å; S239-E287 VanDerWaalsContact CB-OE2 3.27Å; S239-E287 WeakPolarHBondContact CB-OE2 3.45Å; S239-E287 PolarHBondContact OG-OE2 3.46Å; S242-E287 WeakPolarHBondContact CB-OE1 3.08Å; S242-E287 PolarHBondContact OG-OE1 3.43Å; I243-E287 HydrophobicContact CD1-CB 4.05Å; I243-E287 HydrophobicContact CD1-CG 4.23Å; I243-E287 HydrophobicContact CG1-CB 4.47Å; I243-E287 HydrophobicContact CG1-CG 4.09Å; S283-E287 VanDerWaalsContact O-CG 3.29Å; S283-E287 WeakPolarHBondContact O-CG 3.48Å; S283-E287 PolarHBondContact O-N 2.9Å; Y284-E287 PolarHBondContact O-N 3.23Å; E287-G289 VanDerWaalsContact C-N 3.27Å; E287-G289 PolarHBondContact O-N 3.36Å; E287-V290 WeakPolarHBondContact O-CB 3.03Å; E287-V290 PolarHBondContact O-N 3.33Å; E287-V290 VanDerWaalsContact O-N 3.14Å; E287-L291 PolarHBondContact O-N 3.44Å; E287-F322 HydrophobicContact CB-CE2 4.01Å; E287-F322 HydrophobicContact CB-CZ 3.81Å
288	F	79.8	Confident	76.2	Confident	55 Å²	55	54.7 Å²	54.7	24%	0.241	26%	0.264	C	S	.	.	H	α-helix	trans	-55.7	-43.6	171.2	-172	-87.2	0	0	0	111.5	Y284 V290 L291 L292 C319 F322	Y284-F288 HydrophobicContact CE1-CD2 4.45Å; Y284-F288 VanDerWaalsContact O-CB 3.22Å; Y284-F288 WeakPolarHBondContact O-CB 2.99Å; Y284-F288 PolarHBondContact O-N 2.88Å; F288-V290 VanDerWaalsContact C-N 3.35Å; F288-V290 PolarHBondContact O-N 2.95Å; F288-L291 PolarHBondContact O-N 2.93Å; F288-L292 HydrophobicContact CE1-CD1 3.92Å; F288-L292 WeakPolarHBondContact O-CB 3.45Å; F288-L292 PolarHBondContact O-N 3.48Å; F288-C319 HydrophobicContact CE2-CB 3.66Å; F288-C319 HydrophobicContact CZ-CB 3.6Å; F288-F322 HydrophobicContact CB-CD1 4.34Å; F288-F322 HydrophobicContact CB-CE1 3.73Å; F288-F322 HydrophobicContact CB-CZ 4.33Å; F288-F322 AromaticContact CD2-CD1 3.62Å; F288-F322 HydrophobicContact CD2-CD1 3.62Å; F288-F322 AromaticContact CD2-CE1 3.74Å; F288-F322 HydrophobicContact CD2-CE1 3.74Å; F288-F322 HydrophobicContact CE2-CD1 4.45Å; F288-F322 HydrophobicContact CG-CD1 4.44Å; F288-F322 HydrophobicContact CG-CE1 4.24Å
289	G	75.3	Confident	74.6	Confident	26 Å²	26	53.4 Å²	53.4	27%	0.268	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-33.2	177.7	0	0	0	0	0	114.1	Y285 Q286 E287 K293	Y285-G289 PolarHBondContact O-N 3.36Å; Q286-G289 WeakPolarHBondContact O-CA 3.29Å; Q286-G289 PolarHBondContact O-N 3.12Å; Q286-G289 VanDerWaalsContact O-N 3.14Å; E287-G289 VanDerWaalsContact C-N 3.27Å; E287-G289 PolarHBondContact O-N 3.36Å; G289-K293 WeakPolarHBondContact O-CG 3.41Å; G289-K293 PolarHBondContact O-N 3.44Å
290	V	76.3	Confident	72.6	Confident	51 Å²	51	54.8 Å²	54.8	31%	0.309	27%	0.27	S	S	.	.	H	α-helix	trans	-64.7	-50.7	174.4	173.3	0	0	0	0	110.1	Q286 E287 F288 L292 K293 L294	Q286-V290 PolarHBondContact O-N 2.97Å; Q286-V290 VanDerWaalsContact O-N 3.09Å; E287-V290 WeakPolarHBondContact O-CB 3.03Å; E287-V290 PolarHBondContact O-N 3.33Å; E287-V290 VanDerWaalsContact O-N 3.14Å; F288-V290 VanDerWaalsContact C-N 3.35Å; F288-V290 PolarHBondContact O-N 2.95Å; V290-L292 VanDerWaalsContact C-N 3.29Å; V290-L292 PolarHBondContact O-N 3.36Å; V290-K293 WeakPolarHBondContact O-CB 3.05Å; V290-K293 PolarHBondContact O-N 3.17Å; V290-K293 VanDerWaalsContact O-N 3.07Å; V290-L294 HydrophobicContact CG1-CD1 4.07Å; V290-L294 PolarHBondContact O-N 3.41Å
291	L	74.2	Confident	70.5	Confident	2 Å²	2	59 Å²	59	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-63.5	-34.8	179.5	-68.1	176.4	0	0	0	112.9	E235 L236 E287 F288 K293 L294 S295 T318 F322	E235-L291 HydrophobicContact CB-CD2 3.94Å; L236-L291 HydrophobicContact CD1-CD1 3.98Å; E287-L291 PolarHBondContact O-N 3.44Å; F288-L291 PolarHBondContact O-N 2.93Å; L291-K293 VanDerWaalsContact C-N 3.3Å; L291-K293 PolarHBondContact O-N 2.88Å; L291-L294 HydrophobicContact CD2-CD1 4.3Å; L291-L294 PolarHBondContact O-N 3.31Å; L291-S295 WeakPolarHBondContact O-CB 3.38Å; L291-S295 PolarHBondContact O-N 2.92Å; L291-S295 PolarHBondContact O-OG 3.47Å; L291-T318 HydrophobicContact CB-CG2 3.91Å; L291-T318 HydrophobicContact CD2-CG2 4.38Å; L291-F322 HydrophobicContact CD1-CB 3.56Å; L291-F322 HydrophobicContact CD1-CD1 4.34Å; L291-F322 HydrophobicContact CD1-CD2 3.2Å; L291-F322 HydrophobicContact CD1-CE2 3.88Å; L291-F322 HydrophobicContact CD1-CG 3.43Å; L291-F322 VanDerWaalsContact CD1-CG 3.43Å
292	L	70.1	Confident	68.3	Low	45 Å²	45	66.5 Å²	66.5	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-66.2	-31.6	175	-168.3	133	0	0	0	112.5	F288 V290 S295 R296	F288-L292 HydrophobicContact CE1-CD1 3.92Å; F288-L292 WeakPolarHBondContact O-CB 3.45Å; F288-L292 PolarHBondContact O-N 3.48Å; V290-L292 VanDerWaalsContact C-N 3.29Å; V290-L292 PolarHBondContact O-N 3.36Å; L292-S295 WeakPolarHBondContact CA-OG 3.31Å; L292-S295 PolarHBondContact O-OG 2.81Å; L292-R296 WeakPolarHBondContact O-CG 3.39Å; L292-R296 PolarHBondContact O-N 2.93Å
293	K	68.4	Low	66	Low	144 Å²	144	63.8 Å²	63.8	63%	0.626	32%	0.319	S	S	*	.	H	α-helix	trans	-71.4	-44.7	173.9	-71.1	170	-177	174.7	0	111.8	G289 V290 L291 S295 R296 L297	G289-K293 WeakPolarHBondContact O-CG 3.41Å; G289-K293 PolarHBondContact O-N 3.44Å; V290-K293 WeakPolarHBondContact O-CB 3.05Å; V290-K293 PolarHBondContact O-N 3.17Å; V290-K293 VanDerWaalsContact O-N 3.07Å; L291-K293 VanDerWaalsContact C-N 3.3Å; L291-K293 PolarHBondContact O-N 2.88Å; K293-S295 VanDerWaalsContact C-N 3.33Å; K293-S295 PolarHBondContact O-N 3.43Å; K293-R296 PolarHBondContact O-N 3.2Å; K293-L297 WeakPolarHBondContact O-CG 3.28Å; K293-L297 PolarHBondContact O-N 3.23Å
294	L	65.7	Low	63.6	Low	41 Å²	41	67.2 Å²	67.2	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-61	-43	178.1	-78.3	151.1	0	0	0	112.5	E235 V290 L291 R296 L297 T298	E235-L294 HydrophobicContact CB-CD1 3.49Å; E235-L294 VanDerWaalsContact CB-CD1 3.49Å; E235-L294 HydrophobicContact CG-CD1 3.31Å; E235-L294 HydrophobicContact CG-CD2 3.98Å; E235-L294 HydrophobicContact CG-CG 4.26Å; V290-L294 HydrophobicContact CG1-CD1 4.07Å; V290-L294 PolarHBondContact O-N 3.41Å; L291-L294 HydrophobicContact CD2-CD1 4.3Å; L291-L294 PolarHBondContact O-N 3.31Å; L294-R296 VanDerWaalsContact C-N 3.32Å; L294-R296 PolarHBondContact O-N 3.03Å; L294-L297 WeakPolarHBondContact O-CB 3.07Å; L294-L297 PolarHBondContact O-N 2.67Å; L294-T298 PolarHBondContact O-N 2.64Å; L294-T298 PolarHBondContact O-OG1 3.36Å
295	S	62.8	Low	61.1	Low	2 Å²	2	72.4 Å²	72.4	1%	0.014	38%	0.376	C	S	.	.	H	α-helix	trans	-66.8	-33.2	178.7	55.3	0	0	0	0	113.3	L291 L292 K293 T298 S299 D315	L291-S295 WeakPolarHBondContact O-CB 3.38Å; L291-S295 PolarHBondContact O-N 2.92Å; L291-S295 PolarHBondContact O-OG 3.47Å; L292-S295 WeakPolarHBondContact CA-OG 3.31Å; L292-S295 PolarHBondContact O-OG 2.81Å; K293-S295 VanDerWaalsContact C-N 3.33Å; K293-S295 PolarHBondContact O-N 3.43Å; S295-T298 WeakPolarHBondContact CA-OG1 3.49Å; S295-T298 PolarHBondContact O-N 2.69Å; S295-T298 PolarHBondContact O-OG1 2.9Å; S295-S299 PolarHBondContact O-N 2.99Å; S295-S299 PolarHBondContact O-OG 2.65Å; S295-D315 VanDerWaalsContact CB-CB 3.42Å; S295-D315 WeakPolarHBondContact OG-CA 3.42Å; S295-D315 WeakPolarHBondContact OG-CB 3.39Å
296	R	61.1	Low	58.7	Low	146 Å²	146	76.4 Å²	76.4	55%	0.551	40%	0.396	S	S	*	.	H	α-helix	trans	-66.8	-37.1	170	-74	175.2	176	-178.2	0.1	113	L292 K293 L294 S299 N300	L292-R296 WeakPolarHBondContact O-CG 3.39Å; L292-R296 PolarHBondContact O-N 2.93Å; K293-R296 PolarHBondContact O-N 3.2Å; L294-R296 VanDerWaalsContact C-N 3.32Å; L294-R296 PolarHBondContact O-N 3.03Å; R296-S299 WeakPolarHBondContact CA-OG 3.05Å; R296-S299 PolarHBondContact O-OG 3.05Å; R296-N300 WeakPolarHBondContact O-CB 3.28Å; R296-N300 PolarHBondContact O-N 3.18Å; R296-N300 VanDerWaalsContact O-N 3.16Å; R296-N300 PolarHBondContact O-ND2 3.38Å
297	L	54.5	Low	56.4	Low	115 Å²	115	75.3 Å²	75.3	60%	0.602	39%	0.393	S	S	*	.	H	α-helix	trans	-65.4	-42.3	175.4	-70.6	169.5	0	0	0	111.2	K293 L294 N300 L301	K293-L297 WeakPolarHBondContact O-CG 3.28Å; K293-L297 PolarHBondContact O-N 3.23Å; L294-L297 WeakPolarHBondContact O-CB 3.07Å; L294-L297 PolarHBondContact O-N 2.67Å; L297-N300 PolarHBondContact O-N 2.84Å; L297-L301 PolarHBondContact O-N 2.79Å
298	T	52.6	Low	54.2	Low	10 Å²	10	76.4 Å²	76.4	6%	0.061	41%	0.406	C	S	.	.	H	α-helix	trans	-72.2	-33.8	178.4	53.9	0	0	0	0	113	Y231 L294 S295 N300 L301	Y231-T298 HydrophobicContact CD2-CG2 4Å; Y231-T298 HydrophobicContact CG-CG2 4.27Å; L294-T298 PolarHBondContact O-N 2.64Å; L294-T298 PolarHBondContact O-OG1 3.36Å; S295-T298 WeakPolarHBondContact CA-OG1 3.49Å; S295-T298 PolarHBondContact O-N 2.69Å; S295-T298 PolarHBondContact O-OG1 2.9Å; T298-N300 PolarHBondContact O-N 3.16Å; T298-L301 HydrophobicContact CG2-CD1 4.37Å; T298-L301 WeakPolarHBondContact O-CB 3.38Å; T298-L301 PolarHBondContact O-N 3.05Å
299	S	52.7	Low	52.3	Low	34 Å²	34	75.5 Å²	75.5	24%	0.238	40%	0.404	C	S	.	.	H	α-helix	trans	-64.9	-29.6	171.3	62.4	0	0	0	0	112.7	S295 R296 L301	S295-S299 PolarHBondContact O-N 2.99Å; S295-S299 PolarHBondContact O-OG 2.65Å; R296-S299 WeakPolarHBondContact CA-OG 3.05Å; R296-S299 PolarHBondContact O-OG 3.05Å; S299-L301 VanDerWaalsContact C-N 3.29Å; S299-L301 PolarHBondContact O-N 2.88Å
300	N	45.8	Very low	50.8	Low	123 Å²	123	79.3 Å²	79.3	66%	0.658	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-8.1	177.4	-72.5	-13.5	0	0	0	113.7	R296 L297 T298 N302	R296-N300 WeakPolarHBondContact O-CB 3.28Å; R296-N300 PolarHBondContact O-N 3.18Å; R296-N300 VanDerWaalsContact O-N 3.16Å; R296-N300 PolarHBondContact O-ND2 3.38Å; L297-N300 PolarHBondContact O-N 2.84Å; T298-N300 PolarHBondContact O-N 3.16Å; N300-N302 PolarHBondContact O-N 2.84Å
301	L	43.4	Very low	49.2	Very low	92 Å²	92	83.2 Å²	83.2	48%	0.482	43%	0.433	S	S	.	.	S	Bend	trans	-71.2	28.8	179.3	-74.4	170.8	0	0	0	114.4	I227 Y231 L297 T298 S299 C303	I227-L301 HydrophobicContact CG2-CD1 4.16Å; Y231-L301 HydrophobicContact CE2-CD1 4.36Å; L297-L301 PolarHBondContact O-N 2.79Å; T298-L301 HydrophobicContact CG2-CD1 4.37Å; T298-L301 WeakPolarHBondContact O-CB 3.38Å; T298-L301 PolarHBondContact O-N 3.05Å; S299-L301 VanDerWaalsContact C-N 3.29Å; S299-L301 PolarHBondContact O-N 2.88Å; L301-C303 PolarHBondContact O-N 3.39Å
302	N	38.5	Very low	47.8	Very low	160 Å²	160	85.2 Å²	85.2	86%	0.856	44%	0.443	S	S	*	.			trans	55.3	21.5	-177.6	-76.5	-24	0	0	0	114.4	N300 S304	N300-N302 PolarHBondContact O-N 2.84Å; N302-S304 PolarHBondContact O-N 3.49Å
303	C	38.7	Very low	47.1	Very low	24 Å²	24	85.9 Å²	85.9	16%	0.162	45%	0.449	C	S	.	.			trans	-61.1	107.4	160.9	-77.7	0	0	0	0	106.2	L301 T305	L301-C303 PolarHBondContact O-N 3.39Å; C303-T305 PolarHBondContact O-N 3.4Å
304	S	36.4	Very low	46.6	Very low	73 Å²	73	80 Å²	80	51%	0.51	42%	0.424	S	S	.	.			trans	-48.4	111.3	-174.3	64.6	0	0	0	0	109.8	N302 K306 L307	N302-S304 PolarHBondContact O-N 3.49Å; S304-K306 PolarHBondContact O-N 2.88Å; S304-L307 PolarHBondContact O-N 2.9Å
305	T	34.6	Very low	46.3	Very low	122 Å²	122	79.7 Å²	79.7	75%	0.748	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-4.2	-179.9	37.2	0	0	0	0	113.1	C303 L307 A308	C303-T305 PolarHBondContact O-N 3.4Å; T305-L307 PolarHBondContact O-N 2.94Å; T305-A308 PolarHBondContact O-N 3.11Å
306	K	34.1	Very low	46.3	Very low	201 Å²	201	84.3 Å²	84.3	87%	0.874	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22	171.3	-85.3	-171.2	173.2	-178.9	0	114.1	S304 A308	S304-K306 PolarHBondContact O-N 2.88Å; K306-A308 PolarHBondContact O-N 2.67Å
307	L	36.5	Very low	46.5	Very low	92 Å²	92	78 Å²	78	48%	0.482	42%	0.419	S	S	.	.			trans	-94.9	56.2	170.4	-78.9	151.1	0	0	0	109.7	S304 T305 I309	S304-L307 PolarHBondContact O-N 2.9Å; T305-L307 PolarHBondContact O-N 2.94Å; L307-I309 PolarHBondContact O-N 3.07Å
308	A	36.5	Very low	47.2	Very low	47 Å²	47	72.6 Å²	72.6	39%	0.388	39%	0.391	S	S	.	.			trans	-62.8	91.5	153	0	0	0	0	0	106.1	T305 K306 Q310	T305-A308 PolarHBondContact O-N 3.11Å; K306-A308 PolarHBondContact O-N 2.67Å; A308-Q310 VanDerWaalsContact C-N 3.26Å; A308-Q310 PolarHBondContact O-N 3.45Å
309	I	40.4	Very low	47.9	Very low	36 Å²	36	72.9 Å²	72.9	19%	0.185	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-61.3	94.9	174.3	-64.1	140.8	0	0	0	105.8	S219 K220 L307 D311 Q312	S219-I309 WeakPolarHBondContact O-CD1 2.98Å; K220-I309 HydrophobicContact CD-CG2 4.44Å; L307-I309 PolarHBondContact O-N 3.07Å; I309-D311 VanDerWaalsContact C-N 3.34Å; I309-D311 PolarHBondContact O-N 3.48Å; I309-Q312 WeakPolarHBondContact O-CB 3.41Å; I309-Q312 PolarHBondContact O-N 3.34Å
310	Q	44.5	Very low	48.6	Very low	106 Å²	106	73 Å²	73	50%	0.495	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	53.1	-179.3	-60.7	179.9	-16.6	0	0	112.8	A308 Q312	A308-Q310 VanDerWaalsContact C-N 3.26Å; A308-Q310 PolarHBondContact O-N 3.45Å; Q310-Q312 PolarHBondContact O-N 2.64Å
311	D	41.7	Very low	50.2	Low	132 Å²	132	67.5 Å²	67.5	71%	0.706	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	15.1	179.9	-55.2	-45.6	0	0	0	115.6	I309 K316	I309-D311 VanDerWaalsContact C-N 3.34Å; I309-D311 PolarHBondContact O-N 3.48Å; D311-K316 PolarHBondContact O-NZ 2.92Å
312	Q	45.6	Very low	52	Low	45 Å²	45	63.1 Å²	63.1	21%	0.21	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-100.2	110.4	173.4	-51.9	-148.5	-26.7	0	0	110.3	M1 I309 Q310	M1-Q312 VanDerWaalsContact CG-NE2 3.31Å; I309-Q312 WeakPolarHBondContact O-CB 3.41Å; I309-Q312 PolarHBondContact O-N 3.34Å; Q310-Q312 PolarHBondContact O-N 2.64Å
313	T	53.9	Low	53.9	Low	58 Å²	58	55.9 Å²	55.9	36%	0.356	30%	0.3	S	S	.	.			trans	-79	153.5	168.7	37.6	0	0	0	0	109.4	D315 K316 L317	T313-D315 WeakPolarHBondContact CA-OD1 3.42Å; T313-D315 WeakPolarHBondContact CB-OD1 3.41Å; T313-D315 PolarHBondContact O-N 3.25Å; T313-D315 VanDerWaalsContact O-N 3.15Å; T313-D315 PolarHBondContact OG1-OD1 3.16Å; T313-K316 WeakPolarHBondContact O-CB 3.3Å; T313-K316 PolarHBondContact O-N 3.32Å; T313-L317 PolarHBondContact O-N 2.83Å
314	L	57.9	Low	55.9	Low	21 Å²	21	55.2 Å²	55.2	11%	0.11	30%	0.295	C	S	.	.	H	α-helix	trans	-56	-29.3	-178.3	-81.8	148.9	0	0	0	112.8	Q224 F228 L317 T318	Q224-L314 HydrophobicContact CB-CD1 4.25Å; Q224-L314 HydrophobicContact CG-CD1 4.26Å; F228-L314 HydrophobicContact CB-CD2 3.9Å; F228-L314 HydrophobicContact CD1-CD2 3.76Å; F228-L314 HydrophobicContact CD2-CB 4.25Å; F228-L314 HydrophobicContact CD2-CD2 3.66Å; F228-L314 HydrophobicContact CD2-CG 4.44Å; F228-L314 HydrophobicContact CE1-CD2 4.1Å; F228-L314 HydrophobicContact CE2-CB 4.15Å; F228-L314 HydrophobicContact CE2-CD2 4.03Å; F228-L314 HydrophobicContact CG-CD2 3.51Å; F228-L314 HydrophobicContact CZ-CD2 4.22Å; L314-L317 PolarHBondContact O-N 2.7Å; L314-T318 PolarHBondContact O-N 2.82Å; L314-T318 PolarHBondContact O-OG1 2.96Å
315	D	59.9	Low	58.4	Low	34 Å²	34	51.8 Å²	51.8	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-46.9	169.7	62.4	-14.1	0	0	0	113.3	S295 T313 L317 T318 C319	S295-D315 VanDerWaalsContact CB-CB 3.42Å; S295-D315 WeakPolarHBondContact OG-CA 3.42Å; S295-D315 WeakPolarHBondContact OG-CB 3.39Å; T313-D315 WeakPolarHBondContact CA-OD1 3.42Å; T313-D315 WeakPolarHBondContact CB-OD1 3.41Å; T313-D315 PolarHBondContact O-N 3.25Å; T313-D315 VanDerWaalsContact O-N 3.15Å; T313-D315 PolarHBondContact OG1-OD1 3.16Å; D315-L317 VanDerWaalsContact C-N 3.3Å; D315-L317 PolarHBondContact O-N 3.48Å; D315-T318 WeakPolarHBondContact O-CB 3.31Å; D315-T318 PolarHBondContact O-N 2.89Å; D315-C319 WeakPolarHBondContact O-CB 3.43Å; D315-C319 PolarHBondContact O-N 3.41Å; D315-C319 PolarHBondContact O-SG 3Å
316	K	62.1	Low	60.9	Low	100 Å²	100	46 Å²	46	44%	0.435	24%	0.235	S	C	.	.	H	α-helix	trans	-62.8	-39.9	176.3	-65	-177.6	-170	173.8	0	110.7	D311 T313 L320	D311-K316 PolarHBondContact O-NZ 2.92Å; T313-K316 WeakPolarHBondContact O-CB 3.3Å; T313-K316 PolarHBondContact O-N 3.32Å; K316-L320 WeakPolarHBondContact O-CB 3.41Å; K316-L320 WeakPolarHBondContact O-CD1 3.36Å; K316-L320 WeakPolarHBondContact O-CG 3.15Å; K316-L320 PolarHBondContact O-N 3.21Å
317	L	66.3	Low	63.4	Low	12 Å²	12	36.9 Å²	36.9	6%	0.063	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-45.1	177	-178.1	60.2	0	0	0	111.6	V215 K218 T313 L314 D315 C319 L320 I321	V215-L317 HydrophobicContact CG1-CD2 4.44Å; K218-L317 HydrophobicContact CB-CD1 3.62Å; K218-L317 HydrophobicContact CB-CD2 4.06Å; K218-L317 HydrophobicContact CG-CD1 4.11Å; T313-L317 PolarHBondContact O-N 2.83Å; L314-L317 PolarHBondContact O-N 2.7Å; D315-L317 VanDerWaalsContact C-N 3.3Å; D315-L317 PolarHBondContact O-N 3.48Å; L317-C319 PolarHBondContact O-N 2.78Å; L317-L320 PolarHBondContact O-N 3.38Å; L317-I321 HydrophobicContact CD1-CD1 3.93Å; L317-I321 HydrophobicContact CD1-CG1 4.18Å; L317-I321 HydrophobicContact CG-CD1 3.92Å; L317-I321 WeakPolarHBondContact O-CG1 3.4Å; L317-I321 PolarHBondContact O-N 3.35Å
318	T	68.2	Low	66	Low	2 Å²	2	32.6 Å²	32.6	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-55	-53.1	175.5	-52.2	0	0	0	0	111.1	F228 L232 L291 L314 D315 L320 I321 F322	F228-T318 WeakPolarHBondContact CE2-OG1 3.45Å; F228-T318 WeakPolarHBondContact CZ-OG1 3.4Å; L232-T318 HydrophobicContact CD1-CG2 3.53Å; L291-T318 HydrophobicContact CB-CG2 3.91Å; L291-T318 HydrophobicContact CD2-CG2 4.38Å; L314-T318 PolarHBondContact O-N 2.82Å; L314-T318 PolarHBondContact O-OG1 2.96Å; D315-T318 WeakPolarHBondContact O-CB 3.31Å; D315-T318 PolarHBondContact O-N 2.89Å; T318-L320 VanDerWaalsContact C-N 3.31Å; T318-L320 PolarHBondContact O-N 2.92Å; T318-I321 PolarHBondContact O-N 3.48Å; T318-F322 WeakPolarHBondContact O-CB 3.2Å; T318-F322 PolarHBondContact O-N 3.14Å
319	C	68.3	Low	68.6	Low	16 Å²	16	30.5 Å²	30.5	11%	0.108	16%	0.156	C	C	.	.	H	α-helix	trans	-61.7	-41.7	-176.5	-66.1	0	0	0	0	111.3	F288 D315 L317 F322 D323	F288-C319 HydrophobicContact CE2-CB 3.66Å; F288-C319 HydrophobicContact CZ-CB 3.6Å; D315-C319 WeakPolarHBondContact O-CB 3.43Å; D315-C319 PolarHBondContact O-N 3.41Å; D315-C319 PolarHBondContact O-SG 3Å; L317-C319 PolarHBondContact O-N 2.78Å; C319-F322 PolarHBondContact O-N 2.99Å; C319-D323 WeakPolarHBondContact O-CB 3.41Å; C319-D323 PolarHBondContact O-N 2.97Å
320	L	67.8	Low	71	Confident	37 Å²	37	28.9 Å²	28.9	19%	0.194	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-48	176.5	-72.6	171.2	0	0	0	111.7	M1 K316 L317 T318 F322 D323 H324	M1-L320 VanDerWaalsContact N-CD1 3.32Å; K316-L320 WeakPolarHBondContact O-CB 3.41Å; K316-L320 WeakPolarHBondContact O-CD1 3.36Å; K316-L320 WeakPolarHBondContact O-CG 3.15Å; K316-L320 PolarHBondContact O-N 3.21Å; L317-L320 PolarHBondContact O-N 3.38Å; T318-L320 VanDerWaalsContact C-N 3.31Å; T318-L320 PolarHBondContact O-N 2.92Å; L320-F322 VanDerWaalsContact C-N 3.3Å; L320-F322 PolarHBondContact O-N 3.47Å; L320-D323 PolarHBondContact O-N 2.76Å; L320-H324 PolarHBondContact O-CD2 3.49Å; L320-H324 PolarHBondContact O-CE1 2.99Å; L320-H324 PolarHBondContact O-N 2.83Å; L320-H324 VanDerWaalsContact O-N 3.08Å; L320-H324 PolarHBondContact O-ND1 2.98Å; L320-H324 PolarHBondContact O-NE2 3.37Å; L320-H324 VanDerWaalsContact O-NE2 3.15Å
321	I	78	Confident	73.2	Confident	8 Å²	8	26.4 Å²	26.4	4%	0.041	13%	0.134	C	C	.	.	H	α-helix	trans	-59.3	-45.8	178.8	-70.9	172.3	0	0	0	110.1	V215 L236 L317 T318 H324 L325	V215-I321 HydrophobicContact CG2-CD1 3.56Å; L236-I321 HydrophobicContact CD2-CG2 3.77Å; L317-I321 HydrophobicContact CD1-CD1 3.93Å; L317-I321 HydrophobicContact CD1-CG1 4.18Å; L317-I321 HydrophobicContact CG-CD1 3.92Å; L317-I321 WeakPolarHBondContact O-CG1 3.4Å; L317-I321 PolarHBondContact O-N 3.35Å; T318-I321 PolarHBondContact O-N 3.48Å; I321-H324 PolarHBondContact O-N 2.91Å; I321-L325 HydrophobicContact CG2-CD1 3.54Å; I321-L325 HydrophobicContact CG2-CG 4.29Å; I321-L325 WeakPolarHBondContact O-CB 3.39Å; I321-L325 WeakPolarHBondContact O-CG 3.33Å; I321-L325 PolarHBondContact O-N 2.65Å
322	F	81.4	Confident	75.6	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.2	-48.9	177.2	169.8	-93.8	0	0	0	112.6	L236 L240 I243 Y284 E287 F288 L291 T318 C319 L320 H324 L325 A326	L236-F322 HydrophobicContact CD1-CB 3.92Å; L236-F322 HydrophobicContact CD1-CD2 4.16Å; L240-F322 HydrophobicContact CD2-CD2 3.95Å; L240-F322 HydrophobicContact CD2-CE2 4.23Å; L240-F322 HydrophobicContact CG-CD2 4.35Å; I243-F322 HydrophobicContact CD1-CE1 4.38Å; I243-F322 HydrophobicContact CD1-CE2 3.47Å; I243-F322 VanDerWaalsContact CD1-CE2 3.47Å; I243-F322 HydrophobicContact CD1-CZ 3.28Å; Y284-F322 HydrophobicContact CD2-CE1 4.06Å; Y284-F322 HydrophobicContact CD2-CZ 4.39Å; Y284-F322 HydrophobicContact CE2-CD1 4.48Å; Y284-F322 AromaticContact CE2-CE1 3.78Å; Y284-F322 HydrophobicContact CE2-CE1 3.78Å; E287-F322 HydrophobicContact CB-CE2 4.01Å; E287-F322 HydrophobicContact CB-CZ 3.81Å; F288-F322 HydrophobicContact CB-CD1 4.34Å; F288-F322 HydrophobicContact CB-CE1 3.73Å; F288-F322 HydrophobicContact CB-CZ 4.33Å; F288-F322 AromaticContact CD2-CD1 3.62Å; F288-F322 HydrophobicContact CD2-CD1 3.62Å; F288-F322 AromaticContact CD2-CE1 3.74Å; F288-F322 HydrophobicContact CD2-CE1 3.74Å; F288-F322 HydrophobicContact CE2-CD1 4.45Å; F288-F322 HydrophobicContact CG-CD1 4.44Å; F288-F322 HydrophobicContact CG-CE1 4.24Å; L291-F322 HydrophobicContact CD1-CB 3.56Å; L291-F322 HydrophobicContact CD1-CD1 4.34Å; L291-F322 HydrophobicContact CD1-CD2 3.2Å; L291-F322 HydrophobicContact CD1-CE2 3.88Å; L291-F322 HydrophobicContact CD1-CG 3.43Å; L291-F322 VanDerWaalsContact CD1-CG 3.43Å; T318-F322 WeakPolarHBondContact O-CB 3.2Å; T318-F322 PolarHBondContact O-N 3.14Å; C319-F322 PolarHBondContact O-N 2.99Å; L320-F322 VanDerWaalsContact C-N 3.3Å; L320-F322 PolarHBondContact O-N 3.47Å; F322-H324 VanDerWaalsContact C-N 3.29Å; F322-H324 PolarHBondContact O-N 2.87Å; F322-L325 PolarHBondContact O-N 2.66Å; F322-L325 VanDerWaalsContact O-N 3.15Å; F322-A326 HydrophobicContact CE1-CB 4.44Å; F322-A326 HydrophobicContact CZ-CB 4.45Å; F322-A326 VanDerWaalsContact O-CB 3.26Å; F322-A326 WeakPolarHBondContact O-CB 3.44Å; F322-A326 PolarHBondContact O-N 3.21Å
323	D	79.8	Confident	77.7	Confident	8 Å²	8	21.3 Å²	21.3	4%	0.043	11%	0.107	C	C	.	.	H	α-helix	trans	-56.7	-44.3	-179.3	-179	50.6	0	0	0	111.7	Y284 C319 L320 T327	Y284-D323 PolarHBondContact OH-OD1 3.49Å; C319-D323 WeakPolarHBondContact O-CB 3.41Å; C319-D323 PolarHBondContact O-N 2.97Å; L320-D323 PolarHBondContact O-N 2.76Å; D323-T327 WeakPolarHBondContact O-CG2 3.48Å; D323-T327 PolarHBondContact O-N 3.19Å; D323-T327 VanDerWaalsContact O-N 3.12Å; D323-T327 PolarHBondContact O-OG1 2.73Å
324	H	80.3	Confident	79.3	Confident	10 Å²	10	20 Å²	20	5%	0.046	11%	0.106	C	C	.	.	H	α-helix	trans	-67.6	-42.1	178.5	-51.3	167.2	0	0	0	111.5	F2 Y192 L320 I321 F322 T327 L328	F2-H324 AromaticContact CD1-CE1 3.92Å; F2-H324 AromaticContact CD2-CE1 3.18Å; F2-H324 WeakPolarHBondContact CD2-CE1 3.45Å; F2-H324 AromaticContact CD2-ND1 4Å; F2-H324 AromaticContact CD2-NE2 3.26Å; F2-H324 VanDerWaalsContact CD2-NE2 3.26Å; F2-H324 WeakPolarHBondContact CD2-NE2 3.12Å; F2-H324 AromaticContact CE1-CE1 3.72Å; F2-H324 AromaticContact CE1-CG 3.96Å; F2-H324 AromaticContact CE1-ND1 3.54Å; F2-H324 AromaticContact CE2-CD2 3.21Å; F2-H324 WeakPolarHBondContact CE2-CD2 3.27Å; F2-H324 AromaticContact CE2-CE1 3.03Å; F2-H324 WeakPolarHBondContact CE2-CE1 3.43Å; F2-H324 AromaticContact CE2-CG 3.69Å; F2-H324 AromaticContact CE2-ND1 3.56Å; F2-H324 AromaticContact CE2-NE2 2.8Å; F2-H324 WeakPolarHBondContact CE2-NE2 3.41Å; F2-H324 AromaticContact CG-CE1 3.66Å; F2-H324 HydrophobicContact CZ-CB 4.2Å; F2-H324 AromaticContact CZ-CD2 3.3Å; F2-H324 WeakPolarHBondContact CZ-CD2 2.96Å; F2-H324 AromaticContact CZ-CE1 3.28Å; F2-H324 WeakPolarHBondContact CZ-CE1 3.29Å; F2-H324 AromaticContact CZ-CG 3.3Å; F2-H324 AromaticContact CZ-ND1 3.26Å; F2-H324 VanDerWaalsContact CZ-ND1 3.26Å; F2-H324 WeakPolarHBondContact CZ-ND1 3.17Å; F2-H324 AromaticContact CZ-NE2 3.34Å; F2-H324 VanDerWaalsContact CZ-NE2 3.34Å; F2-H324 WeakPolarHBondContact CZ-NE2 3.49Å; Y192-H324 HydrophobicContact CE1-CB 4.35Å; Y192-H324 PolarHBondContact OH-ND1 2.62Å; L320-H324 PolarHBondContact O-CD2 3.49Å; L320-H324 PolarHBondContact O-CE1 2.99Å; L320-H324 PolarHBondContact O-N 2.83Å; L320-H324 VanDerWaalsContact O-N 3.08Å; L320-H324 PolarHBondContact O-ND1 2.98Å; L320-H324 PolarHBondContact O-NE2 3.37Å; L320-H324 VanDerWaalsContact O-NE2 3.15Å; I321-H324 PolarHBondContact O-N 2.91Å; F322-H324 VanDerWaalsContact C-N 3.29Å; F322-H324 PolarHBondContact O-N 2.87Å; H324-T327 PolarHBondContact O-OG1 3.37Å; H324-L328 WeakPolarHBondContact O-CG 3.41Å; H324-L328 PolarHBondContact O-N 3.04Å; H324-L328 VanDerWaalsContact O-N 3.13Å
325	L	89.2	Confident	80.9	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-72.5	-34	-178.4	-67.6	175.4	0	0	0	112.1	Y192 I195 L236 L240 I321 F322 L328 C329	Y192-L325 HydrophobicContact CD1-CD2 3.65Å; Y192-L325 HydrophobicContact CE1-CD2 3.98Å; I195-L325 HydrophobicContact CB-CD2 4.06Å; I195-L325 HydrophobicContact CD1-CD1 4.28Å; I195-L325 HydrophobicContact CD1-CD2 3.93Å; I195-L325 HydrophobicContact CG2-CD1 3.8Å; I195-L325 HydrophobicContact CG2-CD2 3.5Å; I195-L325 HydrophobicContact CG2-CG 4.2Å; L236-L325 HydrophobicContact CD2-CD1 4.06Å; L240-L325 HydrophobicContact CD1-CB 3.56Å; L240-L325 HydrophobicContact CD1-CD1 3.56Å; L240-L325 HydrophobicContact CD1-CG 4.19Å; L240-L325 HydrophobicContact CD2-CB 3.66Å; L240-L325 HydrophobicContact CG-CB 4.28Å; I321-L325 HydrophobicContact CG2-CD1 3.54Å; I321-L325 HydrophobicContact CG2-CG 4.29Å; I321-L325 WeakPolarHBondContact O-CB 3.39Å; I321-L325 WeakPolarHBondContact O-CG 3.33Å; I321-L325 PolarHBondContact O-N 2.65Å; F322-L325 PolarHBondContact O-N 2.66Å; F322-L325 VanDerWaalsContact O-N 3.15Å; L325-L328 HydrophobicContact CD2-CD1 4.21Å; L325-L328 PolarHBondContact O-N 2.69Å; L325-C329 PolarHBondContact O-N 3.35Å; L325-C329 PolarHBondContact O-SG 3.46Å
326	A	86	Confident	82.3	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.1	-44.9	175.6	0	0	0	0	0	111	L240 I243 Y284 F322 L328 C329 F330	L240-A326 HydrophobicContact CD2-CB 4.19Å; I243-A326 HydrophobicContact CD1-CB 4.18Å; Y284-A326 HydrophobicContact CD2-CB 4Å; Y284-A326 HydrophobicContact CE2-CB 3.88Å; F322-A326 HydrophobicContact CE1-CB 4.44Å; F322-A326 HydrophobicContact CZ-CB 4.45Å; F322-A326 VanDerWaalsContact O-CB 3.26Å; F322-A326 WeakPolarHBondContact O-CB 3.44Å; F322-A326 PolarHBondContact O-N 3.21Å; A326-L328 VanDerWaalsContact C-N 3.32Å; A326-L328 PolarHBondContact O-N 3.34Å; A326-C329 CarbonylContact O-C 2.92Å; A326-C329 WeakPolarHBondContact O-CA 3.39Å; A326-C329 WeakPolarHBondContact O-CB 3.42Å; A326-C329 PolarHBondContact O-N 3.46Å; A326-C329 VanDerWaalsContact O-N 3.09Å; A326-F330 VanDerWaalsContact O-CG 3.32Å; A326-F330 WeakPolarHBondContact O-CG 3.48Å; A326-F330 PolarHBondContact O-N 2.9Å
327	T	87	Confident	83.3	Confident	10 Å²	10	14.4 Å²	14.4	6%	0.061	8%	0.082	C	C	.	.	H	α-helix	trans	-64.7	-34.4	175.7	47.9	0	0	0	0	113.3	D323 H324 F330 Y331 F348 V356	D323-T327 WeakPolarHBondContact O-CG2 3.48Å; D323-T327 PolarHBondContact O-N 3.19Å; D323-T327 VanDerWaalsContact O-N 3.12Å; D323-T327 PolarHBondContact O-OG1 2.73Å; H324-T327 PolarHBondContact O-OG1 3.37Å; T327-F330 HydrophobicContact CG2-CD2 4.41Å; T327-F330 PolarHBondContact O-N 3.46Å; T327-Y331 PolarHBondContact O-N 3.38Å; T327-Y331 VanDerWaalsContact O-N 3.09Å; T327-F348 HydrophobicContact CG2-CE2 3.51Å; T327-F348 HydrophobicContact CG2-CZ 3.45Å; T327-F348 VanDerWaalsContact CG2-CZ 3.45Å; T327-V356 HydrophobicContact CG2-CG1 3.92Å
328	L	90.7	Very high	84.3	Confident	3 Å²	3	21 Å²	21	2%	0.016	11%	0.107	C	C	.	.	H	α-helix	trans	-67.9	-37.6	170.9	-67.5	170	0	0	0	111.8	Y192 V196 H324 L325 A326 Y331 Q332 L363 L364	Y192-L328 HydrophobicContact CD1-CD1 3.54Å; Y192-L328 HydrophobicContact CE1-CD1 4.19Å; Y192-L328 HydrophobicContact CG-CD1 3.96Å; V196-L328 HydrophobicContact CG2-CB 3.79Å; V196-L328 HydrophobicContact CG2-CD1 4.43Å; H324-L328 WeakPolarHBondContact O-CG 3.41Å; H324-L328 PolarHBondContact O-N 3.04Å; H324-L328 VanDerWaalsContact O-N 3.13Å; L325-L328 HydrophobicContact CD2-CD1 4.21Å; L325-L328 PolarHBondContact O-N 2.69Å; A326-L328 VanDerWaalsContact C-N 3.32Å; A326-L328 PolarHBondContact O-N 3.34Å; L328-Y331 PolarHBondContact O-N 2.89Å; L328-Q332 VanDerWaalsContact O-CB 3.28Å; L328-Q332 WeakPolarHBondContact O-CB 3.42Å; L328-Q332 PolarHBondContact O-N 2.87Å; L328-L363 HydrophobicContact CD2-CB 4.1Å; L328-L363 HydrophobicContact CD2-CD1 4.17Å; L328-L364 HydrophobicContact CB-CD1 4.13Å; L328-L364 HydrophobicContact CD2-CD1 3.95Å; L328-L364 HydrophobicContact CD2-CD2 4.1Å; L328-L364 HydrophobicContact CD2-CG 3.76Å; L328-L364 WeakPolarHBondContact O-CD1 3.43Å
329	C	92.4	Very high	85.2	Confident	2 Å²	2	22.9 Å²	22.9	1%	0.014	12%	0.117	C	C	.	.	H	α-helix	trans	-65.6	-39.5	173.9	-68.9	0	0	0	0	112.1	Y244 L325 A326 Q332 S333	Y244-C329 HydrophobicContact CD2-CB 4.21Å; L325-C329 PolarHBondContact O-N 3.35Å; L325-C329 PolarHBondContact O-SG 3.46Å; A326-C329 CarbonylContact O-C 2.92Å; A326-C329 WeakPolarHBondContact O-CA 3.39Å; A326-C329 WeakPolarHBondContact O-CB 3.42Å; A326-C329 PolarHBondContact O-N 3.46Å; A326-C329 VanDerWaalsContact O-N 3.09Å; C329-Q332 PolarHBondContact O-N 3.03Å; C329-S333 WeakPolarHBondContact O-CB 3.15Å; C329-S333 PolarHBondContact O-N 2.77Å; C329-S333 PolarHBondContact O-OG 3.37Å
330	F	90.9	Very high	86.1	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.009	11%	0.114	C	C	.	.	H	α-helix	trans	-57.3	-56	172.7	-64.1	-27.7	0	0	0	110.5	I243 A247 L280 Y284 A326 T327 Q332 S333 G334 I335 V343 L347	I243-F330 HydrophobicContact CG2-CD1 4.06Å; I243-F330 HydrophobicContact CG2-CE1 3.45Å; I243-F330 VanDerWaalsContact CG2-CE1 3.45Å; I243-F330 HydrophobicContact CG2-CZ 4.17Å; A247-F330 HydrophobicContact CB-CD1 4.02Å; L280-F330 HydrophobicContact CD1-CE1 3.92Å; L280-F330 HydrophobicContact CD2-CD1 4.16Å; L280-F330 HydrophobicContact CD2-CE1 3.93Å; L280-F330 HydrophobicContact CG-CE1 3.96Å; Y284-F330 HydrophobicContact CD2-CE2 4.2Å; Y284-F330 AromaticContact CD2-CZ 3.92Å; Y284-F330 HydrophobicContact CD2-CZ 3.92Å; A326-F330 VanDerWaalsContact O-CG 3.32Å; A326-F330 WeakPolarHBondContact O-CG 3.48Å; A326-F330 PolarHBondContact O-N 2.9Å; T327-F330 HydrophobicContact CG2-CD2 4.41Å; T327-F330 PolarHBondContact O-N 3.46Å; F330-Q332 VanDerWaalsContact C-N 3.31Å; F330-Q332 PolarHBondContact O-N 3.41Å; F330-S333 WeakPolarHBondContact O-CB 3.26Å; F330-S333 PolarHBondContact O-N 2.75Å; F330-G334 PolarHBondContact O-N 3.21Å; F330-I335 CarbonylContact C-O 3.57Å; F330-I335 VanDerWaalsContact C-O 3.23Å; F330-I335 HydrophobicContact CB-CB 4.03Å; F330-I335 HydrophobicContact CB-CG2 4.24Å; F330-I335 WeakPolarHBondContact O-CA 3.29Å; F330-I335 WeakPolarHBondContact O-CB 3.4Å; F330-I335 PolarHBondContact O-N 2.94Å; F330-V343 HydrophobicContact CD2-CG1 4.47Å; F330-V343 HydrophobicContact CE2-CG1 4.3Å; F330-L347 HydrophobicContact CE2-CD1 3.65Å; F330-L347 HydrophobicContact CZ-CD1 4.36Å
331	Y	90.7	Very high	86.9	Confident	54 Å²	54	21.9 Å²	21.9	21%	0.212	11%	0.112	C	C	.	.	H	α-helix	trans	-56.4	-46.6	-179.9	-174.2	-87.6	0	0	0	111.8	T327 L328 S333 G334 I335 T336 E361 L364	T327-Y331 PolarHBondContact O-N 3.38Å; T327-Y331 VanDerWaalsContact O-N 3.09Å; L328-Y331 PolarHBondContact O-N 2.89Å; Y331-S333 VanDerWaalsContact C-N 3.26Å; Y331-S333 PolarHBondContact O-N 3.05Å; Y331-G334 PolarHBondContact O-N 2.92Å; Y331-I335 WeakPolarHBondContact CA-O 3.43Å; Y331-I335 PolarHBondContact N-O 3.26Å; Y331-T336 HydrophobicContact CD2-CG2 4.23Å; Y331-T336 HydrophobicContact CE2-CG2 4.29Å; Y331-E361 HydrophobicContact CE1-CB 4.23Å; Y331-E361 HydrophobicContact CE2-CB 3.95Å; Y331-E361 VanDerWaalsContact OH-CB 3.24Å; Y331-E361 WeakPolarHBondContact OH-CB 3.27Å; Y331-E361 VanDerWaalsContact OH-CG 3.25Å; Y331-E361 WeakPolarHBondContact OH-CG 3.42Å; Y331-L364 HydrophobicContact CD1-CD1 4.02Å
332	Q	90.9	Very high	87.3	Confident	60 Å²	60	24 Å²	24	28%	0.28	12%	0.121	S	C	.	.	H	α-helix	trans	-64.4	-30.6	178.9	-176.8	56.1	27.9	0	0	113.4	V196 V200 Y244 L328 C329 F330 G334 L364 L367	V196-Q332 HydrophobicContact CG1-CB 3.87Å; V196-Q332 HydrophobicContact CG1-CG 3.72Å; V200-Q332 HydrophobicContact CG2-CG 3.74Å; Y244-Q332 HydrophobicContact CE2-CG 4.27Å; L328-Q332 VanDerWaalsContact O-CB 3.28Å; L328-Q332 WeakPolarHBondContact O-CB 3.42Å; L328-Q332 PolarHBondContact O-N 2.87Å; C329-Q332 PolarHBondContact O-N 3.03Å; F330-Q332 VanDerWaalsContact C-N 3.31Å; F330-Q332 PolarHBondContact O-N 3.41Å; Q332-G334 PolarHBondContact O-N 2.99Å; Q332-L364 HydrophobicContact CB-CD1 4.11Å; Q332-L367 HydrophobicContact CG-CD2 4.12Å
333	S	89.9	Confident	87.4	Confident	10 Å²	10	24 Å²	24	7%	0.07	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-3.8	175.1	-52.3	0	0	0	0	112.4	Y244 A247 T248 S251 C329 F330 Y331	Y244-S333 WeakPolarHBondContact CD2-OG 3.19Å; Y244-S333 VanDerWaalsContact CE2-OG 3.23Å; Y244-S333 WeakPolarHBondContact CE2-OG 3.33Å; A247-S333 WeakPolarHBondContact CB-OG 3.42Å; T248-S333 PolarHBondContact OG1-OG 3.41Å; S251-S333 WeakPolarHBondContact CB-O 3.36Å; S251-S333 PolarHBondContact OG-O 3.05Å; C329-S333 WeakPolarHBondContact O-CB 3.15Å; C329-S333 PolarHBondContact O-N 2.77Å; C329-S333 PolarHBondContact O-OG 3.37Å; F330-S333 WeakPolarHBondContact O-CB 3.26Å; F330-S333 PolarHBondContact O-N 2.75Å; Y331-S333 VanDerWaalsContact C-N 3.26Å; Y331-S333 PolarHBondContact O-N 3.05Å
334	G	88.2	Confident	87.4	Confident	32 Å²	32	23.7 Å²	23.7	33%	0.33	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	8.8	-174.2	0	0	0	0	0	113.8	F330 Y331 Q332 N339	F330-G334 PolarHBondContact O-N 3.21Å; Y331-G334 PolarHBondContact O-N 2.92Å; Q332-G334 PolarHBondContact O-N 2.99Å; G334-N339 PolarHBondContact O-ND2 3.46Å
335	I	89.7	Confident	87.5	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.			trans	-85.4	111.6	173.4	-54.4	-59.3	0	0	0	108	A247 L250 L280 F330 Y331 H340 V343 Y344	A247-I335 HydrophobicContact CB-CG1 4.07Å; L250-I335 HydrophobicContact CB-CD1 4.14Å; L250-I335 HydrophobicContact CD2-CD1 3.76Å; L250-I335 HydrophobicContact CG-CD1 3.86Å; L280-I335 HydrophobicContact CD2-CG1 4.49Å; L280-I335 HydrophobicContact CD2-CG2 4.43Å; F330-I335 CarbonylContact C-O 3.57Å; F330-I335 VanDerWaalsContact C-O 3.23Å; F330-I335 HydrophobicContact CB-CB 4.03Å; F330-I335 HydrophobicContact CB-CG2 4.24Å; F330-I335 WeakPolarHBondContact O-CA 3.29Å; F330-I335 WeakPolarHBondContact O-CB 3.4Å; F330-I335 PolarHBondContact O-N 2.94Å; Y331-I335 WeakPolarHBondContact CA-O 3.43Å; Y331-I335 PolarHBondContact N-O 3.26Å; I335-H340 WeakPolarHBondContact CD1-CD2 3.18Å; I335-H340 VanDerWaalsContact CD1-NE2 3.34Å; I335-H340 WeakPolarHBondContact CD1-NE2 3.42Å; I335-H340 HydrophobicContact CG2-CB 3.77Å; I335-V343 HydrophobicContact CG2-CG1 4.41Å; I335-Y344 HydrophobicContact CG2-CE2 4.32Å; I335-Y344 PolarHBondContact O-OH 3.48Å; I335-Y344 VanDerWaalsContact O-OH 3.1Å
336	T	89.7	Confident	86.9	Confident	25 Å²	25	28.3 Å²	28.3	15%	0.153	15%	0.147	C	C	.	.			trans	-126.2	166	-176.7	70.5	0	0	0	0	110.4	Y331 Y338 N339 H340 N357	Y331-T336 HydrophobicContact CD2-CG2 4.23Å; Y331-T336 HydrophobicContact CE2-CG2 4.29Å; T336-Y338 PolarHBondContact O-N 2.89Å; T336-Y338 VanDerWaalsContact O-N 3.13Å; T336-Y338 PolarHBondContact OG1-N 2.68Å; T336-N339 WeakPolarHBondContact CA-OD1 3.26Å; T336-N339 PolarHBondContact N-OD1 3.08Å; T336-N339 PolarHBondContact O-N 3.35Å; T336-N339 PolarHBondContact O-OD1 2.85Å; T336-N339 PolarHBondContact OG1-N 2.84Å; T336-N339 PolarHBondContact OG1-OD1 3.37Å; T336-H340 CarbonylContact O-C 3.51Å; T336-H340 PolarHBondContact O-N 3.03Å; T336-N357 VanDerWaalsContact CB-OD1 3.27Å; T336-N357 WeakPolarHBondContact CB-OD1 3.35Å
337	V	83.9	Confident	86.5	Confident	11 Å²	11	29.9 Å²	29.9	7%	0.067	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.7	174.1	67.8	0	0	0	0	112.6	P341 Y344 N357	V337-P341 VanDerWaalsContact O-CA 3.3Å; V337-P341 WeakPolarHBondContact O-CA 3.48Å; V337-P341 WeakPolarHBondContact O-CB 3.38Å; V337-Y344 HydrophobicContact CB-CD1 4.28Å; V337-Y344 HydrophobicContact CB-CD2 4.31Å; V337-Y344 HydrophobicContact CB-CG 4.06Å; V337-Y344 HydrophobicContact CG2-CG 4.42Å; V337-N357 HydrophobicContact CB-CB 4.34Å; V337-N357 HydrophobicContact CG1-CB 3.76Å
338	Y	87.3	Confident	86	Confident	152 Å²	152	30 Å²	30	60%	0.596	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-31	-174.4	-55.1	-63.6	0	0	0	113.8	T336 N357	T336-Y338 PolarHBondContact O-N 2.89Å; T336-Y338 VanDerWaalsContact O-N 3.13Å; T336-Y338 PolarHBondContact OG1-N 2.68Å; Y338-N357 WeakPolarHBondContact CE2-ND2 3.16Å
339	N	87.3	Confident	85.2	Confident	40 Å²	40	32.7 Å²	32.7	21%	0.214	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-22	-179.9	63.4	-12.9	0	0	0	113.7	L255 Y271 G334 T336 P341	L255-N339 HydrophobicContact CD1-CB 4.25Å; Y271-N339 PolarHBondContact OH-O 3.24Å; Y271-N339 VanDerWaalsContact OH-O 3.04Å; G334-N339 PolarHBondContact O-ND2 3.46Å; T336-N339 WeakPolarHBondContact CA-OD1 3.26Å; T336-N339 PolarHBondContact N-OD1 3.08Å; T336-N339 PolarHBondContact O-N 3.35Å; T336-N339 PolarHBondContact O-OD1 2.85Å; T336-N339 PolarHBondContact OG1-N 2.84Å; T336-N339 PolarHBondContact OG1-OD1 3.37Å; N339-P341 VanDerWaalsContact C-CD 3.44Å
340	H	87.2	Confident	84.1	Confident	11 Å²	11	38.5 Å²	38.5	5%	0.051	20%	0.2	C	C	.	.			trans	-131.7	61.8	172.7	-64.2	-86.3	0	0	0	110.3	D277 I335 T336 F342 V343	D277-H340 IonicContact OD1-CE1 3.78Å; D277-H340 IonicContact OD1-ND1 2.9Å; D277-H340 PolarHBondContact OD1-ND1 2.9Å; D277-H340 IonicContact OD2-ND1 3.53Å; I335-H340 WeakPolarHBondContact CD1-CD2 3.18Å; I335-H340 VanDerWaalsContact CD1-NE2 3.34Å; I335-H340 WeakPolarHBondContact CD1-NE2 3.42Å; I335-H340 HydrophobicContact CG2-CB 3.77Å; T336-H340 CarbonylContact O-C 3.51Å; T336-H340 PolarHBondContact O-N 3.03Å; H340-F342 PolarHBondContact O-N 3.48Å; H340-V343 HydrophobicContact CB-CB 4.31Å; H340-V343 HydrophobicContact CB-CG2 3.99Å; H340-V343 PolarHBondContact O-N 3.29Å
341	P	85.4	Confident	83	Confident	22 Å²	22	46 Å²	46	14%	0.143	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-35	-178.7	22.9	-33.5	0	0	0	112.1	Y271 V337 N339 V343 Y344 H345	Y271-P341 HydrophobicContact CD1-CG 3.87Å; Y271-P341 HydrophobicContact CD2-CG 3.94Å; Y271-P341 HydrophobicContact CE1-CG 3.8Å; Y271-P341 HydrophobicContact CE2-CG 3.86Å; Y271-P341 HydrophobicContact CG-CG 3.94Å; V337-P341 VanDerWaalsContact O-CA 3.3Å; V337-P341 WeakPolarHBondContact O-CA 3.48Å; V337-P341 WeakPolarHBondContact O-CB 3.38Å; N339-P341 VanDerWaalsContact C-CD 3.44Å; P341-V343 PolarHBondContact O-N 2.99Å; P341-Y344 PolarHBondContact O-N 3.05Å; P341-H345 VanDerWaalsContact O-CB 3.31Å; P341-H345 WeakPolarHBondContact O-CB 3.41Å; P341-H345 PolarHBondContact O-CD2 3.33Å; P341-H345 PolarHBondContact O-N 3.01Å
342	F	85.2	Confident	81.8	Confident	52 Å²	52	45.1 Å²	45.1	23%	0.228	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-45.4	179.1	179.3	-95.3	0	0	0	112.5	Q273 D277 V281 H340 Y344 H345 A346	Q273-F342 HydrophobicContact CG-CD2 4.4Å; Q273-F342 HydrophobicContact CG-CE2 4.1Å; Q273-F342 HydrophobicContact CG-CZ 4.48Å; D277-F342 HydrophobicContact CB-CD1 3.88Å; V281-F342 HydrophobicContact CG2-CD1 4.43Å; V281-F342 HydrophobicContact CG2-CE1 4.18Å; H340-F342 PolarHBondContact O-N 3.48Å; F342-Y344 VanDerWaalsContact C-N 3.31Å; F342-Y344 PolarHBondContact O-N 3.39Å; F342-H345 PolarHBondContact O-N 3.19Å; F342-A346 VanDerWaalsContact O-CB 3.29Å; F342-A346 WeakPolarHBondContact O-CB 3.38Å; F342-A346 PolarHBondContact O-N 3.47Å
343	V	83.1	Confident	81	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-46.8	179.3	176.9	0	0	0	0	110.3	D277 L280 V281 F330 I335 H340 P341 L347	D277-V343 HydrophobicContact CB-CG2 3.99Å; L280-V343 HydrophobicContact CD2-CG1 4.23Å; L280-V343 HydrophobicContact CD2-CG2 4.28Å; V281-V343 HydrophobicContact CG2-CB 4.42Å; V281-V343 HydrophobicContact CG2-CG1 4.33Å; V281-V343 HydrophobicContact CG2-CG2 4.36Å; F330-V343 HydrophobicContact CD2-CG1 4.47Å; F330-V343 HydrophobicContact CE2-CG1 4.3Å; I335-V343 HydrophobicContact CG2-CG1 4.41Å; H340-V343 HydrophobicContact CB-CB 4.31Å; H340-V343 HydrophobicContact CB-CG2 3.99Å; H340-V343 PolarHBondContact O-N 3.29Å; P341-V343 PolarHBondContact O-N 2.99Å; V343-L347 HydrophobicContact CG1-CD1 4.49Å; V343-L347 VanDerWaalsContact O-CG 3.32Å; V343-L347 WeakPolarHBondContact O-CG 3.36Å; V343-L347 PolarHBondContact O-N 3.05Å
344	Y	81	Confident	80.3	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-69.9	-42.1	179.7	-81.6	-99.9	0	0	0	112.4	I335 V337 P341 F342 A346 L347 F348 S353 V356	I335-Y344 HydrophobicContact CG2-CE2 4.32Å; I335-Y344 PolarHBondContact O-OH 3.48Å; I335-Y344 VanDerWaalsContact O-OH 3.1Å; V337-Y344 HydrophobicContact CB-CD1 4.28Å; V337-Y344 HydrophobicContact CB-CD2 4.31Å; V337-Y344 HydrophobicContact CB-CG 4.06Å; V337-Y344 HydrophobicContact CG2-CG 4.42Å; P341-Y344 PolarHBondContact O-N 3.05Å; F342-Y344 VanDerWaalsContact C-N 3.31Å; F342-Y344 PolarHBondContact O-N 3.39Å; Y344-A346 VanDerWaalsContact C-N 3.31Å; Y344-A346 PolarHBondContact O-N 2.86Å; Y344-L347 PolarHBondContact O-N 3.46Å; Y344-L347 VanDerWaalsContact O-N 3.15Å; Y344-F348 HydrophobicContact CD1-CD2 4.3Å; Y344-F348 WeakPolarHBondContact O-CA 3.16Å; Y344-F348 WeakPolarHBondContact O-CB 3.39Å; Y344-F348 PolarHBondContact O-N 3.46Å; Y344-S353 PolarHBondContact O-OG 3.45Å; Y344-V356 HydrophobicContact CD1-CB 4.49Å; Y344-V356 HydrophobicContact CD1-CG1 4.45Å; Y344-V356 HydrophobicContact CE1-CB 4.21Å; Y344-V356 HydrophobicContact CE1-CG1 3.83Å
345	H	81.5	Confident	79.6	Confident	71 Å²	71	44.7 Å²	44.7	33%	0.329	23%	0.226	S	C	.	.	H	α-helix	trans	-72.5	-22.3	-179	-64.6	-23.2	0	0	0	113.8	P341 F342 L347 F348 S353	P341-H345 VanDerWaalsContact O-CB 3.31Å; P341-H345 WeakPolarHBondContact O-CB 3.41Å; P341-H345 PolarHBondContact O-CD2 3.33Å; P341-H345 PolarHBondContact O-N 3.01Å; F342-H345 PolarHBondContact O-N 3.19Å; H345-L347 VanDerWaalsContact C-N 3.33Å; H345-F348 CarbonylContact C-O 3.38Å; H345-F348 VanDerWaalsContact CA-O 3.29Å; H345-F348 WeakPolarHBondContact CA-O 3.45Å; H345-S353 PolarHBondContact ND1-OG 2.89Å; H345-S353 VanDerWaalsContact ND1-OG 3.09Å
346	A	77	Confident	78.9	Confident	36 Å²	36	44.8 Å²	44.8	30%	0.298	23%	0.226	S	C	.	.	H	α-helix	trans	-70.4	-32.6	169.7	0	0	0	0	0	111.8	V281 Y285 F342 Y344	V281-A346 HydrophobicContact CG1-CB 4.01Å; V281-A346 HydrophobicContact CG2-CB 4.02Å; Y285-A346 PolarHBondContact OH-O 3.2Å; F342-A346 VanDerWaalsContact O-CB 3.29Å; F342-A346 WeakPolarHBondContact O-CB 3.38Å; F342-A346 PolarHBondContact O-N 3.47Å; Y344-A346 VanDerWaalsContact C-N 3.31Å; Y344-A346 PolarHBondContact O-N 2.86Å
347	L	77.1	Confident	78.5	Confident	32 Å²	32	43.9 Å²	43.9	17%	0.168	22%	0.22	C	C	.	.	H	α-helix	trans	-95.9	-31.6	-175.7	-60.6	177.9	0	0	0	113.1	Y284 Y285 F330 V343 Y344 H345	Y284-L347 HydrophobicContact CD1-CD2 3.51Å; Y284-L347 HydrophobicContact CD2-CD1 4.24Å; Y284-L347 HydrophobicContact CE1-CD2 3.59Å; Y284-L347 HydrophobicContact CE2-CD1 4.32Å; Y284-L347 HydrophobicContact CG-CD1 4.37Å; Y284-L347 HydrophobicContact CG-CD2 4.08Å; Y285-L347 HydrophobicContact CE1-CD2 4.3Å; Y285-L347 HydrophobicContact CE2-CD2 4.49Å; F330-L347 HydrophobicContact CE2-CD1 3.65Å; F330-L347 HydrophobicContact CZ-CD1 4.36Å; V343-L347 HydrophobicContact CG1-CD1 4.49Å; V343-L347 VanDerWaalsContact O-CG 3.32Å; V343-L347 WeakPolarHBondContact O-CG 3.36Å; V343-L347 PolarHBondContact O-N 3.05Å; Y344-L347 PolarHBondContact O-N 3.46Å; Y344-L347 VanDerWaalsContact O-N 3.15Å; H345-L347 VanDerWaalsContact C-N 3.33Å
348	F	77.5	Confident	78.3	Confident	14 Å²	14	45.1 Å²	45.1	6%	0.061	23%	0.226	C	C	.	.	S	Bend	trans	-139.4	157.3	-170.4	-51.2	-67.9	0	0	0	111	T327 Y344 H345 Q352 V356	T327-F348 HydrophobicContact CG2-CE2 3.51Å; T327-F348 HydrophobicContact CG2-CZ 3.45Å; T327-F348 VanDerWaalsContact CG2-CZ 3.45Å; Y344-F348 HydrophobicContact CD1-CD2 4.3Å; Y344-F348 WeakPolarHBondContact O-CA 3.16Å; Y344-F348 WeakPolarHBondContact O-CB 3.39Å; Y344-F348 PolarHBondContact O-N 3.46Å; H345-F348 CarbonylContact C-O 3.38Å; H345-F348 VanDerWaalsContact CA-O 3.29Å; H345-F348 WeakPolarHBondContact CA-O 3.45Å; F348-Q352 HydrophobicContact CB-CB 3.8Å; F348-V356 HydrophobicContact CD1-CG2 4.25Å; F348-V356 HydrophobicContact CD2-CG2 4.01Å; F348-V356 HydrophobicContact CE1-CG2 4.33Å; F348-V356 HydrophobicContact CE2-CG1 4.4Å; F348-V356 HydrophobicContact CE2-CG2 4.1Å; F348-V356 HydrophobicContact CG-CG2 4.09Å; F348-V356 HydrophobicContact CZ-CG2 4.28Å
349	S	72.3	Confident	77.9	Confident	58 Å²	58	38.4 Å²	38.4	41%	0.406	20%	0.2	S	C	.	.			trans	-64.8	165.5	168.1	73.2	0	0	0	0	111.5	E351 Q352 S353	S349-E351 PolarHBondContact O-N 3.35Å; S349-Q352 PolarHBondContact O-N 2.88Å; S349-Q352 VanDerWaalsContact O-N 3.14Å; S349-Q352 WeakPolarHBondContact OG-CB 3.35Å; S349-Q352 VanDerWaalsContact OG-CG 3.23Å; S349-Q352 WeakPolarHBondContact OG-CG 3.38Å; S349-Q352 PolarHBondContact OG-N 2.78Å; S349-Q352 PolarHBondContact OG-OE1 3.31Å; S349-S353 WeakPolarHBondContact O-CB 3.38Å; S349-S353 PolarHBondContact O-N 2.75Å; S349-S353 PolarHBondContact O-OG 2.99Å
350	E	70	Confident	77.8	Confident	124 Å²	124	36.7 Å²	36.7	58%	0.579	19%	0.191	S	C	*	.	H	α-helix	trans	-55.5	-51	179.3	-171.3	177.3	178.9	0	0	112.5	Q352 S353 I354	E350-Q352 VanDerWaalsContact C-N 3.31Å; E350-Q352 PolarHBondContact O-N 2.94Å; E350-S353 WeakPolarHBondContact O-CB 3.38Å; E350-S353 PolarHBondContact O-N 3.38Å; E350-I354 PolarHBondContact O-N 2.83Å
351	E	67.2	Low	77.6	Confident	159 Å²	159	39.3 Å²	39.3	74%	0.743	20%	0.204	S	C	*	.	H	α-helix	trans	-60.1	-39.8	175.6	-65.5	178.3	175.5	0	0	112.7	S349 S355	S349-E351 PolarHBondContact O-N 3.35Å; E351-S355 PolarHBondContact O-N 2.93Å
352	Q	66.9	Low	77.4	Confident	36 Å²	36	38.3 Å²	38.3	17%	0.168	20%	0.197	C	C	.	.	H	α-helix	trans	-68	-38.7	178.3	-74.4	175.4	-28.5	0	0	111.1	F348 S349 E350 I354 S355 V356	F348-Q352 HydrophobicContact CB-CB 3.8Å; S349-Q352 PolarHBondContact O-N 2.88Å; S349-Q352 VanDerWaalsContact O-N 3.14Å; S349-Q352 WeakPolarHBondContact OG-CB 3.35Å; S349-Q352 VanDerWaalsContact OG-CG 3.23Å; S349-Q352 WeakPolarHBondContact OG-CG 3.38Å; S349-Q352 PolarHBondContact OG-N 2.78Å; S349-Q352 PolarHBondContact OG-OE1 3.31Å; E350-Q352 VanDerWaalsContact C-N 3.31Å; E350-Q352 PolarHBondContact O-N 2.94Å; Q352-I354 PolarHBondContact O-N 2.77Å; Q352-S355 CarbonylContact O-C 3.57Å; Q352-S355 WeakPolarHBondContact O-CB 3.5Å; Q352-S355 PolarHBondContact O-N 3.3Å; Q352-S355 VanDerWaalsContact O-N 3.13Å; Q352-V356 VanDerWaalsContact O-CG2 3.29Å; Q352-V356 WeakPolarHBondContact O-CG2 3.28Å; Q352-V356 PolarHBondContact O-N 3.42Å
353	S	72.8	Confident	77.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-46.9	-179.2	-60.3	0	0	0	0	111.5	Y344 H345 S349 E350 S355 V356 N357	Y344-S353 PolarHBondContact O-OG 3.45Å; H345-S353 PolarHBondContact ND1-OG 2.89Å; H345-S353 VanDerWaalsContact ND1-OG 3.09Å; S349-S353 WeakPolarHBondContact O-CB 3.38Å; S349-S353 PolarHBondContact O-N 2.75Å; S349-S353 PolarHBondContact O-OG 2.99Å; E350-S353 WeakPolarHBondContact O-CB 3.38Å; E350-S353 PolarHBondContact O-N 3.38Å; S353-S355 VanDerWaalsContact C-N 3.34Å; S353-S355 PolarHBondContact O-N 3.26Å; S353-V356 PolarHBondContact O-N 2.78Å; S353-N357 WeakPolarHBondContact O-CB 3.27Å; S353-N357 PolarHBondContact O-N 3.42Å
354	I	76.7	Confident	77.2	Confident	72 Å²	72	36.7 Å²	36.7	37%	0.369	19%	0.19	S	C	.	.	H	α-helix	trans	-62.4	-44.4	176.1	-62	170.1	0	0	0	110.3	E350 Q352 N357 N358	E350-I354 PolarHBondContact O-N 2.83Å; Q352-I354 PolarHBondContact O-N 2.77Å; I354-N357 PolarHBondContact O-N 2.86Å; I354-N358 VanDerWaalsContact O-CG 3.31Å; I354-N358 PolarHBondContact O-N 3.42Å; I354-N358 VanDerWaalsContact O-N 3.1Å; I354-N358 PolarHBondContact O-OD1 2.66Å
355	S	73.1	Confident	77	Confident	22 Å²	22	39.8 Å²	39.8	15%	0.154	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-43.9	178.4	-174	0	0	0	0	111.8	F8 E351 Q352 S353 N357 N358 W359	F8-S355 VanDerWaalsContact CE1-C 3.41Å; F8-S355 WeakPolarHBondContact CE1-OG 3.47Å; F8-S355 VanDerWaalsContact CZ-C 3.41Å; F8-S355 WeakPolarHBondContact CZ-O 3.46Å; E351-S355 PolarHBondContact O-N 2.93Å; Q352-S355 CarbonylContact O-C 3.57Å; Q352-S355 WeakPolarHBondContact O-CB 3.5Å; Q352-S355 PolarHBondContact O-N 3.3Å; Q352-S355 VanDerWaalsContact O-N 3.13Å; S353-S355 VanDerWaalsContact C-N 3.34Å; S353-S355 PolarHBondContact O-N 3.26Å; S355-N357 VanDerWaalsContact C-N 3.3Å; S355-N357 PolarHBondContact O-N 3.06Å; S355-N358 PolarHBondContact O-N 3.42Å; S355-W359 VanDerWaalsContact O-CD1 3.29Å; S355-W359 PolarHBondContact O-N 2.98Å
356	V	73.9	Confident	76.4	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-57.4	-48.7	177.6	173.5	0	0	0	0	109	F8 T327 Y344 F348 Q352 S353 N358 W359 S360	F8-V356 HydrophobicContact CB-CG2 4.32Å; F8-V356 HydrophobicContact CD1-CB 4.11Å; F8-V356 HydrophobicContact CD1-CG2 3.09Å; F8-V356 HydrophobicContact CD2-CG2 4.47Å; F8-V356 HydrophobicContact CE1-CB 3.9Å; F8-V356 HydrophobicContact CE1-CG2 3.34Å; F8-V356 HydrophobicContact CG-CG2 3.71Å; F8-V356 HydrophobicContact CZ-CB 4.31Å; F8-V356 HydrophobicContact CZ-CG2 4.13Å; T327-V356 HydrophobicContact CG2-CG1 3.92Å; Y344-V356 HydrophobicContact CD1-CB 4.49Å; Y344-V356 HydrophobicContact CD1-CG1 4.45Å; Y344-V356 HydrophobicContact CE1-CB 4.21Å; Y344-V356 HydrophobicContact CE1-CG1 3.83Å; F348-V356 HydrophobicContact CD1-CG2 4.25Å; F348-V356 HydrophobicContact CD2-CG2 4.01Å; F348-V356 HydrophobicContact CE1-CG2 4.33Å; F348-V356 HydrophobicContact CE2-CG1 4.4Å; F348-V356 HydrophobicContact CE2-CG2 4.1Å; F348-V356 HydrophobicContact CG-CG2 4.09Å; F348-V356 HydrophobicContact CZ-CG2 4.28Å; Q352-V356 VanDerWaalsContact O-CG2 3.29Å; Q352-V356 WeakPolarHBondContact O-CG2 3.28Å; Q352-V356 PolarHBondContact O-N 3.42Å; S353-V356 PolarHBondContact O-N 2.78Å; V356-N358 PolarHBondContact O-N 3.46Å; V356-W359 PolarHBondContact O-N 3.31Å; V356-S360 WeakPolarHBondContact O-CB 3.34Å; V356-S360 PolarHBondContact O-N 2.92Å; V356-S360 PolarHBondContact O-OG 3Å
357	N	81.3	Confident	75.6	Confident	5 Å²	5	34.9 Å²	34.9	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-56.6	-49.6	-179.9	-169.9	83.5	0	0	0	112.2	T336 V337 Y338 S353 I354 S355 W359 S360 E361	T336-N357 VanDerWaalsContact CB-OD1 3.27Å; T336-N357 WeakPolarHBondContact CB-OD1 3.35Å; V337-N357 HydrophobicContact CB-CB 4.34Å; V337-N357 HydrophobicContact CG1-CB 3.76Å; Y338-N357 WeakPolarHBondContact CE2-ND2 3.16Å; S353-N357 WeakPolarHBondContact O-CB 3.27Å; S353-N357 PolarHBondContact O-N 3.42Å; I354-N357 PolarHBondContact O-N 2.86Å; S355-N357 VanDerWaalsContact C-N 3.3Å; S355-N357 PolarHBondContact O-N 3.06Å; N357-W359 VanDerWaalsContact C-N 3.33Å; N357-W359 PolarHBondContact O-N 3.27Å; N357-S360 PolarHBondContact O-N 3.28Å; N357-E361 PolarHBondContact O-N 2.92Å
358	N	79.7	Confident	74.8	Confident	37 Å²	37	36.6 Å²	36.6	20%	0.198	19%	0.194	C	C	.	.	H	α-helix	trans	-65.2	-36.3	-179.4	-65.5	-5.8	0	0	0	112.5	Y103 I354 S355 V356 F362	Y103-N358 HydrophobicContact CD2-CB 3.92Å; Y103-N358 HydrophobicContact CE2-CB 4.24Å; I354-N358 VanDerWaalsContact O-CG 3.31Å; I354-N358 PolarHBondContact O-N 3.42Å; I354-N358 VanDerWaalsContact O-N 3.1Å; I354-N358 PolarHBondContact O-OD1 2.66Å; S355-N358 PolarHBondContact O-N 3.42Å; V356-N358 PolarHBondContact O-N 3.46Å; N358-F362 WeakPolarHBondContact O-CB 3.17Å; N358-F362 PolarHBondContact O-N 2.9Å
359	W	79.2	Confident	73.9	Confident	11 Å²	11	38.3 Å²	38.3	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-72.3	-37.3	176	-86.2	94.1	0	0	0	112.3	I6 F8 L107 F185 S355 V356 N357 F362 L363	I6-W359 HydrophobicContact CD1-CE3 4.11Å; I6-W359 HydrophobicContact CD1-CH2 3.48Å; I6-W359 VanDerWaalsContact CD1-CH2 3.48Å; I6-W359 HydrophobicContact CD1-CZ2 4.22Å; I6-W359 HydrophobicContact CD1-CZ3 3.43Å; I6-W359 VanDerWaalsContact CD1-CZ3 3.43Å; I6-W359 HydrophobicContact CG1-CH2 3.63Å; I6-W359 HydrophobicContact CG1-CZ2 3.87Å; I6-W359 HydrophobicContact CG1-CZ3 4.01Å; I6-W359 HydrophobicContact CG2-CD2 3.77Å; I6-W359 HydrophobicContact CG2-CE3 3.98Å; I6-W359 HydrophobicContact CG2-CG 4.29Å; I6-W359 HydrophobicContact CG2-CH2 4.34Å; I6-W359 HydrophobicContact CG2-CZ2 4.14Å; I6-W359 HydrophobicContact CG2-CZ3 4.27Å; F8-W359 HydrophobicContact CE2-CB 3.56Å; F8-W359 AromaticContact CE2-CD1 3.78Å; F8-W359 AromaticContact CE2-CG 3.63Å; F8-W359 HydrophobicContact CE2-CG 3.63Å; F8-W359 HydrophobicContact CZ-CB 3.67Å; F8-W359 AromaticContact CZ-CD1 3.34Å; F8-W359 AromaticContact CZ-CG 3.63Å; F8-W359 HydrophobicContact CZ-CG 3.63Å; L107-W359 HydrophobicContact CD1-CH2 4.39Å; F185-W359 HydrophobicContact CE2-CZ3 4.41Å; F185-W359 HydrophobicContact CZ-CZ3 4.25Å; S355-W359 VanDerWaalsContact O-CD1 3.29Å; S355-W359 PolarHBondContact O-N 2.98Å; V356-W359 PolarHBondContact O-N 3.31Å; N357-W359 VanDerWaalsContact C-N 3.33Å; N357-W359 PolarHBondContact O-N 3.27Å; W359-F362 AromaticContact CE3-CD1 3.79Å; W359-F362 HydrophobicContact CE3-CD1 3.79Å; W359-F362 HydrophobicContact CE3-CE1 4.46Å; W359-F362 AromaticContact CZ3-CD1 3.63Å; W359-F362 HydrophobicContact CZ3-CD1 3.63Å; W359-F362 AromaticContact CZ3-CE1 3.83Å; W359-F362 HydrophobicContact CZ3-CE1 3.83Å; W359-F362 PolarHBondContact O-N 3.12Å; W359-L363 HydrophobicContact CE3-CG 4.49Å; W359-L363 VanDerWaalsContact O-CB 3.31Å; W359-L363 WeakPolarHBondContact O-CB 3.43Å; W359-L363 VanDerWaalsContact O-CG 3.24Å; W359-L363 WeakPolarHBondContact O-CG 3.38Å; W359-L363 PolarHBondContact O-N 3.16Å
360	S	85.6	Confident	73.3	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-45.9	173.2	-68.8	0	0	0	0	111.3	V356 N357 F362 L363 L364	V356-S360 WeakPolarHBondContact O-CB 3.34Å; V356-S360 PolarHBondContact O-N 2.92Å; V356-S360 PolarHBondContact O-OG 3Å; N357-S360 PolarHBondContact O-N 3.28Å; S360-F362 PolarHBondContact O-N 3.46Å; S360-L363 PolarHBondContact O-N 2.82Å; S360-L364 WeakPolarHBondContact O-CB 3.41Å; S360-L364 WeakPolarHBondContact O-CG 3.47Å; S360-L364 PolarHBondContact O-N 3.03Å
361	E	83.9	Confident	72.5	Confident	67 Å²	67	35 Å²	35	31%	0.313	19%	0.189	S	C	.	.	H	α-helix	trans	-55.8	-51.7	172.5	-177.3	179.5	-177.4	0	0	111.2	Y331 N357 L363 L364 K365	Y331-E361 HydrophobicContact CE1-CB 4.23Å; Y331-E361 HydrophobicContact CE2-CB 3.95Å; Y331-E361 VanDerWaalsContact OH-CB 3.24Å; Y331-E361 WeakPolarHBondContact OH-CB 3.27Å; Y331-E361 VanDerWaalsContact OH-CG 3.25Å; Y331-E361 WeakPolarHBondContact OH-CG 3.42Å; N357-E361 PolarHBondContact O-N 2.92Å; E361-L363 PolarHBondContact O-N 3.08Å; E361-L364 PolarHBondContact O-N 2.67Å; E361-K365 WeakPolarHBondContact O-CB 3.35Å; E361-K365 PolarHBondContact O-N 2.95Å
362	F	80.5	Confident	72.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-45.8	-177.9	176.1	-122	0	0	0	112.4	P59 Y63 L107 F185 R189 N358 W359 S360	P59-F362 HydrophobicContact CB-CB 4.21Å; P59-F362 HydrophobicContact CB-CD2 3.59Å; P59-F362 HydrophobicContact CB-CE2 4.35Å; P59-F362 HydrophobicContact CB-CG 4.23Å; Y63-F362 HydrophobicContact CD1-CZ 4.4Å; Y63-F362 HydrophobicContact CD2-CZ 4.43Å; Y63-F362 HydrophobicContact CG-CZ 4.09Å; L107-F362 HydrophobicContact CD1-CE1 4.13Å; L107-F362 HydrophobicContact CD1-CZ 4.19Å; F185-F362 AromaticContact CE1-CE1 3.81Å; F185-F362 HydrophobicContact CE1-CE1 3.81Å; F185-F362 HydrophobicContact CE1-CZ 4.03Å; F185-F362 HydrophobicContact CZ-CD1 4.45Å; F185-F362 AromaticContact CZ-CE1 3.55Å; F185-F362 HydrophobicContact CZ-CE1 3.55Å; F185-F362 HydrophobicContact CZ-CZ 4.24Å; R189-F362 VanDerWaalsContact CZ-O 3.25Å; R189-F362 PolarHBondContact NE-O 3.31Å; R189-F362 PolarHBondContact NH2-O 2.81Å; N358-F362 WeakPolarHBondContact O-CB 3.17Å; N358-F362 PolarHBondContact O-N 2.9Å; W359-F362 AromaticContact CE3-CD1 3.79Å; W359-F362 HydrophobicContact CE3-CD1 3.79Å; W359-F362 HydrophobicContact CE3-CE1 4.46Å; W359-F362 AromaticContact CZ3-CD1 3.63Å; W359-F362 HydrophobicContact CZ3-CD1 3.63Å; W359-F362 AromaticContact CZ3-CE1 3.83Å; W359-F362 HydrophobicContact CZ3-CE1 3.83Å; W359-F362 PolarHBondContact O-N 3.12Å; S360-F362 PolarHBondContact O-N 3.46Å
363	L	81.4	Confident	73.1	Confident	11 Å²	11	28.4 Å²	28.4	6%	0.058	16%	0.161	C	C	.	.	H	α-helix	trans	-65	-43.3	-179.2	-73.1	172.9	0	0	0	111.3	R189 Y192 C193 L328 W359 S360 E361 P366	R189-L363 HydrophobicContact CB-CD2 4.33Å; R189-L363 HydrophobicContact CG-CD2 4.07Å; Y192-L363 HydrophobicContact CD2-CD1 4.27Å; Y192-L363 HydrophobicContact CD2-CD2 4.15Å; Y192-L363 HydrophobicContact CE2-CD1 4.48Å; C193-L363 PolarHBondContact SG-O 2.84Å; L328-L363 HydrophobicContact CD2-CB 4.1Å; L328-L363 HydrophobicContact CD2-CD1 4.17Å; W359-L363 HydrophobicContact CE3-CG 4.49Å; W359-L363 VanDerWaalsContact O-CB 3.31Å; W359-L363 WeakPolarHBondContact O-CB 3.43Å; W359-L363 VanDerWaalsContact O-CG 3.24Å; W359-L363 WeakPolarHBondContact O-CG 3.38Å; W359-L363 PolarHBondContact O-N 3.16Å; S360-L363 PolarHBondContact O-N 2.82Å; E361-L363 PolarHBondContact O-N 3.08Å; L363-P366 VanDerWaalsContact O-CD 3.26Å; L363-P366 WeakPolarHBondContact O-CD 3.39Å
364	L	82.3	Confident	73.1	Confident	8 Å²	8	29.9 Å²	29.9	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-88.8	-4.2	-176.9	-59.5	-179.4	0	0	0	114.7	V196 L328 Y331 Q332 S360 E361 P366 L367	V196-L364 HydrophobicContact CB-CD2 3.98Å; V196-L364 HydrophobicContact CG1-CD1 4.37Å; V196-L364 HydrophobicContact CG1-CD2 4.22Å; V196-L364 HydrophobicContact CG2-CD2 3.8Å; L328-L364 HydrophobicContact CB-CD1 4.13Å; L328-L364 HydrophobicContact CD2-CD1 3.95Å; L328-L364 HydrophobicContact CD2-CD2 4.1Å; L328-L364 HydrophobicContact CD2-CG 3.76Å; L328-L364 WeakPolarHBondContact O-CD1 3.43Å; Y331-L364 HydrophobicContact CD1-CD1 4.02Å; Q332-L364 HydrophobicContact CB-CD1 4.11Å; S360-L364 WeakPolarHBondContact O-CB 3.41Å; S360-L364 WeakPolarHBondContact O-CG 3.47Å; S360-L364 PolarHBondContact O-N 3.03Å; E361-L364 PolarHBondContact O-N 2.67Å; L364-P366 VanDerWaalsContact C-N 3.28Å; L364-P366 VanDerWaalsContact O-N 3.15Å; L364-L367 HydrophobicContact CB-CB 4.36Å; L364-L367 HydrophobicContact CD2-CD1 4.49Å; L364-L367 WeakPolarHBondContact O-CA 2.91Å; L364-L367 WeakPolarHBondContact O-CB 3.44Å; L364-L367 PolarHBondContact O-N 3.14Å
365	K	76.4	Confident	72.9	Confident	67 Å²	67	27.5 Å²	27.5	29%	0.291	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-49.4	-39.8	175.9	-168.8	167.9	-174.3	163.1	0	114.3	E361 L367	E361-K365 WeakPolarHBondContact O-CB 3.35Å; E361-K365 PolarHBondContact O-N 2.95Å; K365-L367 PolarHBondContact O-N 3.3Å
366	P	69	Low	72.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-72.3	-10.4	176	-15.6	32.3	0	0	0	114.3	Y145 L363 L364 A368 N369	Y145-P366 HydrophobicContact CE2-CB 3.63Å; L363-P366 VanDerWaalsContact O-CD 3.26Å; L363-P366 WeakPolarHBondContact O-CD 3.39Å; L364-P366 VanDerWaalsContact C-N 3.28Å; L364-P366 VanDerWaalsContact O-N 3.15Å; P366-A368 PolarHBondContact O-N 3.1Å; P366-N369 WeakPolarHBondContact O-CB 3.46Å; P366-N369 PolarHBondContact O-N 2.55Å; P366-N369 VanDerWaalsContact O-N 3.13Å; P366-N369 PolarHBondContact O-ND2 3.38Å
367	L	61.9	Low	72.8	Confident	4 Å²	4	29.5 Å²	29.5	2%	0.021	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-61.6	-27.8	-178.1	-162.4	86.3	0	0	0	112.5	C193 V196 Q332 L364 K365 N369 F370	C193-L367 HydrophobicContact CB-CD1 4.06Å; C193-L367 WeakPolarHBondContact O-CD1 3.34Å; V196-L367 HydrophobicContact CB-CD1 4.26Å; V196-L367 HydrophobicContact CG1-CD1 4.34Å; V196-L367 HydrophobicContact CG1-CD2 4.08Å; Q332-L367 HydrophobicContact CG-CD2 4.12Å; L364-L367 HydrophobicContact CB-CB 4.36Å; L364-L367 HydrophobicContact CD2-CD1 4.49Å; L364-L367 WeakPolarHBondContact O-CA 2.91Å; L364-L367 WeakPolarHBondContact O-CB 3.44Å; L364-L367 PolarHBondContact O-N 3.14Å; K365-L367 PolarHBondContact O-N 3.3Å; L367-N369 PolarHBondContact O-N 3.47Å; L367-F370 WeakPolarHBondContact O-CB 3.47Å; L367-F370 PolarHBondContact O-N 2.87Å
368	A	58.8	Low	72.2	Confident	67 Å²	67	31.3 Å²	31.3	55%	0.554	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-53.7	-19.4	174.1	0	0	0	0	0	113.4	P366 T371	P366-A368 PolarHBondContact O-N 3.1Å; A368-T371 PolarHBondContact O-OG1 2.71Å
369	N	59.7	Low	71.7	Confident	50 Å²	50	30.8 Å²	30.8	27%	0.267	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-97.4	-5.6	-179.8	-53.3	-46.4	0	0	0	113.3	G143 T144 Q149 P366 L367	G143-N369 VanDerWaalsContact C-ND2 3.29Å; G143-N369 PolarHBondContact O-ND2 3.02Å; T144-N369 VanDerWaalsContact CA-ND2 3.26Å; T144-N369 WeakPolarHBondContact CA-ND2 3.28Å; T144-N369 VanDerWaalsContact CG2-OD1 3.26Å; T144-N369 WeakPolarHBondContact CG2-OD1 3.41Å; T144-N369 PolarHBondContact N-ND2 3.05Å; Q149-N369 PolarHBondContact NE2-O 3.4Å; P366-N369 WeakPolarHBondContact O-CB 3.46Å; P366-N369 PolarHBondContact O-N 2.55Å; P366-N369 VanDerWaalsContact O-N 3.13Å; P366-N369 PolarHBondContact O-ND2 3.38Å; L367-N369 PolarHBondContact O-N 3.47Å
370	F	59	Low	71	Confident	1 Å²	1	32.5 Å²	32.5	0%	0.004	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-14.4	176.1	-75.3	-77.6	0	0	0	113.5	Y145 Q149 L152 L190 C193 L194 Y206 L367	Y145-F370 HydrophobicContact CD2-CE2 4.23Å; Y145-F370 HydrophobicContact CD2-CZ 4.38Å; Y145-F370 AromaticContact CE2-CE2 3.67Å; Y145-F370 HydrophobicContact CE2-CE2 3.67Å; Y145-F370 HydrophobicContact CE2-CZ 4.09Å; Q149-F370 HydrophobicContact CB-CD1 4.41Å; Q149-F370 HydrophobicContact CB-CE1 4.3Å; Q149-F370 HydrophobicContact CG-CD1 3.86Å; Q149-F370 HydrophobicContact CG-CE1 4.06Å; Q149-F370 VanDerWaalsContact NE2-C 3.33Å; Q149-F370 PolarHBondContact NE2-O 3.48Å; L152-F370 HydrophobicContact CD1-CE1 4.1Å; L152-F370 HydrophobicContact CD1-CZ 3.7Å; L190-F370 HydrophobicContact CD1-CE1 4.45Å; L190-F370 HydrophobicContact CD1-CE2 3.99Å; L190-F370 HydrophobicContact CD1-CZ 3.42Å; L190-F370 VanDerWaalsContact CD1-CZ 3.42Å; C193-F370 HydrophobicContact CB-CD2 4.15Å; C193-F370 HydrophobicContact CB-CE2 3.93Å; L194-F370 HydrophobicContact CD2-CD1 3.96Å; L194-F370 HydrophobicContact CD2-CE1 3.42Å; L194-F370 VanDerWaalsContact CD2-CE1 3.42Å; L194-F370 HydrophobicContact CD2-CZ 3.97Å; L194-F370 HydrophobicContact CG-CE1 4.32Å; L194-F370 HydrophobicContact CG-CZ 4.41Å; Y206-F370 HydrophobicContact CE2-CD1 4.45Å; L367-F370 WeakPolarHBondContact O-CB 3.47Å; L367-F370 PolarHBondContact O-N 2.87Å
371	T	54	Low	69.7	Low	111 Å²	111	35.1 Å²	35.1	68%	0.681	20%	0.203	S	C	*	.			trans	-71.4	0	171.9	74.3	0	0	0	0	109.9	Y201 A368	Y201-T371 HydrophobicContact CE2-CG2 4.35Å; Y201-T371 WeakPolarHBondContact OH-CB 3.39Å; Y201-T371 WeakPolarHBondContact OH-CG2 3.45Å; A368-T371 PolarHBondContact O-OG1 2.71Å

Retrieved 371 of 371 residues in 625.8 ms (Link to these results)

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