A0A087Y8V0_POEFO Loading...

Phospholipid phosphatase 2

AlphaFold DB , UniProt , Accession A0A087Y8V0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 287 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.3	Low	79.6	Confident	174 Å²	174	119.1 Å²	119.1	86%	0.857	55%	0.545	S	S	*	.				0	135.4	0	-71.8	-174.8	-73.6	0	0	107.7	E3	M1-E3 PolarHBondContact O-N 3.37Å
2	P	76.5	Confident	80.4	Confident	79 Å²	79	116.9 Å²	116.9	51%	0.513	55%	0.547	S	S	.	.			trans	-59.2	130.7	178.2	23.6	-31.1	0	0	0	109.3	E4 K5 K6	P2-E4 PolarHBondContact O-N 3.25Å; P2-K5 HydrophobicContact CG-CB 4.18Å; P2-K5 HydrophobicContact CG-CD 3.7Å; P2-K5 HydrophobicContact CG-CG 3.84Å; P2-K5 WeakPolarHBondContact O-CB 3.41Å; P2-K5 PolarHBondContact O-N 3.34Å; P2-K6 PolarHBondContact O-N 2.69Å
3	E	73.3	Confident	81.3	Confident	142 Å²	142	113.2 Å²	113.2	66%	0.664	54%	0.536	S	S	*	.	H	α-helix	trans	-48.8	-30.7	-172.5	-74.8	-62.4	126.3	0	0	113.7	M1 K6 R7	M1-E3 PolarHBondContact O-N 3.37Å; E3-K6 PolarHBondContact O-N 3.35Å; E3-R7 PolarHBondContact O-N 3.27Å
4	E	77.1	Confident	81.9	Confident	102 Å²	102	110.8 Å²	110.8	48%	0.477	53%	0.529	S	S	.	.	H	α-helix	trans	-66.1	-40.8	175.3	-157.1	-167.8	160.1	0	0	113.5	P2 K6 R7 R8	P2-E4 PolarHBondContact O-N 3.25Å; E4-K6 VanDerWaalsContact C-N 3.3Å; E4-K6 PolarHBondContact O-N 3.29Å; E4-R7 PolarHBondContact O-N 3.15Å; E4-R8 WeakPolarHBondContact O-CG 3.35Å; E4-R8 PolarHBondContact O-N 3.46Å; E4-R8 IonicContact OE1-CZ 2.91Å; E4-R8 VanDerWaalsContact OE1-CZ 3.32Å; E4-R8 IonicContact OE1-NE 2.85Å; E4-R8 PolarHBondContact OE1-NE 3.5Å; E4-R8 IonicContact OE1-NH2 2.69Å; E4-R8 PolarHBondContact OE1-NH2 2.89Å
5	K	82.4	Confident	82.5	Confident	143 Å²	143	107.7 Å²	107.7	62%	0.622	52%	0.52	S	S	*	.	H	α-helix	trans	-64.5	-37.3	175.4	-75.8	-174.3	-175.1	-177.9	0	111	P2 L9	P2-K5 HydrophobicContact CG-CB 4.18Å; P2-K5 HydrophobicContact CG-CD 3.7Å; P2-K5 HydrophobicContact CG-CG 3.84Å; P2-K5 WeakPolarHBondContact O-CB 3.41Å; P2-K5 PolarHBondContact O-N 3.34Å; K5-L9 WeakPolarHBondContact O-CB 3.13Å; K5-L9 PolarHBondContact O-N 3.34Å
6	K	82.8	Confident	83.2	Confident	85 Å²	85	107.5 Å²	107.5	37%	0.37	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-44.2	177.2	-170	-179.9	178.7	-174.9	0	111.5	P2 E3 E4 L9 F10	P2-K6 PolarHBondContact O-N 2.69Å; E3-K6 PolarHBondContact O-N 3.35Å; E4-K6 VanDerWaalsContact C-N 3.3Å; E4-K6 PolarHBondContact O-N 3.29Å; K6-L9 WeakPolarHBondContact O-CB 3.37Å; K6-L9 PolarHBondContact O-N 3.47Å; K6-F10 HydrophobicContact CD-CE2 4.24Å; K6-F10 HydrophobicContact CD-CZ 4.44Å; K6-F10 HydrophobicContact CG-CD2 4.35Å; K6-F10 HydrophobicContact CG-CE2 3.68Å; K6-F10 HydrophobicContact CG-CZ 3.93Å; K6-F10 WeakPolarHBondContact O-CD2 3.12Å; K6-F10 WeakPolarHBondContact O-CG 3.44Å; K6-F10 PolarHBondContact O-N 3.18Å; K6-F10 VanDerWaalsContact O-N 3.09Å
7	R	80	Confident	83.9	Confident	164 Å²	164	104.5 Å²	104.5	62%	0.619	51%	0.513	S	S	*	.	H	α-helix	trans	-62.5	-45.4	175.2	-168.2	179	81.5	-155.5	4.6	112.2	E3 E4 L9 F10 I11	E3-R7 PolarHBondContact O-N 3.27Å; E4-R7 PolarHBondContact O-N 3.15Å; R7-L9 VanDerWaalsContact C-N 3.32Å; R7-L9 PolarHBondContact O-N 3.44Å; R7-F10 PolarHBondContact O-N 2.91Å; R7-I11 HydrophobicContact CG-CD1 4.3Å; R7-I11 WeakPolarHBondContact O-CG1 3.39Å; R7-I11 PolarHBondContact O-N 3.1Å; R7-I11 VanDerWaalsContact O-N 3.16Å
8	R	84.3	Confident	84.4	Confident	152 Å²	152	100.6 Å²	100.6	57%	0.574	50%	0.496	S	S	*	.	H	α-helix	trans	-61.7	-41.1	176.4	-71.6	179	-175	-146.4	4.5	111.4	E4 I11 V12	E4-R8 WeakPolarHBondContact O-CG 3.35Å; E4-R8 PolarHBondContact O-N 3.46Å; E4-R8 IonicContact OE1-CZ 2.91Å; E4-R8 VanDerWaalsContact OE1-CZ 3.32Å; E4-R8 IonicContact OE1-NE 2.85Å; E4-R8 PolarHBondContact OE1-NE 3.5Å; E4-R8 IonicContact OE1-NH2 2.69Å; E4-R8 PolarHBondContact OE1-NH2 2.89Å; R8-I11 PolarHBondContact O-N 3.17Å; R8-V12 VanDerWaalsContact O-CG2 3.31Å; R8-V12 WeakPolarHBondContact O-CG2 3.39Å; R8-V12 PolarHBondContact O-N 2.89Å
9	L	88.3	Confident	84.9	Confident	90 Å²	90	102.4 Å²	102.4	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-59.8	-47.2	176.4	179.6	64.1	0	0	0	111.9	K5 K6 R7 I11 V12 V13	K5-L9 WeakPolarHBondContact O-CB 3.13Å; K5-L9 PolarHBondContact O-N 3.34Å; K6-L9 WeakPolarHBondContact O-CB 3.37Å; K6-L9 PolarHBondContact O-N 3.47Å; R7-L9 VanDerWaalsContact C-N 3.32Å; R7-L9 PolarHBondContact O-N 3.44Å; L9-I11 VanDerWaalsContact C-N 3.34Å; L9-I11 PolarHBondContact O-N 3.49Å; L9-V12 PolarHBondContact O-N 3.02Å; L9-V13 HydrophobicContact CD1-CG2 4.39Å; L9-V13 WeakPolarHBondContact O-CG2 3.12Å; L9-V13 PolarHBondContact O-N 3.06Å
10	F	86.3	Confident	85.4	Confident	115 Å²	115	101.4 Å²	101.4	50%	0.504	50%	0.501	S	S	.	.	H	α-helix	trans	-61.7	-41.5	177.8	-65.7	-38.3	0	0	0	112.7	K6 R7 V12 V13 D14	K6-F10 HydrophobicContact CD-CE2 4.24Å; K6-F10 HydrophobicContact CD-CZ 4.44Å; K6-F10 HydrophobicContact CG-CD2 4.35Å; K6-F10 HydrophobicContact CG-CE2 3.68Å; K6-F10 HydrophobicContact CG-CZ 3.93Å; K6-F10 WeakPolarHBondContact O-CD2 3.12Å; K6-F10 WeakPolarHBondContact O-CG 3.44Å; K6-F10 PolarHBondContact O-N 3.18Å; K6-F10 VanDerWaalsContact O-N 3.09Å; R7-F10 PolarHBondContact O-N 2.91Å; F10-V12 VanDerWaalsContact C-N 3.32Å; F10-V12 PolarHBondContact O-N 3.43Å; F10-V13 PolarHBondContact O-N 3.16Å; F10-D14 VanDerWaalsContact O-CG 3.31Å; F10-D14 PolarHBondContact O-N 3.04Å
11	I	86.8	Confident	85.9	Confident	64 Å²	64	97.3 Å²	97.3	33%	0.328	48%	0.483	S	S	.	.	H	α-helix	trans	-61.3	-43	176	-65.8	166.1	0	0	0	111.1	R7 R8 L9 V13 D14 V15 Y99	R7-I11 HydrophobicContact CG-CD1 4.3Å; R7-I11 WeakPolarHBondContact O-CG1 3.39Å; R7-I11 PolarHBondContact O-N 3.1Å; R7-I11 VanDerWaalsContact O-N 3.16Å; R8-I11 PolarHBondContact O-N 3.17Å; L9-I11 VanDerWaalsContact C-N 3.34Å; L9-I11 PolarHBondContact O-N 3.49Å; I11-V13 VanDerWaalsContact C-N 3.34Å; I11-V13 PolarHBondContact O-N 3.14Å; I11-D14 PolarHBondContact O-N 3.5Å; I11-V15 HydrophobicContact CG2-CG2 4.48Å; I11-V15 WeakPolarHBondContact O-CB 3.37Å; I11-V15 VanDerWaalsContact O-CG2 3.28Å; I11-V15 WeakPolarHBondContact O-CG2 3.23Å; I11-V15 PolarHBondContact O-N 3.14Å; I11-Y99 WeakPolarHBondContact CA-OH 3.36Å; I11-Y99 HydrophobicContact CG1-CE1 4.32Å; I11-Y99 HydrophobicContact CG2-CE2 3.98Å
12	V	89.3	Confident	87.6	Confident	93 Å²	93	90.7 Å²	90.7	56%	0.564	46%	0.456	S	S	*	.	H	α-helix	trans	-63.4	-41.9	177.5	170.4	0	0	0	0	111.2	R8 L9 F10 V15 L16	R8-V12 VanDerWaalsContact O-CG2 3.31Å; R8-V12 WeakPolarHBondContact O-CG2 3.39Å; R8-V12 PolarHBondContact O-N 2.89Å; L9-V12 PolarHBondContact O-N 3.02Å; F10-V12 VanDerWaalsContact C-N 3.32Å; F10-V12 PolarHBondContact O-N 3.43Å; V12-V15 PolarHBondContact O-N 3.43Å; V12-L16 WeakPolarHBondContact O-CB 3.41Å; V12-L16 PolarHBondContact O-N 3.17Å
13	V	91.4	Very high	88.5	Confident	68 Å²	68	91.2 Å²	91.2	41%	0.412	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-46.3	176.9	171.6	0	0	0	0	111.1	L9 F10 I11 V15 L16 C17	L9-V13 HydrophobicContact CD1-CG2 4.39Å; L9-V13 WeakPolarHBondContact O-CG2 3.12Å; L9-V13 PolarHBondContact O-N 3.06Å; F10-V13 PolarHBondContact O-N 3.16Å; I11-V13 VanDerWaalsContact C-N 3.34Å; I11-V13 PolarHBondContact O-N 3.14Å; V13-V15 PolarHBondContact O-N 2.73Å; V13-L16 WeakPolarHBondContact O-CB 3.2Å; V13-L16 PolarHBondContact O-N 3.32Å; V13-C17 PolarHBondContact O-N 3.22Å; V13-C17 PolarHBondContact O-SG 2.83Å
14	D	90	Very high	89.4	Confident	80 Å²	80	87.2 Å²	87.2	43%	0.428	44%	0.44	S	S	.	.	H	α-helix	trans	-59.2	-47.1	177.6	-70.5	-17	0	0	0	111.7	F10 I11 L16 C17 V18 Y99	F10-D14 VanDerWaalsContact O-CG 3.31Å; F10-D14 PolarHBondContact O-N 3.04Å; I11-D14 PolarHBondContact O-N 3.5Å; D14-L16 VanDerWaalsContact C-N 3.33Å; D14-L16 PolarHBondContact O-N 3.03Å; D14-C17 WeakPolarHBondContact O-CB 3.46Å; D14-C17 PolarHBondContact O-N 3.24Å; D14-V18 WeakPolarHBondContact O-CG2 3.36Å; D14-V18 PolarHBondContact O-N 3.39Å; D14-Y99 WeakPolarHBondContact CB-OH 3.36Å; D14-Y99 PolarHBondContact OD2-OH 3.37Å
15	V	90.6	Very high	90.1	Very high	65 Å²	65	83.2 Å²	83.2	39%	0.394	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-43.7	177.8	169.7	0	0	0	0	110.6	I11 V12 V13 C17 V18 F19	I11-V15 HydrophobicContact CG2-CG2 4.48Å; I11-V15 WeakPolarHBondContact O-CB 3.37Å; I11-V15 VanDerWaalsContact O-CG2 3.28Å; I11-V15 WeakPolarHBondContact O-CG2 3.23Å; I11-V15 PolarHBondContact O-N 3.14Å; V12-V15 PolarHBondContact O-N 3.43Å; V13-V15 PolarHBondContact O-N 2.73Å; V15-C17 VanDerWaalsContact C-N 3.34Å; V15-C17 PolarHBondContact O-N 3.29Å; V15-V18 PolarHBondContact O-N 3.46Å; V15-F19 HydrophobicContact CG1-CD2 3.81Å; V15-F19 HydrophobicContact CG1-CE2 3.49Å; V15-F19 VanDerWaalsContact CG1-CE2 3.49Å; V15-F19 WeakPolarHBondContact O-CD2 3.15Å; V15-F19 PolarHBondContact O-N 3.36Å; V15-F19 VanDerWaalsContact O-N 3.1Å
16	L	94.1	Very high	90.5	Very high	104 Å²	104	78.5 Å²	78.5	55%	0.545	41%	0.411	S	S	.	.	H	α-helix	trans	-60.5	-43	175.4	-178.8	64.3	0	0	0	111.5	V12 V13 D14 V18 F19 V20	V12-L16 WeakPolarHBondContact O-CB 3.41Å; V12-L16 PolarHBondContact O-N 3.17Å; V13-L16 WeakPolarHBondContact O-CB 3.2Å; V13-L16 PolarHBondContact O-N 3.32Å; D14-L16 VanDerWaalsContact C-N 3.33Å; D14-L16 PolarHBondContact O-N 3.03Å; L16-V18 VanDerWaalsContact C-N 3.32Å; L16-V18 PolarHBondContact O-N 2.98Å; L16-F19 PolarHBondContact O-N 3.31Å; L16-V20 HydrophobicContact CD1-CG2 4.29Å; L16-V20 HydrophobicContact CG-CG2 4.32Å; L16-V20 VanDerWaalsContact O-CG2 3.31Å; L16-V20 WeakPolarHBondContact O-CG2 3.34Å; L16-V20 PolarHBondContact O-N 3.43Å
17	C	94.3	Very high	91	Very high	57 Å²	57	78.8 Å²	78.8	39%	0.385	42%	0.416	S	S	.	.	H	α-helix	trans	-60.3	-39.9	176.7	-73.3	0	0	0	0	112.3	V13 D14 V15 V20 A21 F107	V13-C17 PolarHBondContact O-N 3.22Å; V13-C17 PolarHBondContact O-SG 2.83Å; D14-C17 WeakPolarHBondContact O-CB 3.46Å; D14-C17 PolarHBondContact O-N 3.24Å; V15-C17 VanDerWaalsContact C-N 3.34Å; V15-C17 PolarHBondContact O-N 3.29Å; C17-V20 PolarHBondContact O-N 2.82Å; C17-A21 VanDerWaalsContact O-CB 3.29Å; C17-A21 WeakPolarHBondContact O-CB 3.41Å; C17-A21 PolarHBondContact O-N 3.2Å; C17-F107 HydrophobicContact CB-CE2 4.36Å
18	V	93.9	Very high	91.4	Very high	33 Å²	33	72 Å²	72	20%	0.2	39%	0.392	C	S	.	.	H	α-helix	trans	-61.8	-46.2	174.2	174.6	0	0	0	0	110.9	D14 V15 L16 A21 A22 L106 F107	D14-V18 WeakPolarHBondContact O-CG2 3.36Å; D14-V18 PolarHBondContact O-N 3.39Å; V15-V18 PolarHBondContact O-N 3.46Å; L16-V18 VanDerWaalsContact C-N 3.32Å; L16-V18 PolarHBondContact O-N 2.98Å; V18-A21 PolarHBondContact O-N 2.96Å; V18-A22 PolarHBondContact O-N 3.02Å; V18-A22 VanDerWaalsContact O-N 3.09Å; V18-L106 HydrophobicContact CG1-CB 4.25Å; V18-F107 HydrophobicContact CG2-CB 3.99Å; V18-F107 HydrophobicContact CG2-CD2 4.43Å
19	F	93.8	Very high	91.5	Very high	135 Å²	135	69.1 Å²	69.1	59%	0.592	39%	0.391	S	S	*	.	H	α-helix	trans	-61.4	-48.5	177	-78.2	-66.8	0	0	0	111.6	V15 L16 A21 A22 L23	V15-F19 HydrophobicContact CG1-CD2 3.81Å; V15-F19 HydrophobicContact CG1-CE2 3.49Å; V15-F19 VanDerWaalsContact CG1-CE2 3.49Å; V15-F19 WeakPolarHBondContact O-CD2 3.15Å; V15-F19 PolarHBondContact O-N 3.36Å; V15-F19 VanDerWaalsContact O-N 3.1Å; L16-F19 PolarHBondContact O-N 3.31Å; F19-A21 VanDerWaalsContact C-N 3.29Å; F19-A21 PolarHBondContact O-N 2.64Å; F19-A22 CarbonylContact O-C 3.51Å; F19-A22 PolarHBondContact O-N 3.42Å; F19-L23 WeakPolarHBondContact O-CG 3.24Å; F19-L23 PolarHBondContact O-N 3.5Å
20	V	95.5	Very high	91.3	Very high	82 Å²	82	71.4 Å²	71.4	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-58.6	-41.9	178	171.8	0	0	0	0	111.3	L16 C17 A22 L23 P24	L16-V20 HydrophobicContact CD1-CG2 4.29Å; L16-V20 HydrophobicContact CG-CG2 4.32Å; L16-V20 VanDerWaalsContact O-CG2 3.31Å; L16-V20 WeakPolarHBondContact O-CG2 3.34Å; L16-V20 PolarHBondContact O-N 3.43Å; C17-V20 PolarHBondContact O-N 2.82Å; V20-A22 VanDerWaalsContact C-N 3.26Å; V20-A22 PolarHBondContact O-N 3.5Å; V20-L23 HydrophobicContact CG2-CD1 4.47Å; V20-L23 WeakPolarHBondContact O-CB 3.42Å; V20-L23 PolarHBondContact O-N 3.08Å; V20-P24 WeakPolarHBondContact O-CD 3.4Å
21	A	95.1	Very high	90.8	Very high	16 Å²	16	76.2 Å²	76.2	13%	0.132	42%	0.418	C	S	.	.	H	α-helix	trans	-64.1	-29.4	175.9	0	0	0	0	0	113.1	C17 V18 F19 F107 A110 V111 S114	C17-A21 VanDerWaalsContact O-CB 3.29Å; C17-A21 WeakPolarHBondContact O-CB 3.41Å; C17-A21 PolarHBondContact O-N 3.2Å; V18-A21 PolarHBondContact O-N 2.96Å; F19-A21 VanDerWaalsContact C-N 3.29Å; F19-A21 PolarHBondContact O-N 2.64Å; A21-F107 HydrophobicContact CB-CD2 4.11Å; A21-F107 HydrophobicContact CB-CE2 3.93Å; A21-A110 HydrophobicContact CB-CB 3.91Å; A21-V111 HydrophobicContact CB-CG2 3.98Å; A21-S114 WeakPolarHBondContact O-CB 3.25Å; A21-S114 PolarHBondContact O-OG 2.91Å
22	A	94.9	Very high	90.1	Very high	35 Å²	35	79.1 Å²	79.1	29%	0.289	43%	0.429	S	S	.	.	H	α-helix	trans	-86.2	-17.7	177.9	0	0	0	0	0	113.8	V18 F19 V20 S25 A26 A110	V18-A22 PolarHBondContact O-N 3.02Å; V18-A22 VanDerWaalsContact O-N 3.09Å; F19-A22 CarbonylContact O-C 3.51Å; F19-A22 PolarHBondContact O-N 3.42Å; V20-A22 VanDerWaalsContact C-N 3.26Å; V20-A22 PolarHBondContact O-N 3.5Å; A22-S25 PolarHBondContact O-N 2.89Å; A22-A26 PolarHBondContact O-N 2.9Å; A22-A26 VanDerWaalsContact O-N 3.08Å; A22-A110 HydrophobicContact CB-CB 3.99Å
23	L	93.7	Very high	89.8	Confident	90 Å²	90	83.3 Å²	83.3	47%	0.471	44%	0.439	S	S	.	.	H	α-helix	trans	-55.1	-44.8	-177.1	-74.3	178.3	0	0	0	113.8	F19 V20 S25 A26 I27	F19-L23 WeakPolarHBondContact O-CG 3.24Å; F19-L23 PolarHBondContact O-N 3.5Å; V20-L23 HydrophobicContact CG2-CD1 4.47Å; V20-L23 WeakPolarHBondContact O-CB 3.42Å; V20-L23 PolarHBondContact O-N 3.08Å; L23-S25 PolarHBondContact O-N 3.38Å; L23-A26 PolarHBondContact O-N 2.95Å; L23-I27 HydrophobicContact CB-CD1 4.42Å; L23-I27 WeakPolarHBondContact O-CB 3.21Å; L23-I27 VanDerWaalsContact O-CG1 3.27Å; L23-I27 WeakPolarHBondContact O-CG1 3.49Å; L23-I27 PolarHBondContact O-N 3.12Å
24	P	92.4	Very high	89.5	Confident	58 Å²	58	80.5 Å²	80.5	38%	0.377	42%	0.423	S	S	.	.	H	α-helix	trans	-58.6	-46.4	179.7	-24	33.5	0	0	0	112.5	V20 A26 I27 L28	V20-P24 WeakPolarHBondContact O-CD 3.4Å; P24-A26 PolarHBondContact O-N 3Å; P24-I27 PolarHBondContact O-N 3.36Å; P24-L28 WeakPolarHBondContact O-CB 3.43Å; P24-L28 WeakPolarHBondContact O-CG 3.36Å; P24-L28 PolarHBondContact O-N 2.97Å
25	S	92.4	Very high	89.5	Confident	18 Å²	18	83.6 Å²	83.6	13%	0.126	43%	0.429	C	S	.	.	H	α-helix	trans	-58.8	-46.3	175.1	173.4	0	0	0	0	111.9	A22 L23 L28 T29 S114 D117	A22-S25 PolarHBondContact O-N 2.89Å; L23-S25 PolarHBondContact O-N 3.38Å; S25-L28 PolarHBondContact O-N 3.47Å; S25-T29 WeakPolarHBondContact O-CB 3.43Å; S25-T29 PolarHBondContact O-N 2.89Å; S25-T29 PolarHBondContact O-OG1 2.91Å; S25-S114 PolarHBondContact N-OG 2.71Å; S25-D117 WeakPolarHBondContact CB-OD2 3.3Å; S25-D117 PolarHBondContact OG-OD2 3.46Å
26	A	91.7	Very high	89.4	Confident	44 Å²	44	84.6 Å²	84.6	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-62.7	-47	179.8	0	0	0	0	0	112.2	A22 L23 P24 T29 L30	A22-A26 PolarHBondContact O-N 2.9Å; A22-A26 VanDerWaalsContact O-N 3.08Å; L23-A26 PolarHBondContact O-N 2.95Å; P24-A26 PolarHBondContact O-N 3Å; A26-T29 PolarHBondContact O-N 3.22Å; A26-L30 WeakPolarHBondContact O-CB 3.47Å; A26-L30 VanDerWaalsContact O-CG 3.22Å; A26-L30 WeakPolarHBondContact O-CG 3.29Å; A26-L30 PolarHBondContact O-N 3.22Å
27	I	91.6	Very high	89.3	Confident	92 Å²	92	85.5 Å²	85.5	47%	0.472	43%	0.428	S	S	.	.	H	α-helix	trans	-62.5	-47.4	179.7	-68.3	166.1	0	0	0	110.6	L23 P24 T29 L30 R31	L23-I27 HydrophobicContact CB-CD1 4.42Å; L23-I27 WeakPolarHBondContact O-CB 3.21Å; L23-I27 VanDerWaalsContact O-CG1 3.27Å; L23-I27 WeakPolarHBondContact O-CG1 3.49Å; L23-I27 PolarHBondContact O-N 3.12Å; P24-I27 PolarHBondContact O-N 3.36Å; I27-T29 PolarHBondContact O-N 3.41Å; I27-L30 PolarHBondContact O-N 3.4Å; I27-R31 WeakPolarHBondContact O-CB 3.33Å; I27-R31 PolarHBondContact O-N 2.95Å
28	L	89.1	Confident	89.1	Confident	21 Å²	21	83.2 Å²	83.2	11%	0.11	41%	0.414	C	S	.	.	H	α-helix	trans	-63.3	-43.8	-178.7	-72	171.4	0	0	0	111.5	P24 S25 L30 F32 D117 L118 F121	P24-L28 WeakPolarHBondContact O-CB 3.43Å; P24-L28 WeakPolarHBondContact O-CG 3.36Å; P24-L28 PolarHBondContact O-N 2.97Å; S25-L28 PolarHBondContact O-N 3.47Å; L28-L30 VanDerWaalsContact C-N 3.35Å; L28-L30 PolarHBondContact O-N 2.89Å; L28-F32 HydrophobicContact CD2-CB 4.07Å; L28-F32 HydrophobicContact CD2-CD1 4.44Å; L28-F32 HydrophobicContact CD2-CD2 3.79Å; L28-F32 HydrophobicContact CD2-CE2 4.36Å; L28-F32 HydrophobicContact CD2-CG 3.83Å; L28-F32 WeakPolarHBondContact O-CB 3.45Å; L28-F32 PolarHBondContact O-N 3.1Å; L28-F32 VanDerWaalsContact O-N 3.13Å; L28-D117 HydrophobicContact CD1-CB 4.21Å; L28-L118 HydrophobicContact CD1-CB 4.22Å; L28-L118 HydrophobicContact CD1-CD1 4.45Å; L28-F121 HydrophobicContact CB-CD2 3.7Å; L28-F121 HydrophobicContact CB-CE2 3.92Å; L28-F121 HydrophobicContact CB-CG 4.29Å; L28-F121 HydrophobicContact CD1-CD2 4.38Å; L28-F121 HydrophobicContact CD2-CB 4.12Å; L28-F121 HydrophobicContact CD2-CD2 4.49Å; L28-F121 HydrophobicContact CD2-CG 4.35Å; L28-F121 HydrophobicContact CG-CD2 4.42Å; L28-F121 WeakPolarHBondContact O-CZ 3.32Å
29	T	85.8	Confident	89.2	Confident	91 Å²	91	81.9 Å²	81.9	56%	0.558	41%	0.406	S	S	*	.	H	α-helix	trans	-67.9	-33.4	-180	-54.5	0	0	0	0	112.7	S25 A26 I27	S25-T29 WeakPolarHBondContact O-CB 3.43Å; S25-T29 PolarHBondContact O-N 2.89Å; S25-T29 PolarHBondContact O-OG1 2.91Å; A26-T29 PolarHBondContact O-N 3.22Å; I27-T29 PolarHBondContact O-N 3.41Å
30	L	85.4	Confident	89.2	Confident	138 Å²	138	80.4 Å²	80.4	72%	0.723	40%	0.401	S	S	*	.	H	α-helix	trans	-86	-29.7	-177.2	-70.4	173.4	0	0	0	114.2	A26 I27 L28	A26-L30 WeakPolarHBondContact O-CB 3.47Å; A26-L30 VanDerWaalsContact O-CG 3.22Å; A26-L30 WeakPolarHBondContact O-CG 3.29Å; A26-L30 PolarHBondContact O-N 3.22Å; I27-L30 PolarHBondContact O-N 3.4Å; L28-L30 VanDerWaalsContact C-N 3.35Å; L28-L30 PolarHBondContact O-N 2.89Å
31	R	74.7	Confident	89.1	Confident	216 Å²	216	77 Å²	77	82%	0.815	38%	0.38	S	S	*	.	H	α-helix	trans	-128.8	-17.1	-164.4	-56.8	-65.3	-86.4	-155.8	-7.3	115	I27	I27-R31 WeakPolarHBondContact O-CB 3.33Å; I27-R31 PolarHBondContact O-N 2.95Å
32	F	73.1	Confident	89	Confident	125 Å²	125	81.8 Å²	81.8	55%	0.548	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-97.1	134.3	-172.6	-100.3	-94.4	0	0	0	113.3	L28 F121	L28-F32 HydrophobicContact CD2-CB 4.07Å; L28-F32 HydrophobicContact CD2-CD1 4.44Å; L28-F32 HydrophobicContact CD2-CD2 3.79Å; L28-F32 HydrophobicContact CD2-CE2 4.36Å; L28-F32 HydrophobicContact CD2-CG 3.83Å; L28-F32 WeakPolarHBondContact O-CB 3.45Å; L28-F32 PolarHBondContact O-N 3.1Å; L28-F32 VanDerWaalsContact O-N 3.13Å; F32-F121 HydrophobicContact CB-CD1 3.85Å; F32-F121 HydrophobicContact CB-CE1 4.17Å; F32-F121 HydrophobicContact CB-CG 4.41Å; F32-F121 VanDerWaalsContact O-CE1 3.23Å; F32-F121 WeakPolarHBondContact O-CE1 3.22Å
33	K	82.3	Confident	89	Confident	181 Å²	181	83 Å²	83	79%	0.787	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-83.1	137.6	158.2	-65.3	-179.7	-179.9	179.2	0	107.3
34	P	85.6	Confident	89.1	Confident	10 Å²	10	84.2 Å²	84.2	7%	0.065	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-60.1	153	175.4	21.6	-29.5	0	0	0	111.6	L36 F121 T156 R159 L160	P34-L36 PolarHBondContact O-N 3.16Å; P34-F121 HydrophobicContact CB-CD1 4.34Å; P34-T156 HydrophobicContact CG-CG2 3.9Å; P34-R159 HydrophobicContact CG-CB 4.2Å; P34-L160 HydrophobicContact CB-CD2 3.67Å; P34-L160 HydrophobicContact CG-CD2 4.22Å
35	Y	88.8	Confident	89.2	Confident	145 Å²	145	83.5 Å²	83.5	57%	0.569	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-52.2	126.8	167.7	178.7	-105.9	0	0	0	110.6	R37 F121 T122 G124	Y35-R37 HydrophobicContact CD1-CB 4.15Å; Y35-R37 HydrophobicContact CE1-CB 4.11Å; Y35-R37 PolarHBondContact O-N 2.62Å; Y35-R37 VanDerWaalsContact O-N 3.08Å; Y35-F121 WeakPolarHBondContact CB-O 3.39Å; Y35-F121 PolarHBondContact N-O 3.39Å; Y35-T122 VanDerWaalsContact CB-O 3.28Å; Y35-T122 WeakPolarHBondContact CB-O 3.16Å; Y35-G124 WeakPolarHBondContact O-CA 3.38Å
36	L	90.1	Very high	89.4	Confident	85 Å²	85	82.9 Å²	82.9	45%	0.445	40%	0.4	S	S	.	.			trans	-84.1	85.3	-179.6	-84.9	151.9	0	0	0	109.6	P34	P34-L36 PolarHBondContact O-N 3.16Å
37	R	90.2	Very high	89.6	Confident	123 Å²	123	87 Å²	87	46%	0.464	41%	0.406	S	S	.	.			trans	-73.6	133.4	169.5	-172.3	177.8	173.8	171.8	-1	110.2	Y35 R159	Y35-R37 HydrophobicContact CD1-CB 4.15Å; Y35-R37 HydrophobicContact CE1-CB 4.11Å; Y35-R37 PolarHBondContact O-N 2.62Å; Y35-R37 VanDerWaalsContact O-N 3.08Å; R37-R159 PolarHBondContact O-NH1 2.91Å; R37-R159 VanDerWaalsContact O-NH1 3.12Å
38	G	91.8	Very high	89.8	Confident	9 Å²	9	88.2 Å²	88.2	9%	0.093	41%	0.406	C	S	.	.			trans	-70.5	152.7	171.8	0	0	0	0	0	112.6	Y142 V143	G38-Y142 WeakPolarHBondContact CA-OH 3.31Å; G38-V143 CarbonylContact C-O 3.51Å; G38-V143 WeakPolarHBondContact CA-O 3.33Å
39	I	94.4	Very high	90.1	Very high	6 Å²	6	90.9 Å²	90.9	3%	0.031	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152	-173.3	58	164.3	0	0	0	110.2	I46 P126 F130 L131 Y142 V143 I146	I39-I46 HydrophobicContact CB-CD1 4.08Å; I39-I46 HydrophobicContact CD1-CD1 4.32Å; I39-I46 HydrophobicContact CG2-CD1 4.31Å; I39-P126 HydrophobicContact CG2-CB 4.45Å; I39-P126 HydrophobicContact CG2-CG 3.46Å; I39-P126 VanDerWaalsContact CG2-CG 3.46Å; I39-F130 HydrophobicContact CD1-CD1 3.96Å; I39-F130 HydrophobicContact CD1-CE1 3.4Å; I39-F130 HydrophobicContact CD1-CZ 4.3Å; I39-L131 HydrophobicContact CD1-CD2 4.09Å; I39-Y142 WeakPolarHBondContact O-CA 3.5Å; I39-V143 HydrophobicContact CD1-CG2 4.19Å; I39-V143 HydrophobicContact CG1-CG2 3.7Å; I39-V143 PolarHBondContact N-O 2.99Å; I39-V143 PolarHBondContact O-N 3.4Å; I39-I146 HydrophobicContact CD1-CD1 3.79Å; I39-I146 HydrophobicContact CD1-CG2 4.43Å
40	H	94.7	Very high	90.6	Very high	103 Å²	103	92 Å²	92	48%	0.477	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	131.6	168.9	-64.1	87	0	0	0	108.4	D42 D43 G141 Y142	H40-D42 PolarHBondContact O-N 2.93Å; H40-D43 HydrophobicContact CB-CB 4.24Å; H40-D43 WeakPolarHBondContact O-CB 3.38Å; H40-D43 PolarHBondContact O-N 3.44Å; H40-G141 WeakPolarHBondContact CA-O 3.33Å; H40-Y142 AromaticContact CD2-CD2 3.9Å; H40-Y142 AromaticContact CE1-CD2 3.43Å; H40-Y142 VanDerWaalsContact CE1-CD2 3.43Å; H40-Y142 WeakPolarHBondContact CE1-CD2 3.43Å; H40-Y142 AromaticContact ND1-CD2 3.81Å; H40-Y142 AromaticContact NE2-CD2 3.47Å; H40-Y142 WeakPolarHBondContact NE2-CD2 3.37Å; H40-Y142 AromaticContact NE2-CG 3.96Å
41	C	92.8	Very high	91	Very high	10 Å²	10	91.6 Å²	91.6	7%	0.068	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-26.2	-179.2	-62.3	0	0	0	0	112.9	D43 C139 S140 G141	C41-D43 VanDerWaalsContact C-N 3.27Å; C41-D43 PolarHBondContact O-N 3.49Å; C41-C139 HydrophobicContact CB-CB 3.74Å; C41-C139 WeakPolarHBondContact CB-SG 3.46Å; C41-C139 WeakPolarHBondContact SG-CA 3.46Å; C41-C139 WeakPolarHBondContact SG-CB 3.5Å; C41-C139 CovalentContact SG-SG 2.02Å; C41-C139 PolarHBondContact SG-SG 2.88Å; C41-S140 PolarHBondContact SG-N 3.34Å; C41-G141 PolarHBondContact N-O 3.37Å; C41-G141 PolarHBondContact SG-O 3.34Å
42	D	93.7	Very high	91.9	Very high	118 Å²	118	89.8 Å²	89.8	63%	0.631	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	7.2	178.5	-50.8	-53.5	0	0	0	112.8	H40 E44	H40-D42 PolarHBondContact O-N 2.93Å; D42-E44 PolarHBondContact O-N 3.09Å; D42-E44 VanDerWaalsContact O-N 3.15Å
43	D	95.2	Very high	92.9	Very high	60 Å²	60	86.8 Å²	86.8	32%	0.321	40%	0.396	S	S	.	.			trans	-76.7	100.6	179.4	-175.3	-8.6	0	0	0	111.1	H40 C41 S45 I46 R47	H40-D43 HydrophobicContact CB-CB 4.24Å; H40-D43 WeakPolarHBondContact O-CB 3.38Å; H40-D43 PolarHBondContact O-N 3.44Å; C41-D43 VanDerWaalsContact C-N 3.27Å; C41-D43 PolarHBondContact O-N 3.49Å; D43-S45 VanDerWaalsContact CG-OG 3.25Å; D43-S45 PolarHBondContact O-N 3.37Å; D43-S45 VanDerWaalsContact O-N 3.15Å; D43-S45 VanDerWaalsContact OD1-CB 3.22Å; D43-S45 WeakPolarHBondContact OD1-CB 3.28Å; D43-S45 PolarHBondContact OD1-N 3.46Å; D43-S45 PolarHBondContact OD1-OG 3.49Å; D43-S45 PolarHBondContact OD2-OG 2.88Å; D43-I46 HydrophobicContact CB-CD1 4.14Å; D43-I46 HydrophobicContact CB-CG1 3.88Å; D43-I46 WeakPolarHBondContact O-CG1 3.5Å; D43-I46 PolarHBondContact O-N 3.38Å; D43-R47 WeakPolarHBondContact O-CG 3.33Å
44	E	94.5	Very high	93.6	Very high	116 Å²	116	81.8 Å²	81.8	54%	0.542	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-58.3	-24.9	177.2	-66.2	-56.1	135.9	0	0	113.6	D42 I46 R47 Y48	D42-E44 PolarHBondContact O-N 3.09Å; D42-E44 VanDerWaalsContact O-N 3.15Å; E44-I46 PolarHBondContact O-N 3.01Å; E44-R47 PolarHBondContact O-N 3.4Å; E44-R47 WeakPolarHBondContact OE1-CD 3.39Å; E44-R47 IonicContact OE1-CZ 3.66Å; E44-R47 IonicContact OE1-NE 3.92Å; E44-R47 IonicContact OE1-NH1 2.7Å; E44-R47 PolarHBondContact OE1-NH1 2.94Å; E44-Y48 WeakPolarHBondContact O-CE2 3.4Å
45	S	96	Very high	94	Very high	43 Å²	43	82.1 Å²	82.1	30%	0.301	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-66.6	-20.3	-178.4	75.1	0	0	0	0	113.2	D43 P128	D43-S45 VanDerWaalsContact CG-OG 3.25Å; D43-S45 PolarHBondContact O-N 3.37Å; D43-S45 VanDerWaalsContact O-N 3.15Å; D43-S45 VanDerWaalsContact OD1-CB 3.22Å; D43-S45 WeakPolarHBondContact OD1-CB 3.28Å; D43-S45 PolarHBondContact OD1-N 3.46Å; D43-S45 PolarHBondContact OD1-OG 3.49Å; D43-S45 PolarHBondContact OD2-OG 2.88Å; S45-P128 WeakPolarHBondContact O-CA 3.33Å; S45-P128 WeakPolarHBondContact O-CB 3.44Å
46	I	96.3	Very high	94.3	Very high	4 Å²	4	77.6 Å²	77.6	2%	0.021	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-113.3	11.6	-176.6	61.6	165.6	0	0	0	113.8	I39 D43 E44 P126 P128 F130 L131	I39-I46 HydrophobicContact CB-CD1 4.08Å; I39-I46 HydrophobicContact CD1-CD1 4.32Å; I39-I46 HydrophobicContact CG2-CD1 4.31Å; D43-I46 HydrophobicContact CB-CD1 4.14Å; D43-I46 HydrophobicContact CB-CG1 3.88Å; D43-I46 WeakPolarHBondContact O-CG1 3.5Å; D43-I46 PolarHBondContact O-N 3.38Å; E44-I46 PolarHBondContact O-N 3.01Å; I46-P126 HydrophobicContact CG2-CB 3.95Å; I46-P128 CarbonylContact C-O 3.59Å; I46-P128 WeakPolarHBondContact CA-O 3.4Å; I46-P128 VanDerWaalsContact O-O 3.11Å; I46-F130 HydrophobicContact CB-CB 4.32Å; I46-F130 HydrophobicContact CD1-CD1 4.42Å; I46-L131 HydrophobicContact CD1-CD1 3.91Å; I46-L131 HydrophobicContact CD1-CD2 4.45Å; I46-L131 HydrophobicContact CD1-CG 3.93Å; I46-L131 HydrophobicContact CG1-CD1 3.82Å; I46-L131 HydrophobicContact CG1-CG 4.07Å; I46-L131 WeakPolarHBondContact O-CB 3.47Å; I46-L131 PolarHBondContact O-N 2.93Å
47	R	95.6	Very high	94.2	Very high	130 Å²	130	79.1 Å²	79.1	49%	0.491	38%	0.376	S	S	.	.			trans	-99.8	5	-177.5	-69.4	-179.8	86.8	173.6	10.5	114.7	D43 E44 P128 L131	D43-R47 WeakPolarHBondContact O-CG 3.33Å; E44-R47 PolarHBondContact O-N 3.4Å; E44-R47 WeakPolarHBondContact OE1-CD 3.39Å; E44-R47 IonicContact OE1-CZ 3.66Å; E44-R47 IonicContact OE1-NE 3.92Å; E44-R47 IonicContact OE1-NH1 2.7Å; E44-R47 PolarHBondContact OE1-NH1 2.94Å; R47-P128 PolarHBondContact N-O 2.84Å; R47-L131 HydrophobicContact CG-CD1 3.49Å; R47-L131 VanDerWaalsContact CG-CD1 3.49Å
48	Y	96.4	Very high	94.3	Very high	119 Å²	119	75.6 Å²	75.6	47%	0.467	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-66.7	148.9	-176.2	-72.9	-113.8	0	0	0	111.3	E44 P128 N129 S132 N216	E44-Y48 WeakPolarHBondContact O-CE2 3.4Å; Y48-P128 WeakPolarHBondContact CB-O 3.34Å; Y48-P128 HydrophobicContact CD2-CB 4.08Å; Y48-P128 HydrophobicContact CG-CB 4.2Å; Y48-P128 PolarHBondContact N-O 3.29Å; Y48-N129 WeakPolarHBondContact O-CA 3.5Å; Y48-S132 WeakPolarHBondContact O-CB 3.24Å; Y48-S132 PolarHBondContact O-OG 3.22Å; Y48-N216 VanDerWaalsContact CD1-OD1 3.31Å; Y48-N216 WeakPolarHBondContact CD1-OD1 3.22Å
49	P	96	Very high	94.3	Very high	77 Å²	77	78.3 Å²	78.3	50%	0.5	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-67.3	145	177.5	28	-34.7	0	0	0	110.9	R51 N216	P49-R51 PolarHBondContact O-N 2.9Å; P49-N216 PolarHBondContact O-ND2 3.42Å
50	Y	94.6	Very high	94.2	Very high	115 Å²	115	78.1 Å²	78.1	45%	0.451	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-63.7	129	172.6	178.3	-92.1	0	0	0	110.6	S132 V133	Y50-S132 PolarHBondContact N-OG 2.87Å; Y50-V133 HydrophobicContact CD2-CG2 3.51Å; Y50-V133 HydrophobicContact CE2-CG2 4.23Å; Y50-V133 HydrophobicContact CG-CG2 4.31Å
51	R	94.8	Very high	94	Very high	129 Å²	129	75 Å²	75	49%	0.487	38%	0.383	S	S	.	.			trans	-120.9	149.9	171.7	-64.1	-178.7	172.2	-173.3	-4.8	110.2	P49 S214 K217	P49-R51 PolarHBondContact O-N 2.9Å; R51-S214 PolarHBondContact NH1-O 3.38Å; R51-K217 WeakPolarHBondContact O-CE 3.46Å; R51-K217 PolarHBondContact O-NZ 2.78Å
52	K	94	Very high	93.9	Very high	178 Å²	178	77.2 Å²	77.2	77%	0.774	40%	0.403	S	S	*	.			trans	-69.8	151.5	171.4	-65.7	-177.3	-178.6	178.1	0	109.3	T54	K52-T54 PolarHBondContact O-N 2.89Å
53	D	93.6	Very high	93.9	Very high	61 Å²	61	73.9 Å²	73.9	33%	0.326	39%	0.386	S	S	.	.			trans	-70.4	123	178.8	-64.4	-71.8	0	0	0	110.6	R212 K217	D53-R212 IonicContact OD1-CZ 3.65Å; D53-R212 IonicContact OD1-NH1 2.76Å; D53-R212 IonicContact OD1-NH2 3.87Å; D53-K217 VanDerWaalsContact CG-NZ 3.26Å; D53-K217 VanDerWaalsContact OD1-CD 3.26Å; D53-K217 WeakPolarHBondContact OD1-CD 3.43Å; D53-K217 WeakPolarHBondContact OD1-CE 3.37Å; D53-K217 WeakPolarHBondContact OD1-CG 3.28Å; D53-K217 IonicContact OD1-NZ 3.22Å; D53-K217 PolarHBondContact OD1-NZ 3Å; D53-K217 VanDerWaalsContact OD1-NZ 3.16Å; D53-K217 IonicContact OD2-NZ 3.56Å; D53-K217 PolarHBondContact OD2-NZ 3.12Å
54	T	96.1	Very high	93.7	Very high	76 Å²	76	71.2 Å²	71.2	47%	0.466	37%	0.372	S	S	.	.	S	Bend	trans	-63.3	-46	171.9	-62.7	0	0	0	0	110.1	K52 T211 D215	K52-T54 PolarHBondContact O-N 2.89Å; T54-T211 HydrophobicContact CG2-CG2 3.85Å; T54-D215 WeakPolarHBondContact CB-OD2 3.2Å; T54-D215 PolarHBondContact N-OD2 3.46Å; T54-D215 PolarHBondContact OG1-OD1 3.42Å; T54-D215 PolarHBondContact OG1-OD2 2.92Å
55	I	94.6	Very high	93.5	Very high	18 Å²	18	70.9 Å²	70.9	9%	0.092	37%	0.373	C	S	.	.	S	Bend	trans	-110.8	112.9	171	-58.2	-61.4	0	0	0	109.1	M60 Y207 V208 T211 R212	I55-M60 HydrophobicContact CG2-CB 3.94Å; I55-Y207 HydrophobicContact CD1-CE1 4.19Å; I55-Y207 HydrophobicContact CG1-CE1 4.33Å; I55-V208 HydrophobicContact CG1-CG2 4.48Å; I55-V208 HydrophobicContact CG2-CG2 4.37Å; I55-T211 HydrophobicContact CG1-CG2 4.25Å; I55-R212 VanDerWaalsContact O-CZ 3.25Å; I55-R212 PolarHBondContact O-NH1 2.93Å; I55-R212 PolarHBondContact O-NH2 2.75Å
56	S	94.5	Very high	93.3	Very high	49 Å²	49	71.4 Å²	71.4	34%	0.343	38%	0.38	S	S	.	.			trans	-78.2	159.8	173.4	79.4	0	0	0	0	111.3	G58 T59 M60	S56-G58 PolarHBondContact O-N 3.22Å; S56-G58 PolarHBondContact OG-N 2.86Å; S56-T59 PolarHBondContact O-N 3.27Å; S56-T59 PolarHBondContact OG-N 3.32Å; S56-T59 PolarHBondContact OG-OG1 3.26Å; S56-M60 WeakPolarHBondContact O-CB 3.23Å; S56-M60 PolarHBondContact O-N 3.02Å
57	H	88.9	Confident	93.1	Very high	118 Å²	118	73.1 Å²	73.1	55%	0.546	39%	0.392	S	S	.	.	H	α-helix	trans	-53.7	-40.5	171.4	-78.7	-75.1	0	0	0	112.3	A61 H166	H57-A61 WeakPolarHBondContact O-CB 3.45Å; H57-A61 PolarHBondContact O-N 2.74Å; H57-H166 AromaticContact CD2-CE1 3.46Å; H57-H166 PolarHBondContact CD2-CE1 3.49Å; H57-H166 VanDerWaalsContact CD2-CE1 3.46Å; H57-H166 AromaticContact CD2-NE2 3.62Å; H57-H166 AromaticContact CE1-CE1 3.15Å; H57-H166 PolarHBondContact CE1-CE1 2.8Å; H57-H166 AromaticContact CE1-ND1 3.7Å; H57-H166 AromaticContact CE1-NE2 3.55Å; H57-H166 AromaticContact CG-CE1 3.77Å; H57-H166 AromaticContact CG-NE2 3.52Å; H57-H166 AromaticContact ND1-CE1 3.59Å; H57-H166 AromaticContact ND1-NE2 3.48Å; H57-H166 PolarHBondContact ND1-NE2 3.45Å; H57-H166 AromaticContact NE2-CE1 3.05Å; H57-H166 PolarHBondContact NE2-CE1 2.85Å; H57-H166 AromaticContact NE2-ND1 3.89Å; H57-H166 AromaticContact NE2-NE2 3.65Å
58	G	91	Very high	92.8	Very high	49 Å²	49	67.5 Å²	67.5	51%	0.505	37%	0.372	S	S	.	.	H	α-helix	trans	-67	-44.8	178.8	0	0	0	0	0	112.6	S56 M60 A61 A62	S56-G58 PolarHBondContact O-N 3.22Å; S56-G58 PolarHBondContact OG-N 2.86Å; G58-M60 VanDerWaalsContact C-N 3.33Å; G58-M60 PolarHBondContact O-N 2.84Å; G58-A61 PolarHBondContact O-N 2.74Å; G58-A62 WeakPolarHBondContact O-CB 3.3Å; G58-A62 PolarHBondContact O-N 3.04Å
59	T	92.5	Very high	92.4	Very high	65 Å²	65	67 Å²	67	40%	0.399	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-44.7	176.3	-50.4	0	0	0	0	111	S56 A62 V63	S56-T59 PolarHBondContact O-N 3.27Å; S56-T59 PolarHBondContact OG-N 3.32Å; S56-T59 PolarHBondContact OG-OG1 3.26Å; T59-A62 PolarHBondContact O-N 3.38Å; T59-V63 WeakPolarHBondContact O-CG2 3.16Å; T59-V63 PolarHBondContact O-N 3.01Å
60	M	92.5	Very high	92.2	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.01	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-46.4	178	-173.6	-175.8	-178.4	0	0	111.9	I55 S56 G58 V63 T64 H166 F169 V208	I55-M60 HydrophobicContact CG2-CB 3.94Å; S56-M60 WeakPolarHBondContact O-CB 3.23Å; S56-M60 PolarHBondContact O-N 3.02Å; G58-M60 VanDerWaalsContact C-N 3.33Å; G58-M60 PolarHBondContact O-N 2.84Å; M60-V63 PolarHBondContact O-N 3.46Å; M60-T64 WeakPolarHBondContact O-CB 3.46Å; M60-T64 PolarHBondContact O-N 3.02Å; M60-T64 PolarHBondContact O-OG1 3.17Å; M60-T64 VanDerWaalsContact O-OG1 3.11Å; M60-H166 WeakPolarHBondContact CE-O 3.49Å; M60-H166 HydrophobicContact SD-CB 4.27Å; M60-F169 HydrophobicContact CE-CB 4Å; M60-F169 HydrophobicContact CE-CD1 3.49Å; M60-F169 VanDerWaalsContact CE-CD1 3.49Å; M60-F169 HydrophobicContact CE-CE1 4.42Å; M60-F169 HydrophobicContact CE-CG 4.18Å; M60-F169 HydrophobicContact SD-CD1 3.99Å; M60-V208 HydrophobicContact CE-CG1 4.39Å; M60-V208 HydrophobicContact SD-CG1 4.44Å
61	A	89.6	Confident	92	Very high	37 Å²	37	63.6 Å²	63.6	31%	0.306	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-44.9	176.2	0	0	0	0	0	111.5	H57 G58 V63 T64 I65	H57-A61 WeakPolarHBondContact O-CB 3.45Å; H57-A61 PolarHBondContact O-N 2.74Å; G58-A61 PolarHBondContact O-N 2.74Å; A61-V63 PolarHBondContact O-N 3.25Å; A61-T64 PolarHBondContact O-N 3.41Å; A61-I65 WeakPolarHBondContact O-CB 3.27Å; A61-I65 WeakPolarHBondContact O-CD1 3.47Å; A61-I65 VanDerWaalsContact O-CG1 3.22Å; A61-I65 WeakPolarHBondContact O-CG1 3.43Å; A61-I65 PolarHBondContact O-N 2.92Å
62	A	92.5	Very high	91.6	Very high	58 Å²	58	57.9 Å²	57.9	48%	0.479	34%	0.343	S	S	.	.	H	α-helix	trans	-59.8	-47.8	178.5	0	0	0	0	0	112.1	G58 T59 I65 A66	G58-A62 WeakPolarHBondContact O-CB 3.3Å; G58-A62 PolarHBondContact O-N 3.04Å; T59-A62 PolarHBondContact O-N 3.38Å; A62-I65 PolarHBondContact O-N 2.92Å; A62-A66 VanDerWaalsContact O-CB 3.28Å; A62-A66 WeakPolarHBondContact O-CB 3.35Å; A62-A66 PolarHBondContact O-N 3.43Å
63	V	92.1	Very high	91.2	Very high	47 Å²	47	51.5 Å²	51.5	29%	0.285	32%	0.319	S	S	.	.	H	α-helix	trans	-62.6	-46.7	177.4	173.7	0	0	0	0	110.8	T59 M60 A61 I65 A66 C67 F204	T59-V63 WeakPolarHBondContact O-CG2 3.16Å; T59-V63 PolarHBondContact O-N 3.01Å; M60-V63 PolarHBondContact O-N 3.46Å; A61-V63 PolarHBondContact O-N 3.25Å; V63-I65 PolarHBondContact O-N 3.47Å; V63-A66 PolarHBondContact O-N 3.22Å; V63-C67 WeakPolarHBondContact O-CB 3.29Å; V63-C67 PolarHBondContact O-N 3.44Å; V63-C67 PolarHBondContact O-SG 3.46Å; V63-F204 HydrophobicContact CB-CE1 4.3Å; V63-F204 HydrophobicContact CB-CZ 3.99Å; V63-F204 HydrophobicContact CG1-CD1 4.35Å; V63-F204 HydrophobicContact CG1-CE1 3.65Å; V63-F204 HydrophobicContact CG1-CE2 4.17Å; V63-F204 HydrophobicContact CG1-CZ 3.55Å; V63-F204 HydrophobicContact CG2-CZ 4.26Å
64	T	90.9	Very high	90.7	Very high	4 Å²	4	52.6 Å²	52.6	3%	0.025	33%	0.328	C	S	.	.	H	α-helix	trans	-60.1	-47.2	178.6	-67.3	0	0	0	0	112	M60 A61 C67 S68 F105 C173 M174	M60-T64 WeakPolarHBondContact O-CB 3.46Å; M60-T64 PolarHBondContact O-N 3.02Å; M60-T64 PolarHBondContact O-OG1 3.17Å; M60-T64 VanDerWaalsContact O-OG1 3.11Å; A61-T64 PolarHBondContact O-N 3.41Å; T64-C67 PolarHBondContact O-N 3.34Å; T64-S68 VanDerWaalsContact O-CB 3.28Å; T64-S68 WeakPolarHBondContact O-CB 3.25Å; T64-S68 PolarHBondContact O-N 3.24Å; T64-S68 PolarHBondContact O-OG 3.42Å; T64-F105 HydrophobicContact CG2-CZ 4.01Å; T64-C173 HydrophobicContact CG2-CB 3.65Å; T64-M174 HydrophobicContact CG2-CE 4.29Å; T64-M174 WeakPolarHBondContact OG1-CE 3.38Å
65	I	90.4	Very high	90	Very high	110 Å²	110	49.7 Å²	49.7	56%	0.564	31%	0.313	S	S	*	.	H	α-helix	trans	-62.8	-47.1	179.3	-68.9	165.5	0	0	0	110.1	A61 A62 V63 S68 M69	A61-I65 WeakPolarHBondContact O-CB 3.27Å; A61-I65 WeakPolarHBondContact O-CD1 3.47Å; A61-I65 VanDerWaalsContact O-CG1 3.22Å; A61-I65 WeakPolarHBondContact O-CG1 3.43Å; A61-I65 PolarHBondContact O-N 2.92Å; A62-I65 PolarHBondContact O-N 2.92Å; V63-I65 PolarHBondContact O-N 3.47Å; I65-S68 PolarHBondContact O-N 2.94Å; I65-M69 HydrophobicContact CG2-CG 4.34Å; I65-M69 WeakPolarHBondContact O-CB 3.4Å; I65-M69 VanDerWaalsContact O-CG 3.25Å; I65-M69 WeakPolarHBondContact O-CG 3.46Å; I65-M69 PolarHBondContact O-N 3.36Å
66	A	92.4	Very high	89.3	Confident	53 Å²	53	48.9 Å²	48.9	44%	0.438	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-48.9	179	0	0	0	0	0	111.8	A62 V63 M69 V70	A62-A66 VanDerWaalsContact O-CB 3.28Å; A62-A66 WeakPolarHBondContact O-CB 3.35Å; A62-A66 PolarHBondContact O-N 3.43Å; V63-A66 PolarHBondContact O-N 3.22Å; A66-M69 PolarHBondContact O-N 3Å; A66-V70 WeakPolarHBondContact O-CG2 3.28Å; A66-V70 PolarHBondContact O-N 3.5Å
67	C	91.9	Very high	88.5	Confident	40 Å²	40	49 Å²	49	27%	0.27	31%	0.313	S	S	.	.	H	α-helix	trans	-61.6	-45.5	177.7	-72.2	0	0	0	0	112.1	V63 T64 V70 I71 L177	V63-C67 WeakPolarHBondContact O-CB 3.29Å; V63-C67 PolarHBondContact O-N 3.44Å; V63-C67 PolarHBondContact O-SG 3.46Å; T64-C67 PolarHBondContact O-N 3.34Å; C67-V70 PolarHBondContact O-N 3.37Å; C67-I71 WeakPolarHBondContact O-CB 3.15Å; C67-I71 WeakPolarHBondContact O-CG1 3.45Å; C67-I71 PolarHBondContact O-N 3.14Å; C67-L177 HydrophobicContact CB-CD1 4.21Å
68	S	89.9	Confident	88.1	Confident	12 Å²	12	48.8 Å²	48.8	8%	0.084	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-46.7	177.3	-70.1	0	0	0	0	111.7	T64 I65 I72	T64-S68 VanDerWaalsContact O-CB 3.28Å; T64-S68 WeakPolarHBondContact O-CB 3.25Å; T64-S68 PolarHBondContact O-N 3.24Å; T64-S68 PolarHBondContact O-OG 3.42Å; I65-S68 PolarHBondContact O-N 2.94Å; S68-I72 VanDerWaalsContact O-CB 3.23Å; S68-I72 WeakPolarHBondContact O-CB 3.16Å; S68-I72 WeakPolarHBondContact O-CD1 3.33Å; S68-I72 WeakPolarHBondContact O-CG1 3.33Å; S68-I72 PolarHBondContact O-N 3.31Å
69	M	88.6	Confident	87.3	Confident	108 Å²	108	46.9 Å²	46.9	53%	0.532	29%	0.286	S	S	.	.	H	α-helix	trans	-58.4	-54.3	177.7	-73.4	-60.9	-65.3	0	0	110.3	I65 A66 I71 I72 T73	I65-M69 HydrophobicContact CG2-CG 4.34Å; I65-M69 WeakPolarHBondContact O-CB 3.4Å; I65-M69 VanDerWaalsContact O-CG 3.25Å; I65-M69 WeakPolarHBondContact O-CG 3.46Å; I65-M69 PolarHBondContact O-N 3.36Å; A66-M69 PolarHBondContact O-N 3Å; M69-I71 PolarHBondContact O-N 2.76Å; M69-I72 PolarHBondContact O-N 3.01Å; M69-T73 HydrophobicContact CE-CG2 4.25Å; M69-T73 WeakPolarHBondContact O-CB 3.39Å; M69-T73 WeakPolarHBondContact O-CG2 3.37Å; M69-T73 PolarHBondContact O-N 3.37Å; M69-T73 PolarHBondContact O-OG1 3.13Å
70	V	90.8	Very high	86.4	Confident	93 Å²	93	46 Å²	46	56%	0.564	28%	0.281	S	S	*	.	H	α-helix	trans	-58.9	-47.2	-178.5	172.5	0	0	0	0	111.9	A66 C67 T73 T74	A66-V70 WeakPolarHBondContact O-CG2 3.28Å; A66-V70 PolarHBondContact O-N 3.5Å; C67-V70 PolarHBondContact O-N 3.37Å; V70-T73 PolarHBondContact O-OG1 3.36Å; V70-T74 WeakPolarHBondContact O-CB 3.37Å; V70-T74 PolarHBondContact O-N 2.81Å; V70-T74 VanDerWaalsContact O-N 3.08Å; V70-T74 PolarHBondContact O-OG1 2.96Å
71	I	90.9	Very high	85.5	Confident	28 Å²	28	53.6 Å²	53.6	14%	0.144	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-45.2	-176.5	-71.7	170.8	0	0	0	111.4	C67 M69 G75 L177 Y180 V181 L201	C67-I71 WeakPolarHBondContact O-CB 3.15Å; C67-I71 WeakPolarHBondContact O-CG1 3.45Å; C67-I71 PolarHBondContact O-N 3.14Å; M69-I71 PolarHBondContact O-N 2.76Å; I71-G75 WeakPolarHBondContact O-CA 3.41Å; I71-G75 PolarHBondContact O-N 3.36Å; I71-L177 HydrophobicContact CB-CD2 4.49Å; I71-L177 HydrophobicContact CD1-CB 4.24Å; I71-L177 HydrophobicContact CD1-CD1 4.25Å; I71-L177 HydrophobicContact CG2-CD2 4.35Å; I71-Y180 HydrophobicContact CG2-CD1 3.7Å; I71-Y180 HydrophobicContact CG2-CE1 3.97Å; I71-V181 HydrophobicContact CG2-CG2 3.63Å; I71-L201 HydrophobicContact CD1-CD1 3.91Å; I71-L201 HydrophobicContact CD1-CD2 3.94Å; I71-L201 HydrophobicContact CD1-CG 4.47Å
72	I	86.6	Confident	84.5	Confident	9 Å²	9	54.5 Å²	54.5	5%	0.046	32%	0.318	C	S	.	.	H	α-helix	trans	-71.9	-46	-176.8	-63.6	167.6	0	0	0	110.3	S68 M69 T74 G75 E76 L98 V101 Y180	S68-I72 VanDerWaalsContact O-CB 3.23Å; S68-I72 WeakPolarHBondContact O-CB 3.16Å; S68-I72 WeakPolarHBondContact O-CD1 3.33Å; S68-I72 WeakPolarHBondContact O-CG1 3.33Å; S68-I72 PolarHBondContact O-N 3.31Å; M69-I72 PolarHBondContact O-N 3.01Å; I72-T74 PolarHBondContact O-N 3.41Å; I72-G75 PolarHBondContact O-N 2.98Å; I72-E76 HydrophobicContact CG2-CG 4.39Å; I72-E76 WeakPolarHBondContact O-CB 3.45Å; I72-E76 WeakPolarHBondContact O-CG 3.48Å; I72-E76 PolarHBondContact O-N 3.24Å; I72-L98 HydrophobicContact CG2-CD1 4.5Å; I72-V101 HydrophobicContact CD1-CG1 3.62Å; I72-V101 HydrophobicContact CG1-CG1 3.94Å; I72-V101 HydrophobicContact CG2-CG1 4.24Å; I72-Y180 HydrophobicContact CG1-CE1 4.31Å
73	T	84.2	Confident	83.1	Confident	44 Å²	44	60.3 Å²	60.3	27%	0.27	33%	0.332	S	S	.	.	H	α-helix	trans	-64.4	-44.9	-179.4	60.8	0	0	0	0	111.1	M69 V70 A77	M69-T73 HydrophobicContact CE-CG2 4.25Å; M69-T73 WeakPolarHBondContact O-CB 3.39Å; M69-T73 WeakPolarHBondContact O-CG2 3.37Å; M69-T73 PolarHBondContact O-N 3.37Å; M69-T73 PolarHBondContact O-OG1 3.13Å; V70-T73 PolarHBondContact O-OG1 3.36Å; T73-A77 WeakPolarHBondContact O-CB 3.48Å; T73-A77 PolarHBondContact O-N 3.34Å
74	T	84.4	Confident	81.6	Confident	85 Å²	85	65.2 Å²	65.2	52%	0.521	35%	0.345	S	S	.	.	H	α-helix	trans	-68.6	-40.2	179.6	-48.6	0	0	0	0	111	V70 I72 A77 Y78	V70-T74 WeakPolarHBondContact O-CB 3.37Å; V70-T74 PolarHBondContact O-N 2.81Å; V70-T74 VanDerWaalsContact O-N 3.08Å; V70-T74 PolarHBondContact O-OG1 2.96Å; I72-T74 PolarHBondContact O-N 3.41Å; T74-A77 PolarHBondContact O-N 3.03Å; T74-Y78 VanDerWaalsContact O-CB 3.24Å; T74-Y78 WeakPolarHBondContact O-CB 3.33Å; T74-Y78 PolarHBondContact O-N 3.45Å
75	G	81.6	Confident	79.9	Confident	15 Å²	15	66.1 Å²	66.1	16%	0.155	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-47.9	177.7	0	0	0	0	0	113	I71 I72 L79	I71-G75 WeakPolarHBondContact O-CA 3.41Å; I71-G75 PolarHBondContact O-N 3.36Å; I72-G75 PolarHBondContact O-N 2.98Å; G75-L79 WeakPolarHBondContact O-CD1 3.48Å; G75-L79 WeakPolarHBondContact O-CG 3.33Å; G75-L79 PolarHBondContact O-N 3.5Å; G75-L79 VanDerWaalsContact O-N 3.12Å
76	E	79.3	Confident	77.9	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-71.4	-37.5	177.3	-63.6	-58.5	147.5	0	0	112	I72 Y78 L79 V80 Y94 Y180 R184	I72-E76 HydrophobicContact CG2-CG 4.39Å; I72-E76 WeakPolarHBondContact O-CB 3.45Å; I72-E76 WeakPolarHBondContact O-CG 3.48Å; I72-E76 PolarHBondContact O-N 3.24Å; E76-Y78 VanDerWaalsContact C-N 3.34Å; E76-Y78 PolarHBondContact O-N 3.47Å; E76-L79 PolarHBondContact O-N 3.11Å; E76-V80 WeakPolarHBondContact O-CG2 3.49Å; E76-V80 PolarHBondContact O-N 3.01Å; E76-Y94 HydrophobicContact CB-CD2 3.88Å; E76-Y94 HydrophobicContact CB-CE2 3.57Å; E76-Y180 WeakPolarHBondContact CG-OH 3.11Å; E76-Y180 PolarHBondContact OE1-OH 2.91Å; E76-R184 IonicContact OE1-CZ 3.16Å; E76-R184 IonicContact OE1-NE 3.6Å; E76-R184 IonicContact OE1-NH2 3.65Å; E76-R184 PolarHBondContact OE1-NH2 2.91Å
77	A	77.6	Confident	75.4	Confident	52 Å²	52	72 Å²	72	43%	0.43	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-42.3	174	0	0	0	0	0	111.9	T73 T74 L79 V80 H81	T73-A77 WeakPolarHBondContact O-CB 3.48Å; T73-A77 PolarHBondContact O-N 3.34Å; T74-A77 PolarHBondContact O-N 3.03Å; A77-L79 VanDerWaalsContact C-N 3.35Å; A77-L79 PolarHBondContact O-N 2.96Å; A77-V80 PolarHBondContact O-N 3.35Å; A77-H81 WeakPolarHBondContact O-CB 3.46Å; A77-H81 PolarHBondContact O-N 3.44Å
78	Y	79.8	Confident	73.2	Confident	114 Å²	114	77.9 Å²	77.9	45%	0.447	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-41	174.4	177.3	-96.8	0	0	0	112	T74 E76 H81 T82	T74-Y78 VanDerWaalsContact O-CB 3.24Å; T74-Y78 WeakPolarHBondContact O-CB 3.33Å; T74-Y78 PolarHBondContact O-N 3.45Å; E76-Y78 VanDerWaalsContact C-N 3.34Å; E76-Y78 PolarHBondContact O-N 3.47Å; Y78-H81 PolarHBondContact O-N 3.3Å; Y78-T82 HydrophobicContact CD1-CG2 4.36Å; Y78-T82 HydrophobicContact CD2-CG2 4.18Å; Y78-T82 HydrophobicContact CE1-CG2 3.93Å; Y78-T82 HydrophobicContact CE2-CG2 3.75Å; Y78-T82 HydrophobicContact CG-CG2 4.47Å; Y78-T82 WeakPolarHBondContact O-CB 3.41Å; Y78-T82 WeakPolarHBondContact O-CG2 3.37Å; Y78-T82 PolarHBondContact O-N 3.17Å; Y78-T82 PolarHBondContact O-OG1 3.45Å
79	L	75.7	Confident	71.3	Confident	8 Å²	8	80.4 Å²	80.4	4%	0.042	41%	0.413	C	S	.	.	H	α-helix	trans	-65.4	-38.6	177.1	-76	160.4	0	0	0	113	G75 E76 A77 T82 R84 L85 R184	G75-L79 WeakPolarHBondContact O-CD1 3.48Å; G75-L79 WeakPolarHBondContact O-CG 3.33Å; G75-L79 PolarHBondContact O-N 3.5Å; G75-L79 VanDerWaalsContact O-N 3.12Å; E76-L79 PolarHBondContact O-N 3.11Å; A77-L79 VanDerWaalsContact C-N 3.35Å; A77-L79 PolarHBondContact O-N 2.96Å; L79-T82 PolarHBondContact O-OG1 2.97Å; L79-R84 HydrophobicContact CD2-CB 4.34Å; L79-R84 PolarHBondContact O-N 3.45Å; L79-L85 HydrophobicContact CB-CD1 4.25Å; L79-R184 HydrophobicContact CD1-CB 4.4Å; L79-R184 HydrophobicContact CD1-CG 4.21Å
80	V	73.7	Confident	69.9	Low	48 Å²	48	80.1 Å²	80.1	29%	0.291	42%	0.417	S	S	.	.	H	α-helix	trans	-67	-47	174	173.9	0	0	0	0	110.2	E76 A77 T82 K83 L85	E76-V80 WeakPolarHBondContact O-CG2 3.49Å; E76-V80 PolarHBondContact O-N 3.01Å; A77-V80 PolarHBondContact O-N 3.35Å; V80-T82 PolarHBondContact O-N 3.46Å; V80-K83 PolarHBondContact O-N 3Å; V80-K83 VanDerWaalsContact O-N 3.16Å; V80-L85 HydrophobicContact CG2-CD1 3.8Å
81	H	73.3	Confident	68.5	Low	161 Å²	161	82.5 Å²	82.5	75%	0.745	42%	0.42	S	S	*	.	H	α-helix	trans	-64.3	-39.1	-178.1	-171.5	73.5	0	0	0	112.7	A77 Y78 K83	A77-H81 WeakPolarHBondContact O-CB 3.46Å; A77-H81 PolarHBondContact O-N 3.44Å; Y78-H81 PolarHBondContact O-N 3.3Å; H81-K83 PolarHBondContact O-N 3.49Å; H81-K83 VanDerWaalsContact O-N 3.1Å
82	T	68.5	Low	67.6	Low	55 Å²	55	86.2 Å²	86.2	34%	0.337	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	11	177.3	52	0	0	0	0	114.1	Y78 L79 V80 R84	Y78-T82 HydrophobicContact CD1-CG2 4.36Å; Y78-T82 HydrophobicContact CD2-CG2 4.18Å; Y78-T82 HydrophobicContact CE1-CG2 3.93Å; Y78-T82 HydrophobicContact CE2-CG2 3.75Å; Y78-T82 HydrophobicContact CG-CG2 4.47Å; Y78-T82 WeakPolarHBondContact O-CB 3.41Å; Y78-T82 WeakPolarHBondContact O-CG2 3.37Å; Y78-T82 PolarHBondContact O-N 3.17Å; Y78-T82 PolarHBondContact O-OG1 3.45Å; L79-T82 PolarHBondContact O-OG1 2.97Å; V80-T82 PolarHBondContact O-N 3.46Å; T82-R84 PolarHBondContact O-N 3.36Å
83	K	63.2	Low	66.8	Low	180 Å²	180	89.8 Å²	89.8	78%	0.783	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	18.5	179.7	-60.8	-174.2	-178.6	-179.9	0	114.8	V80 H81 L85	V80-K83 PolarHBondContact O-N 3Å; V80-K83 VanDerWaalsContact O-N 3.16Å; H81-K83 PolarHBondContact O-N 3.49Å; H81-K83 VanDerWaalsContact O-N 3.1Å; K83-L85 PolarHBondContact O-N 2.85Å
84	R	60.4	Low	66.4	Low	150 Å²	150	90.8 Å²	90.8	57%	0.566	46%	0.456	S	S	*	.	S	Bend	trans	-68.4	-5.7	169.3	-88.3	-170.9	171.6	-162.6	-3.1	112.6	L79 T82	L79-R84 HydrophobicContact CD2-CB 4.34Å; L79-R84 PolarHBondContact O-N 3.45Å; T82-R84 PolarHBondContact O-N 3.36Å
85	L	55.5	Low	66.1	Low	24 Å²	24	91.1 Å²	91.1	13%	0.126	45%	0.454	C	S	.	.	S	Bend	trans	-123.6	113.2	171.6	-72	169.6	0	0	0	107.8	L79 V80 K83 Q93	L79-L85 HydrophobicContact CB-CD1 4.25Å; V80-L85 HydrophobicContact CG2-CD1 3.8Å; K83-L85 PolarHBondContact O-N 2.85Å; L85-Q93 HydrophobicContact CD2-CG 4.41Å
86	R	47.7	Very low	66	Low	205 Å²	205	93.1 Å²	93.1	77%	0.774	47%	0.466	S	S	*	.			trans	-112.4	121.5	-171.2	-173.6	167.1	154.1	160.8	-8.1	111.7
87	S	40.9	Very low	66	Low	80 Å²	80	93.3 Å²	93.3	56%	0.559	47%	0.468	S	S	*	.	S	Bend	trans	70.2	157.5	161	-156	0	0	0	0	118.2
88	N	44.1	Very low	66.3	Low	164 Å²	164	93 Å²	93	88%	0.877	46%	0.458	S	S	*	.	S	Bend	cis	-127.1	10	-16.4	-120.3	-17.3	0	0	0	109.8
89	S	50.8	Low	66.5	Low	66 Å²	66	90.8 Å²	90.8	46%	0.462	45%	0.45	S	S	.	.			trans	-152.1	89.3	172.9	-179.8	0	0	0	0	108.2	F91 N92	S89-F91 VanDerWaalsContact C-N 3.26Å; S89-F91 PolarHBondContact O-N 3.47Å; S89-N92 PolarHBondContact O-N 2.94Å; S89-N92 PolarHBondContact OG-ND2 2.99Å
90	T	58	Low	67.1	Low	101 Å²	101	95.4 Å²	95.4	62%	0.62	47%	0.469	S	S	*	.	H	α-helix	trans	-61.5	-31.5	-170.3	50.2	0	0	0	0	113.4	Q93 Y94	T90-Q93 PolarHBondContact O-N 3.07Å; T90-Y94 PolarHBondContact O-N 3.24Å; T90-Y94 VanDerWaalsContact O-N 3.14Å
91	F	62.1	Low	67.8	Low	144 Å²	144	93.2 Å²	93.2	63%	0.632	46%	0.456	S	S	*	.	H	α-helix	trans	-65.6	-41.9	-176	-171.2	-103.8	0	0	0	113.3	S89 Q93 Y94 L95	S89-F91 VanDerWaalsContact C-N 3.26Å; S89-F91 PolarHBondContact O-N 3.47Å; F91-Q93 VanDerWaalsContact C-N 3.35Å; F91-Q93 PolarHBondContact O-N 3.39Å; F91-Y94 PolarHBondContact O-N 3.5Å; F91-L95 WeakPolarHBondContact O-CB 3.37Å; F91-L95 PolarHBondContact O-N 2.92Å
92	N	71.7	Confident	68.5	Low	106 Å²	106	88.1 Å²	88.1	57%	0.567	44%	0.436	S	S	*	.	H	α-helix	trans	-68.8	-32.6	-178.1	-76.9	-40.5	0	0	0	112.7	S89 S96	S89-N92 PolarHBondContact O-N 2.94Å; S89-N92 PolarHBondContact OG-ND2 2.99Å; N92-S96 WeakPolarHBondContact O-CB 3.3Å; N92-S96 PolarHBondContact O-N 3.36Å; N92-S96 VanDerWaalsContact O-N 3.14Å
93	Q	70.7	Confident	69.6	Low	83 Å²	83	86.6 Å²	86.6	39%	0.388	43%	0.431	S	S	.	.	H	α-helix	trans	-79.4	-37.9	178.7	-164.2	171.8	21	0	0	112.2	L85 T90 F91 S96 A97	L85-Q93 HydrophobicContact CD2-CG 4.41Å; T90-Q93 PolarHBondContact O-N 3.07Å; F91-Q93 VanDerWaalsContact C-N 3.35Å; F91-Q93 PolarHBondContact O-N 3.39Å; Q93-S96 PolarHBondContact O-N 3.4Å; Q93-A97 WeakPolarHBondContact O-CB 3.42Å; Q93-A97 PolarHBondContact O-N 3.5Å
94	Y	75.3	Confident	71	Confident	66 Å²	66	79 Å²	79	26%	0.259	40%	0.4	S	S	.	.	H	α-helix	trans	-59.2	-48.9	171.9	177.3	-97.8	0	0	0	111.1	E76 T90 F91 S96 A97 L98	E76-Y94 HydrophobicContact CB-CD2 3.88Å; E76-Y94 HydrophobicContact CB-CE2 3.57Å; T90-Y94 PolarHBondContact O-N 3.24Å; T90-Y94 VanDerWaalsContact O-N 3.14Å; F91-Y94 PolarHBondContact O-N 3.5Å; Y94-S96 VanDerWaalsContact C-N 3.33Å; Y94-S96 PolarHBondContact O-N 2.93Å; Y94-A97 PolarHBondContact O-N 3.45Å; Y94-L98 HydrophobicContact CE1-CD1 4.13Å; Y94-L98 WeakPolarHBondContact O-CB 3.34Å; Y94-L98 PolarHBondContact O-N 3Å
95	L	78.8	Confident	72.6	Confident	91 Å²	91	72.9 Å²	72.9	48%	0.476	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-38.3	179.2	-172.4	60.7	0	0	0	112.2	F91 Y99	F91-L95 WeakPolarHBondContact O-CB 3.37Å; F91-L95 PolarHBondContact O-N 2.92Å; L95-Y99 VanDerWaalsContact O-CB 3.29Å; L95-Y99 WeakPolarHBondContact O-CB 3.29Å; L95-Y99 PolarHBondContact O-N 3.23Å
96	S	79.3	Confident	74.5	Confident	57 Å²	57	75.9 Å²	75.9	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-66.3	-40.2	174.9	-177.5	0	0	0	0	112.7	N92 Q93 Y94 K100	N92-S96 WeakPolarHBondContact O-CB 3.3Å; N92-S96 PolarHBondContact O-N 3.36Å; N92-S96 VanDerWaalsContact O-N 3.14Å; Q93-S96 PolarHBondContact O-N 3.4Å; Y94-S96 VanDerWaalsContact C-N 3.33Å; Y94-S96 PolarHBondContact O-N 2.93Å; S96-K100 WeakPolarHBondContact O-CG 3.23Å; S96-K100 PolarHBondContact O-N 2.96Å; S96-K100 VanDerWaalsContact O-N 3.1Å
97	A	79.8	Confident	76.8	Confident	5 Å²	5	69 Å²	69	4%	0.041	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-45.2	175.8	0	0	0	0	0	111.4	Q93 Y94 K100 V101	Q93-A97 WeakPolarHBondContact O-CB 3.42Å; Q93-A97 PolarHBondContact O-N 3.5Å; Y94-A97 PolarHBondContact O-N 3.45Å; A97-K100 PolarHBondContact O-N 3.18Å; A97-V101 VanDerWaalsContact O-CG2 3.29Å; A97-V101 WeakPolarHBondContact O-CG2 3.38Å; A97-V101 PolarHBondContact O-N 3.35Å
98	L	83	Confident	79.5	Confident	44 Å²	44	65.2 Å²	65.2	23%	0.23	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-45.3	177.6	-170.3	139.8	0	0	0	111.4	I72 Y94 K100 V101 V102	I72-L98 HydrophobicContact CG2-CD1 4.5Å; Y94-L98 HydrophobicContact CE1-CD1 4.13Å; Y94-L98 WeakPolarHBondContact O-CB 3.34Å; Y94-L98 PolarHBondContact O-N 3Å; L98-K100 VanDerWaalsContact C-N 3.33Å; L98-K100 PolarHBondContact O-N 3.01Å; L98-V101 PolarHBondContact O-N 3.08Å; L98-V102 HydrophobicContact CD2-CG2 3.97Å; L98-V102 HydrophobicContact CG-CG2 4.21Å; L98-V102 WeakPolarHBondContact O-CB 3.39Å; L98-V102 VanDerWaalsContact O-CG2 3.3Å; L98-V102 WeakPolarHBondContact O-CG2 3.48Å; L98-V102 PolarHBondContact O-N 3.41Å
99	Y	85	Confident	81.9	Confident	68 Å²	68	57.9 Å²	57.9	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-53.9	-47.5	173.4	164.4	-95.8	0	0	0	112	I11 D14 L95 G103	I11-Y99 WeakPolarHBondContact CA-OH 3.36Å; I11-Y99 HydrophobicContact CG1-CE1 4.32Å; I11-Y99 HydrophobicContact CG2-CE2 3.98Å; D14-Y99 WeakPolarHBondContact CB-OH 3.36Å; D14-Y99 PolarHBondContact OD2-OH 3.37Å; L95-Y99 VanDerWaalsContact O-CB 3.29Å; L95-Y99 WeakPolarHBondContact O-CB 3.29Å; L95-Y99 PolarHBondContact O-N 3.23Å; Y99-G103 WeakPolarHBondContact O-CA 3.2Å; Y99-G103 PolarHBondContact O-N 3.45Å
100	K	86.8	Confident	84.2	Confident	106 Å²	106	55.3 Å²	55.3	46%	0.461	29%	0.288	S	S	.	.	H	α-helix	trans	-64.2	-44.5	179.7	-72.9	-177.7	176.5	-161.1	0	112.1	S96 A97 L98 T104 D243	S96-K100 WeakPolarHBondContact O-CG 3.23Å; S96-K100 PolarHBondContact O-N 2.96Å; S96-K100 VanDerWaalsContact O-N 3.1Å; A97-K100 PolarHBondContact O-N 3.18Å; L98-K100 VanDerWaalsContact C-N 3.33Å; L98-K100 PolarHBondContact O-N 3.01Å; K100-T104 WeakPolarHBondContact O-CB 3.48Å; K100-T104 VanDerWaalsContact O-CG2 3.25Å; K100-T104 WeakPolarHBondContact O-CG2 3.42Å; K100-T104 PolarHBondContact O-N 3.1Å; K100-T104 PolarHBondContact O-OG1 3.09Å; K100-D243 IonicContact NZ-OD2 3.32Å
101	V	88.4	Confident	86	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-48.8	179.9	176.2	0	0	0	0	110.6	I72 A97 L98 T104 F105 F176 Y180 F244	I72-V101 HydrophobicContact CD1-CG1 3.62Å; I72-V101 HydrophobicContact CG1-CG1 3.94Å; I72-V101 HydrophobicContact CG2-CG1 4.24Å; A97-V101 VanDerWaalsContact O-CG2 3.29Å; A97-V101 WeakPolarHBondContact O-CG2 3.38Å; A97-V101 PolarHBondContact O-N 3.35Å; L98-V101 PolarHBondContact O-N 3.08Å; V101-T104 PolarHBondContact O-OG1 3.37Å; V101-F105 VanDerWaalsContact O-CB 3.3Å; V101-F105 WeakPolarHBondContact O-CB 3.29Å; V101-F105 PolarHBondContact O-N 3.28Å; V101-F176 HydrophobicContact CG1-CE1 4.46Å; V101-Y180 HydrophobicContact CG1-CD2 4.1Å; V101-Y180 HydrophobicContact CG1-CE2 3.97Å; V101-Y180 HydrophobicContact CG2-CD2 4.36Å; V101-Y180 HydrophobicContact CG2-CE2 3.74Å; V101-F244 HydrophobicContact CB-CE1 4.19Å; V101-F244 HydrophobicContact CB-CZ 4.09Å; V101-F244 HydrophobicContact CG1-CE1 4.41Å; V101-F244 HydrophobicContact CG1-CZ 3.87Å; V101-F244 HydrophobicContact CG2-CE1 3.52Å; V101-F244 HydrophobicContact CG2-CZ 3.85Å
102	V	89.7	Confident	87.7	Confident	55 Å²	55	45.6 Å²	45.6	33%	0.333	24%	0.24	S	C	.	.	H	α-helix	trans	-67.5	-43.5	-179	173.7	0	0	0	0	110.8	L98 T104 F105 L106	L98-V102 HydrophobicContact CD2-CG2 3.97Å; L98-V102 HydrophobicContact CG-CG2 4.21Å; L98-V102 WeakPolarHBondContact O-CB 3.39Å; L98-V102 VanDerWaalsContact O-CG2 3.3Å; L98-V102 WeakPolarHBondContact O-CG2 3.48Å; L98-V102 PolarHBondContact O-N 3.41Å; V102-T104 PolarHBondContact O-N 3.25Å; V102-F105 PolarHBondContact O-N 3.04Å; V102-L106 HydrophobicContact CG1-CD1 3.79Å; V102-L106 HydrophobicContact CG1-CG 4.17Å; V102-L106 WeakPolarHBondContact O-CB 3.42Å; V102-L106 VanDerWaalsContact O-CG 3.27Å; V102-L106 WeakPolarHBondContact O-CG 3.31Å; V102-L106 PolarHBondContact O-N 2.76Å
103	G	91.1	Very high	88.9	Confident	23 Å²	23	43.2 Å²	43.2	24%	0.237	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-46.4	178	0	0	0	0	0	112.5	Y99 L106 F107	Y99-G103 WeakPolarHBondContact O-CA 3.2Å; Y99-G103 PolarHBondContact O-N 3.45Å; G103-L106 PolarHBondContact O-N 3.2Å; G103-F107 WeakPolarHBondContact O-CB 3.43Å; G103-F107 PolarHBondContact O-N 3.3Å
104	T	92.8	Very high	90.2	Very high	20 Å²	20	39.7 Å²	39.7	12%	0.123	21%	0.21	C	C	.	.	H	α-helix	trans	-66.5	-38.1	177	52.3	0	0	0	0	112.7	K100 V101 V102 G108 T237 V241	K100-T104 WeakPolarHBondContact O-CB 3.48Å; K100-T104 VanDerWaalsContact O-CG2 3.25Å; K100-T104 WeakPolarHBondContact O-CG2 3.42Å; K100-T104 PolarHBondContact O-N 3.1Å; K100-T104 PolarHBondContact O-OG1 3.09Å; V101-T104 PolarHBondContact O-OG1 3.37Å; V102-T104 PolarHBondContact O-N 3.25Å; T104-G108 PolarHBondContact O-N 2.85Å; T104-G108 VanDerWaalsContact O-N 3.08Å; T104-T237 WeakPolarHBondContact O-CG2 3.21Å; T104-V241 HydrophobicContact CG2-CG1 4.05Å
105	F	93.9	Very high	91.2	Very high	22 Å²	22	40 Å²	40	10%	0.096	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-47.2	173.2	178.5	-96.9	0	0	0	112.4	T64 V101 V102 F107 G108 A109 Y172 C173 F176	T64-F105 HydrophobicContact CG2-CZ 4.01Å; V101-F105 VanDerWaalsContact O-CB 3.3Å; V101-F105 WeakPolarHBondContact O-CB 3.29Å; V101-F105 PolarHBondContact O-N 3.28Å; V102-F105 PolarHBondContact O-N 3.04Å; F105-F107 VanDerWaalsContact C-N 3.35Å; F105-F107 PolarHBondContact O-N 3.09Å; F105-G108 PolarHBondContact O-N 2.89Å; F105-A109 VanDerWaalsContact O-CB 3.29Å; F105-A109 WeakPolarHBondContact O-CB 3.43Å; F105-A109 PolarHBondContact O-N 3.46Å; F105-Y172 HydrophobicContact CD2-CE1 4.15Å; F105-Y172 HydrophobicContact CE2-CE1 4.13Å; F105-Y172 PolarHBondContact O-OH 3.31Å; F105-C173 HydrophobicContact CE2-CB 4.1Å; F105-C173 HydrophobicContact CZ-CB 4.01Å; F105-C173 VanDerWaalsContact CZ-SG 3.53Å; F105-F176 HydrophobicContact CB-CD1 4.44Å; F105-F176 HydrophobicContact CB-CE1 3.86Å; F105-F176 HydrophobicContact CB-CE2 4.36Å; F105-F176 HydrophobicContact CB-CZ 3.8Å; F105-F176 HydrophobicContact CD2-CB 4.26Å; F105-F176 AromaticContact CD2-CD1 3.49Å; F105-F176 HydrophobicContact CD2-CD1 3.49Å; F105-F176 VanDerWaalsContact CD2-CD1 3.49Å; F105-F176 HydrophobicContact CD2-CD2 4.34Å; F105-F176 AromaticContact CD2-CE1 3.78Å; F105-F176 HydrophobicContact CD2-CE1 3.78Å; F105-F176 AromaticContact CD2-CG 3.78Å; F105-F176 HydrophobicContact CD2-CG 3.78Å; F105-F176 HydrophobicContact CD2-CZ 4.31Å; F105-F176 HydrophobicContact CE2-CB 4.43Å; F105-F176 HydrophobicContact CE2-CD1 4.23Å; F105-F176 HydrophobicContact CE2-CG 4.42Å; F105-F176 HydrophobicContact CG-CD1 4.43Å; F105-F176 HydrophobicContact CG-CE1 4.31Å
106	L	95.1	Very high	92.1	Very high	86 Å²	86	35.7 Å²	35.7	45%	0.45	19%	0.193	S	C	.	.	H	α-helix	trans	-66.3	-38.6	179.4	-69.8	176.6	0	0	0	111.6	V18 V102 G103 A109 A110	V18-L106 HydrophobicContact CG1-CB 4.25Å; V102-L106 HydrophobicContact CG1-CD1 3.79Å; V102-L106 HydrophobicContact CG1-CG 4.17Å; V102-L106 WeakPolarHBondContact O-CB 3.42Å; V102-L106 VanDerWaalsContact O-CG 3.27Å; V102-L106 WeakPolarHBondContact O-CG 3.31Å; V102-L106 PolarHBondContact O-N 2.76Å; G103-L106 PolarHBondContact O-N 3.2Å; L106-A109 PolarHBondContact O-N 2.87Å; L106-A110 WeakPolarHBondContact O-CB 3.32Å; L106-A110 PolarHBondContact O-N 2.9Å
107	F	96	Very high	92.8	Very high	61 Å²	61	33.3 Å²	33.3	27%	0.268	18%	0.176	S	C	.	.	H	α-helix	trans	-60.2	-53	175.5	178.2	-101.4	0	0	0	111.8	C17 V18 A21 G103 F105 A109 A110 V111 V241	C17-F107 HydrophobicContact CB-CE2 4.36Å; V18-F107 HydrophobicContact CG2-CB 3.99Å; V18-F107 HydrophobicContact CG2-CD2 4.43Å; A21-F107 HydrophobicContact CB-CD2 4.11Å; A21-F107 HydrophobicContact CB-CE2 3.93Å; G103-F107 WeakPolarHBondContact O-CB 3.43Å; G103-F107 PolarHBondContact O-N 3.3Å; F105-F107 VanDerWaalsContact C-N 3.35Å; F105-F107 PolarHBondContact O-N 3.09Å; F107-A109 VanDerWaalsContact C-N 3.32Å; F107-A109 PolarHBondContact O-N 2.93Å; F107-A110 WeakPolarHBondContact O-CB 3.28Å; F107-A110 PolarHBondContact O-N 3.43Å; F107-V111 HydrophobicContact CD1-CG2 4.46Å; F107-V111 HydrophobicContact CE1-CG2 4.03Å; F107-V111 HydrophobicContact CE2-CG2 4.31Å; F107-V111 HydrophobicContact CZ-CG2 3.95Å; F107-V111 WeakPolarHBondContact O-CG2 3.25Å; F107-V111 PolarHBondContact O-N 3.33Å; F107-V241 HydrophobicContact CD1-CG1 4.18Å; F107-V241 HydrophobicContact CE1-CG2 4.31Å
108	G	96.8	Very high	93.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.7	-34.9	179.6	0	0	0	0	0	112.7	T104 F105 V111 S112 Y172 I233	T104-G108 PolarHBondContact O-N 2.85Å; T104-G108 VanDerWaalsContact O-N 3.08Å; F105-G108 PolarHBondContact O-N 2.89Å; G108-V111 PolarHBondContact O-N 2.85Å; G108-S112 WeakPolarHBondContact O-CB 3.31Å; G108-S112 PolarHBondContact O-N 3.19Å; G108-Y172 VanDerWaalsContact CA-OH 3.22Å; G108-Y172 WeakPolarHBondContact CA-OH 3.33Å; G108-I233 WeakPolarHBondContact O-CG2 3.44Å
109	A	96.1	Very high	94.1	Very high	11 Å²	11	36 Å²	36	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-45.4	172.8	0	0	0	0	0	111.5	F105 L106 F107 S112 Q113 F169 Y172	F105-A109 VanDerWaalsContact O-CB 3.29Å; F105-A109 WeakPolarHBondContact O-CB 3.43Å; F105-A109 PolarHBondContact O-N 3.46Å; L106-A109 PolarHBondContact O-N 2.87Å; F107-A109 VanDerWaalsContact C-N 3.32Å; F107-A109 PolarHBondContact O-N 2.93Å; A109-S112 PolarHBondContact O-N 3.02Å; A109-Q113 VanDerWaalsContact O-CB 3.3Å; A109-Q113 WeakPolarHBondContact O-CB 3.21Å; A109-Q113 PolarHBondContact O-N 3.45Å; A109-F169 HydrophobicContact CB-CE2 4.19Å; A109-Y172 VanDerWaalsContact CA-CE1 3.49Å; A109-Y172 HydrophobicContact CB-CD1 4.1Å; A109-Y172 HydrophobicContact CB-CE1 3.64Å; A109-Y172 VanDerWaalsContact N-CE1 3.28Å; A109-Y172 PolarHBondContact N-OH 3.08Å
110	A	97	Very high	94.6	Very high	12 Å²	12	33.6 Å²	33.6	10%	0.099	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-45.1	177.4	0	0	0	0	0	111.7	A21 A22 L106 F107 Q113 S114	A21-A110 HydrophobicContact CB-CB 3.91Å; A22-A110 HydrophobicContact CB-CB 3.99Å; L106-A110 WeakPolarHBondContact O-CB 3.32Å; L106-A110 PolarHBondContact O-N 2.9Å; F107-A110 WeakPolarHBondContact O-CB 3.28Å; F107-A110 PolarHBondContact O-N 3.43Å; A110-Q113 PolarHBondContact O-N 3.3Å; A110-S114 WeakPolarHBondContact O-CB 3.43Å; A110-S114 PolarHBondContact O-N 3.12Å; A110-S114 PolarHBondContact O-OG 3.44Å
111	V	97.7	Very high	94.9	Very high	40 Å²	40	29.5 Å²	29.5	24%	0.242	17%	0.165	C	C	.	.	H	α-helix	trans	-59.9	-48.8	174.9	172.9	0	0	0	0	111.1	A21 F107 G108 Q113 S114 L115 I233	A21-V111 HydrophobicContact CB-CG2 3.98Å; F107-V111 HydrophobicContact CD1-CG2 4.46Å; F107-V111 HydrophobicContact CE1-CG2 4.03Å; F107-V111 HydrophobicContact CE2-CG2 4.31Å; F107-V111 HydrophobicContact CZ-CG2 3.95Å; F107-V111 WeakPolarHBondContact O-CG2 3.25Å; F107-V111 PolarHBondContact O-N 3.33Å; G108-V111 PolarHBondContact O-N 2.85Å; V111-Q113 VanDerWaalsContact C-N 3.34Å; V111-Q113 PolarHBondContact O-N 3.29Å; V111-S114 PolarHBondContact O-N 2.78Å; V111-L115 HydrophobicContact CG1-CD1 4.12Å; V111-L115 WeakPolarHBondContact O-CG 3.28Å; V111-L115 PolarHBondContact O-N 3.28Å; V111-I233 HydrophobicContact CG1-CD1 4.21Å; V111-I233 HydrophobicContact CG1-CG2 4.44Å
112	S	97.6	Very high	95.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-42.8	179.9	-168.8	0	0	0	0	112.2	G108 A109 T116 Q229	G108-S112 WeakPolarHBondContact O-CB 3.31Å; G108-S112 PolarHBondContact O-N 3.19Å; A109-S112 PolarHBondContact O-N 3.02Å; S112-T116 WeakPolarHBondContact O-CB 3.39Å; S112-T116 PolarHBondContact O-N 3.44Å; S112-T116 PolarHBondContact O-OG1 3.24Å; S112-Q229 PolarHBondContact OG-NE2 3.45Å; S112-Q229 PolarHBondContact OG-OE1 3.11Å
113	Q	96.4	Very high	95.4	Very high	56 Å²	56	33.9 Å²	33.9	26%	0.262	19%	0.189	S	C	.	.	H	α-helix	trans	-67.7	-43.8	179.6	-173.9	60.9	30.8	0	0	111.4	A109 A110 V111 L115 T116 D117	A109-Q113 VanDerWaalsContact O-CB 3.3Å; A109-Q113 WeakPolarHBondContact O-CB 3.21Å; A109-Q113 PolarHBondContact O-N 3.45Å; A110-Q113 PolarHBondContact O-N 3.3Å; V111-Q113 VanDerWaalsContact C-N 3.34Å; V111-Q113 PolarHBondContact O-N 3.29Å; Q113-L115 PolarHBondContact O-N 3.31Å; Q113-T116 WeakPolarHBondContact O-CB 3.4Å; Q113-T116 PolarHBondContact O-N 2.91Å; Q113-T116 VanDerWaalsContact O-N 3.16Å; Q113-D117 PolarHBondContact NE2-OD1 2.94Å; Q113-D117 PolarHBondContact NE2-OD2 3.37Å; Q113-D117 PolarHBondContact O-N 3.03Å
114	S	97	Very high	95.5	Very high	10 Å²	10	32.8 Å²	32.8	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-41.8	176	-77	0	0	0	0	112.6	A21 S25 A110 V111 T116 L118	A21-S114 WeakPolarHBondContact O-CB 3.25Å; A21-S114 PolarHBondContact O-OG 2.91Å; S25-S114 PolarHBondContact N-OG 2.71Å; A110-S114 WeakPolarHBondContact O-CB 3.43Å; A110-S114 PolarHBondContact O-N 3.12Å; A110-S114 PolarHBondContact O-OG 3.44Å; V111-S114 PolarHBondContact O-N 2.78Å; S114-T116 VanDerWaalsContact C-N 3.35Å; S114-L118 VanDerWaalsContact O-CB 3.23Å; S114-L118 WeakPolarHBondContact O-CB 3.41Å; S114-L118 PolarHBondContact O-N 2.66Å
115	L	97.3	Very high	95.6	Very high	72 Å²	72	34.4 Å²	34.4	38%	0.377	18%	0.181	S	C	.	.	H	α-helix	trans	-65	-39	174.2	-70.8	172.7	0	0	0	112.3	V111 Q113 A119 Y163 I233	V111-L115 HydrophobicContact CG1-CD1 4.12Å; V111-L115 WeakPolarHBondContact O-CG 3.28Å; V111-L115 PolarHBondContact O-N 3.28Å; Q113-L115 PolarHBondContact O-N 3.31Å; L115-A119 PolarHBondContact O-N 3.46Å; L115-A119 VanDerWaalsContact O-N 3.08Å; L115-Y163 VanDerWaalsContact C-OH 3.29Å; L115-Y163 PolarHBondContact O-OH 3.45Å; L115-I233 HydrophobicContact CD1-CD1 3.89Å; L115-I233 HydrophobicContact CD1-CG1 4.28Å
116	T	96.6	Very high	95.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-50.7	177.4	-60.9	0	0	0	0	110.8	S112 Q113 S114 A119 K120 Y163	S112-T116 WeakPolarHBondContact O-CB 3.39Å; S112-T116 PolarHBondContact O-N 3.44Å; S112-T116 PolarHBondContact O-OG1 3.24Å; Q113-T116 WeakPolarHBondContact O-CB 3.4Å; Q113-T116 PolarHBondContact O-N 2.91Å; Q113-T116 VanDerWaalsContact O-N 3.16Å; S114-T116 VanDerWaalsContact C-N 3.35Å; T116-A119 PolarHBondContact O-N 3.48Å; T116-K120 HydrophobicContact CG2-CD 4.13Å; T116-K120 WeakPolarHBondContact O-CG 3.3Å; T116-K120 PolarHBondContact O-N 2.97Å; T116-Y163 WeakPolarHBondContact CA-OH 3.28Å; T116-Y163 HydrophobicContact CG2-CD2 4.32Å; T116-Y163 HydrophobicContact CG2-CE2 4.07Å; T116-Y163 PolarHBondContact N-OH 3.11Å; T116-Y163 WeakPolarHBondContact OG1-CE2 3.23Å
117	D	95.1	Very high	95.8	Very high	8 Å²	8	30.5 Å²	30.5	4%	0.043	16%	0.161	C	C	.	.	H	α-helix	trans	-68.3	-39.5	-177.3	-67.4	-27.3	0	0	0	110.6	S25 L28 Q113 A119 K120 F121	S25-D117 WeakPolarHBondContact CB-OD2 3.3Å; S25-D117 PolarHBondContact OG-OD2 3.46Å; L28-D117 HydrophobicContact CD1-CB 4.21Å; Q113-D117 PolarHBondContact NE2-OD1 2.94Å; Q113-D117 PolarHBondContact NE2-OD2 3.37Å; Q113-D117 PolarHBondContact O-N 3.03Å; D117-A119 VanDerWaalsContact C-N 3.31Å; D117-A119 PolarHBondContact O-N 3.47Å; D117-K120 PolarHBondContact O-N 3.02Å; D117-F121 HydrophobicContact CB-CD2 4.35Å; D117-F121 HydrophobicContact CB-CE2 4.48Å; D117-F121 VanDerWaalsContact O-CD2 3.25Å; D117-F121 WeakPolarHBondContact O-CD2 3.02Å; D117-F121 PolarHBondContact O-N 3.09Å
118	L	95	Very high	95.9	Very high	90 Å²	90	27.9 Å²	27.9	47%	0.471	15%	0.15	S	C	.	.	H	α-helix	trans	-54.2	-47.9	172.5	-179.6	62.8	0	0	0	111.5	L28 S114 T122	L28-L118 HydrophobicContact CD1-CB 4.22Å; L28-L118 HydrophobicContact CD1-CD1 4.45Å; S114-L118 VanDerWaalsContact O-CB 3.23Å; S114-L118 WeakPolarHBondContact O-CB 3.41Å; S114-L118 PolarHBondContact O-N 2.66Å; L118-T122 WeakPolarHBondContact O-CB 3.4Å; L118-T122 PolarHBondContact O-N 3.05Å; L118-T122 PolarHBondContact O-OG1 3.15Å
119	A	95.4	Very high	95.9	Very high	16 Å²	16	28 Å²	28	13%	0.132	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-46.3	177.7	0	0	0	0	0	112	L115 T116 D117 F121 T122 I123 F162 Y163	L115-A119 PolarHBondContact O-N 3.46Å; L115-A119 VanDerWaalsContact O-N 3.08Å; T116-A119 PolarHBondContact O-N 3.48Å; D117-A119 VanDerWaalsContact C-N 3.31Å; D117-A119 PolarHBondContact O-N 3.47Å; A119-F121 PolarHBondContact O-N 3.46Å; A119-T122 PolarHBondContact O-N 3.21Å; A119-I123 HydrophobicContact CB-CD1 4.47Å; A119-I123 VanDerWaalsContact O-CB 3.32Å; A119-I123 WeakPolarHBondContact O-CB 3.25Å; A119-I123 WeakPolarHBondContact O-CG1 3.22Å; A119-I123 PolarHBondContact O-N 3.45Å; A119-F162 CarbonylContact C-O 3.46Å; A119-F162 HydrophobicContact CB-CD1 4.46Å; A119-Y163 HydrophobicContact CB-CD1 3.96Å; A119-Y163 HydrophobicContact CB-CE1 3.67Å
120	K	95	Very high	95.9	Very high	17 Å²	17	27.5 Å²	27.5	7%	0.074	15%	0.147	C	C	.	.	H	α-helix	trans	-59.5	-49.3	-178.9	-76.5	175.6	171.6	178.4	0	112.8	T116 D117 G124 L160 F162 Y163	T116-K120 HydrophobicContact CG2-CD 4.13Å; T116-K120 WeakPolarHBondContact O-CG 3.3Å; T116-K120 PolarHBondContact O-N 2.97Å; D117-K120 PolarHBondContact O-N 3.02Å; K120-G124 PolarHBondContact O-N 2.93Å; K120-G124 VanDerWaalsContact O-N 3.07Å; K120-L160 HydrophobicContact CB-CB 4.25Å; K120-L160 HydrophobicContact CB-CD2 4Å; K120-L160 HydrophobicContact CD-CB 4.31Å; K120-L160 HydrophobicContact CG-CB 4.44Å; K120-F162 WeakPolarHBondContact CA-O 3.25Å; K120-F162 VanDerWaalsContact CG-O 3.29Å; K120-F162 WeakPolarHBondContact CG-O 3.44Å; K120-F162 PolarHBondContact N-O 3.45Å; K120-Y163 WeakPolarHBondContact CE-O 3.37Å
121	F	93.8	Very high	95.9	Very high	20 Å²	20	28 Å²	28	9%	0.088	15%	0.148	C	C	.	.	H	α-helix	trans	-73.6	-31.3	-177.5	-77.3	-81.3	0	0	0	112.5	L28 F32 P34 Y35 D117 A119 L160	L28-F121 HydrophobicContact CB-CD2 3.7Å; L28-F121 HydrophobicContact CB-CE2 3.92Å; L28-F121 HydrophobicContact CB-CG 4.29Å; L28-F121 HydrophobicContact CD1-CD2 4.38Å; L28-F121 HydrophobicContact CD2-CB 4.12Å; L28-F121 HydrophobicContact CD2-CD2 4.49Å; L28-F121 HydrophobicContact CD2-CG 4.35Å; L28-F121 HydrophobicContact CG-CD2 4.42Å; L28-F121 WeakPolarHBondContact O-CZ 3.32Å; F32-F121 HydrophobicContact CB-CD1 3.85Å; F32-F121 HydrophobicContact CB-CE1 4.17Å; F32-F121 HydrophobicContact CB-CG 4.41Å; F32-F121 VanDerWaalsContact O-CE1 3.23Å; F32-F121 WeakPolarHBondContact O-CE1 3.22Å; P34-F121 HydrophobicContact CB-CD1 4.34Å; Y35-F121 WeakPolarHBondContact CB-O 3.39Å; Y35-F121 PolarHBondContact N-O 3.39Å; D117-F121 HydrophobicContact CB-CD2 4.35Å; D117-F121 HydrophobicContact CB-CE2 4.48Å; D117-F121 VanDerWaalsContact O-CD2 3.25Å; D117-F121 WeakPolarHBondContact O-CD2 3.02Å; D117-F121 PolarHBondContact O-N 3.09Å; A119-F121 PolarHBondContact O-N 3.46Å; F121-L160 HydrophobicContact CD1-CD2 4.04Å; F121-L160 HydrophobicContact CD2-CD2 4.47Å; F121-L160 HydrophobicContact CE1-CD1 4.41Å; F121-L160 HydrophobicContact CE1-CD2 4.1Å; F121-L160 HydrophobicContact CG-CD2 4.23Å; F121-L160 HydrophobicContact CZ-CD1 4.15Å; F121-L160 HydrophobicContact CZ-CD2 4.35Å
122	T	93.3	Very high	95.8	Very high	86 Å²	86	28.5 Å²	28.5	53%	0.528	15%	0.153	S	C	.	.	H	α-helix	trans	-76.3	-41.1	178.6	-55.9	0	0	0	0	112.4	Y35 L118 A119	Y35-T122 VanDerWaalsContact CB-O 3.28Å; Y35-T122 WeakPolarHBondContact CB-O 3.16Å; L118-T122 WeakPolarHBondContact O-CB 3.4Å; L118-T122 PolarHBondContact O-N 3.05Å; L118-T122 PolarHBondContact O-OG1 3.15Å; A119-T122 PolarHBondContact O-N 3.21Å
123	I	94.8	Very high	95.7	Very high	62 Å²	62	29.4 Å²	29.4	32%	0.318	16%	0.158	S	C	.	.	H	α-helix	trans	-87.5	-36.3	-173.4	-66.9	166.5	0	0	0	111.9	A119 R125 F162	A119-I123 HydrophobicContact CB-CD1 4.47Å; A119-I123 VanDerWaalsContact O-CB 3.32Å; A119-I123 WeakPolarHBondContact O-CB 3.25Å; A119-I123 WeakPolarHBondContact O-CG1 3.22Å; A119-I123 PolarHBondContact O-N 3.45Å; I123-R125 HydrophobicContact CG2-CB 4.04Å; I123-R125 PolarHBondContact O-N 3.48Å; I123-F162 HydrophobicContact CD1-CD1 3.2Å; I123-F162 HydrophobicContact CD1-CE1 3.52Å; I123-F162 HydrophobicContact CD1-CG 4.07Å; I123-F162 HydrophobicContact CG1-CD1 4.45Å; I123-F162 HydrophobicContact CG2-CB 4.04Å; I123-F162 HydrophobicContact CG2-CG 4.42Å
124	G	93.1	Very high	95.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.146	C	C	.	.			trans	60.5	29	175.6	0	0	0	0	0	114.5	Y35 K120 P126 R159	Y35-G124 WeakPolarHBondContact O-CA 3.38Å; K120-G124 PolarHBondContact O-N 2.93Å; K120-G124 VanDerWaalsContact O-N 3.07Å; G124-P126 WeakPolarHBondContact O-CD 3.3Å; G124-R159 CarbonylContact C-O 3.32Å; G124-R159 VanDerWaalsContact CA-O 3.28Å; G124-R159 WeakPolarHBondContact CA-O 3.44Å
125	R	95.6	Very high	95.6	Very high	53 Å²	53	28.2 Å²	28.2	20%	0.2	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-65.4	125.6	-178.8	-173.5	-176.1	-179.8	175.5	5.2	110	I123 R159 S161 F162 H219 S221 D222	I123-R125 HydrophobicContact CG2-CB 4.04Å; I123-R125 PolarHBondContact O-N 3.48Å; R125-R159 CarbonylContact C-O 2.9Å; R125-R159 PolarHBondContact N-O 2.8Å; R125-R159 CarbonylContact O-C 3.59Å; R125-S161 WeakPolarHBondContact O-CB 3.19Å; R125-S161 PolarHBondContact O-N 2.72Å; R125-F162 HydrophobicContact CB-CB 3.84Å; R125-H219 VanDerWaalsContact CZ-CG 3.46Å; R125-H219 VanDerWaalsContact CZ-ND1 3.35Å; R125-H219 PolarHBondContact NE-ND1 2.91Å; R125-H219 PolarHBondContact NH2-CD2 2.89Å; R125-H219 VanDerWaalsContact NH2-CD2 3.25Å; R125-H219 PolarHBondContact NH2-ND1 3.49Å; R125-S221 PolarHBondContact NH1-OG 3.34Å; R125-S221 VanDerWaalsContact NH1-OG 3.1Å; R125-D222 IonicContact CZ-OD1 3.56Å; R125-D222 IonicContact NE-OD1 3.85Å; R125-D222 IonicContact NH1-OD1 2.68Å; R125-D222 PolarHBondContact NH1-OD1 3.28Å; R125-D222 IonicContact NH1-OD2 3.78Å
126	P	96.1	Very high	95.4	Very high	8 Å²	8	26.7 Å²	26.7	5%	0.052	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-60.7	145.9	172.6	-17.4	28.4	0	0	0	112.1	I39 I46 G124 F130 S158 S161 H219	I39-P126 HydrophobicContact CG2-CB 4.45Å; I39-P126 HydrophobicContact CG2-CG 3.46Å; I39-P126 VanDerWaalsContact CG2-CG 3.46Å; I46-P126 HydrophobicContact CG2-CB 3.95Å; G124-P126 WeakPolarHBondContact O-CD 3.3Å; P126-F130 HydrophobicContact CB-CB 3.84Å; P126-F130 HydrophobicContact CB-CD2 4.16Å; P126-F130 HydrophobicContact CB-CG 3.89Å; P126-S158 CarbonylContact C-O 3.43Å; P126-S158 WeakPolarHBondContact CA-O 3.41Å; P126-S161 WeakPolarHBondContact O-CB 3.33Å; P126-H219 PolarHBondContact O-CE1 3.22Å; P126-H219 VanDerWaalsContact O-CE1 3.26Å
127	R	97.3	Very high	95.2	Very high	18 Å²	18	30.8 Å²	30.8	7%	0.068	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-77.4	161.1	173.2	-69.1	-173.4	-178.6	177.5	6.4	110.6	N129 F130 E157 S158 K217	R127-N129 VanDerWaalsContact CB-OD1 3.24Å; R127-N129 WeakPolarHBondContact CB-OD1 3.48Å; R127-N129 PolarHBondContact O-N 2.88Å; R127-N129 VanDerWaalsContact O-N 3.08Å; R127-F130 VanDerWaalsContact O-CB 3.26Å; R127-F130 WeakPolarHBondContact O-CB 3.23Å; R127-F130 PolarHBondContact O-N 3.29Å; R127-E157 IonicContact CZ-OE1 2.95Å; R127-E157 VanDerWaalsContact CZ-OE1 3.3Å; R127-E157 PolarHBondContact NE-O 3.45Å; R127-E157 IonicContact NH1-OE1 3.3Å; R127-E157 PolarHBondContact NH1-OE1 2.99Å; R127-E157 PolarHBondContact NH2-O 3.47Å; R127-E157 IonicContact NH2-OE1 3.04Å; R127-E157 PolarHBondContact NH2-OE1 3.28Å; R127-S158 WeakPolarHBondContact CB-O 3.44Å; R127-S158 WeakPolarHBondContact CG-O 3.32Å; R127-S158 PolarHBondContact N-O 2.9Å; R127-K217 WeakPolarHBondContact CD-O 3.3Å; R127-K217 WeakPolarHBondContact CG-O 3.15Å
128	P	97.7	Very high	94.9	Very high	7 Å²	7	34.7 Å²	34.7	5%	0.045	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-26	176.8	-26.1	34.7	0	0	0	114.6	S45 I46 R47 Y48 N216	S45-P128 WeakPolarHBondContact O-CA 3.33Å; S45-P128 WeakPolarHBondContact O-CB 3.44Å; I46-P128 CarbonylContact C-O 3.59Å; I46-P128 WeakPolarHBondContact CA-O 3.4Å; I46-P128 VanDerWaalsContact O-O 3.11Å; R47-P128 PolarHBondContact N-O 2.84Å; Y48-P128 WeakPolarHBondContact CB-O 3.34Å; Y48-P128 HydrophobicContact CD2-CB 4.08Å; Y48-P128 HydrophobicContact CG-CB 4.2Å; Y48-P128 PolarHBondContact N-O 3.29Å; P128-N216 HydrophobicContact CB-CB 4.33Å
129	N	96.6	Very high	94.7	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.016	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	15.8	177.4	66.6	-5.8	0	0	0	114.5	Y48 R127 L131 S132 V133 N216	Y48-N129 WeakPolarHBondContact O-CA 3.5Å; R127-N129 VanDerWaalsContact CB-OD1 3.24Å; R127-N129 WeakPolarHBondContact CB-OD1 3.48Å; R127-N129 PolarHBondContact O-N 2.88Å; R127-N129 VanDerWaalsContact O-N 3.08Å; N129-L131 PolarHBondContact O-N 2.89Å; N129-S132 PolarHBondContact O-N 3.29Å; N129-S132 PolarHBondContact O-OG 2.79Å; N129-V133 WeakPolarHBondContact O-CG2 3.42Å; N129-V133 PolarHBondContact O-N 2.57Å; N129-V133 VanDerWaalsContact O-N 3.09Å; N129-N216 HydrophobicContact CB-CB 4.38Å; N129-N216 PolarHBondContact N-O 3.48Å
130	F	96.8	Very high	94.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-49.2	-174.2	174.3	-91.1	0	0	0	112.9	I39 I46 P126 R127 S132 V133 C134 I146 V155 S158 R159	I39-F130 HydrophobicContact CD1-CD1 3.96Å; I39-F130 HydrophobicContact CD1-CE1 3.4Å; I39-F130 HydrophobicContact CD1-CZ 4.3Å; I46-F130 HydrophobicContact CB-CB 4.32Å; I46-F130 HydrophobicContact CD1-CD1 4.42Å; P126-F130 HydrophobicContact CB-CB 3.84Å; P126-F130 HydrophobicContact CB-CD2 4.16Å; P126-F130 HydrophobicContact CB-CG 3.89Å; R127-F130 VanDerWaalsContact O-CB 3.26Å; R127-F130 WeakPolarHBondContact O-CB 3.23Å; R127-F130 PolarHBondContact O-N 3.29Å; F130-S132 VanDerWaalsContact C-N 3.34Å; F130-S132 PolarHBondContact O-N 2.86Å; F130-V133 PolarHBondContact O-N 2.91Å; F130-C134 HydrophobicContact CD1-CB 4.5Å; F130-C134 HydrophobicContact CE1-CB 3.99Å; F130-C134 HydrophobicContact CZ-CB 4.05Å; F130-C134 VanDerWaalsContact O-CB 3.28Å; F130-C134 WeakPolarHBondContact O-CB 3.37Å; F130-C134 PolarHBondContact O-N 3.41Å; F130-I146 HydrophobicContact CE1-CG2 4.33Å; F130-I146 HydrophobicContact CZ-CG2 4.07Å; F130-V155 HydrophobicContact CE2-CG1 4.38Å; F130-S158 WeakPolarHBondContact CD2-OG 3.37Å; F130-R159 HydrophobicContact CD2-CG 4.02Å; F130-R159 HydrophobicContact CE2-CG 3.61Å
131	L	95.7	Very high	94.5	Very high	22 Å²	22	37.5 Å²	37.5	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-68.8	-33.7	-175.7	-70.9	174.2	0	0	0	112.4	I39 I46 R47 N129 V133 A135 P136 I146	I39-L131 HydrophobicContact CD1-CD2 4.09Å; I46-L131 HydrophobicContact CD1-CD1 3.91Å; I46-L131 HydrophobicContact CD1-CD2 4.45Å; I46-L131 HydrophobicContact CD1-CG 3.93Å; I46-L131 HydrophobicContact CG1-CD1 3.82Å; I46-L131 HydrophobicContact CG1-CG 4.07Å; I46-L131 WeakPolarHBondContact O-CB 3.47Å; I46-L131 PolarHBondContact O-N 2.93Å; R47-L131 HydrophobicContact CG-CD1 3.49Å; R47-L131 VanDerWaalsContact CG-CD1 3.49Å; N129-L131 PolarHBondContact O-N 2.89Å; L131-V133 VanDerWaalsContact C-N 3.34Å; L131-A135 PolarHBondContact O-N 2.9Å; L131-P136 HydrophobicContact CD2-CG 4.4Å; L131-I146 HydrophobicContact CD2-CD1 4.15Å
132	S	95.8	Very high	94.5	Very high	51 Å²	51	42.9 Å²	42.9	36%	0.357	26%	0.259	S	S	.	.	H	α-helix	trans	-69.2	-32.5	174.9	62.5	0	0	0	0	112.5	Y48 Y50 N129 F130	Y48-S132 WeakPolarHBondContact O-CB 3.24Å; Y48-S132 PolarHBondContact O-OG 3.22Å; Y50-S132 PolarHBondContact N-OG 2.87Å; N129-S132 PolarHBondContact O-N 3.29Å; N129-S132 PolarHBondContact O-OG 2.79Å; F130-S132 VanDerWaalsContact C-N 3.34Å; F130-S132 PolarHBondContact O-N 2.86Å
133	V	95.8	Very high	94.5	Very high	18 Å²	18	40.2 Å²	40.2	11%	0.109	24%	0.243	C	C	.	.	H	α-helix	trans	-78	-38.7	174.6	174	0	0	0	0	112.3	Y50 N129 F130 L131 N154 V155	Y50-V133 HydrophobicContact CD2-CG2 3.51Å; Y50-V133 HydrophobicContact CE2-CG2 4.23Å; Y50-V133 HydrophobicContact CG-CG2 4.31Å; N129-V133 WeakPolarHBondContact O-CG2 3.42Å; N129-V133 PolarHBondContact O-N 2.57Å; N129-V133 VanDerWaalsContact O-N 3.09Å; F130-V133 PolarHBondContact O-N 2.91Å; L131-V133 VanDerWaalsContact C-N 3.34Å; V133-N154 HydrophobicContact CG1-CB 3.66Å; V133-V155 HydrophobicContact CG1-CG2 4.29Å
134	C	95.1	Very high	94.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.6	-40.2	179.8	173.9	0	0	0	0	112.1	F130 C148 T149 G150	F130-C134 HydrophobicContact CD1-CB 4.5Å; F130-C134 HydrophobicContact CE1-CB 3.99Å; F130-C134 HydrophobicContact CZ-CB 4.05Å; F130-C134 VanDerWaalsContact O-CB 3.28Å; F130-C134 WeakPolarHBondContact O-CB 3.37Å; F130-C134 PolarHBondContact O-N 3.41Å; C134-C148 HydrophobicContact CB-CB 3.98Å; C134-C148 WeakPolarHBondContact CB-SG 3.22Å; C134-C148 CarbonylContact O-C 3.55Å; C134-C148 WeakPolarHBondContact O-CA 3.34Å; C134-C148 WeakPolarHBondContact O-CB 3.45Å; C134-C148 VanDerWaalsContact SG-CA 3.52Å; C134-C148 WeakPolarHBondContact SG-CB 3.29Å; C134-C148 CovalentContact SG-SG 2.04Å; C134-C148 PolarHBondContact SG-SG 3.23Å; C134-T149 PolarHBondContact O-N 2.66Å; C134-G150 PolarHBondContact O-N 3.47Å
135	A	95.1	Very high	94.1	Very high	42 Å²	42	46.5 Å²	46.5	35%	0.347	28%	0.279	S	S	.	.			trans	47.2	66.3	-174.4	0	0	0	0	0	111.6	L131 T149	L131-A135 PolarHBondContact O-N 2.9Å; A135-T149 VanDerWaalsContact CB-OG1 3.3Å; A135-T149 WeakPolarHBondContact CB-OG1 3.46Å; A135-T149 PolarHBondContact O-N 2.62Å; A135-T149 PolarHBondContact O-OG1 2.9Å
136	P	94	Very high	93.8	Very high	39 Å²	39	45.1 Å²	45.1	25%	0.253	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-69.8	141.3	-172.9	29.6	-35.4	0	0	0	112.5	L131 S138 C139 I146 N147	L131-P136 HydrophobicContact CD2-CG 4.4Å; P136-S138 VanDerWaalsContact C-N 3.33Å; P136-C139 HydrophobicContact CB-CB 4.32Å; P136-C139 HydrophobicContact CG-CB 4.11Å; P136-I146 HydrophobicContact CB-CD1 3.58Å; P136-I146 HydrophobicContact CB-CG1 3.73Å; P136-I146 HydrophobicContact CG-CD1 4.02Å; P136-N147 WeakPolarHBondContact CA-O 3.27Å
137	T	91.4	Very high	93.6	Very high	87 Å²	87	49.8 Å²	49.8	53%	0.534	30%	0.3	S	S	.	.	S	Bend	trans	-68.5	-33.1	175.8	53.9	0	0	0	0	112.8	N147 T149	T137-N147 PolarHBondContact N-O 3.21Å; T137-N147 PolarHBondContact OG1-ND2 3.42Å; T137-T149 HydrophobicContact CG2-CG2 3.53Å
138	S	90.1	Very high	93.5	Very high	90 Å²	90	50.5 Å²	50.5	63%	0.629	31%	0.307	S	S	*	.			trans	-153.6	131.3	178.5	55.8	0	0	0	0	108.5	P136	P136-S138 VanDerWaalsContact C-N 3.33Å
139	C	90.6	Very high	93.4	Very high	46 Å²	46	54.7 Å²	54.7	31%	0.311	33%	0.333	S	S	.	.			trans	-143.6	119	177.7	-155	0	0	0	0	108.3	C41 P136 I146	C41-C139 HydrophobicContact CB-CB 3.74Å; C41-C139 WeakPolarHBondContact CB-SG 3.46Å; C41-C139 WeakPolarHBondContact SG-CA 3.46Å; C41-C139 WeakPolarHBondContact SG-CB 3.5Å; C41-C139 CovalentContact SG-SG 2.02Å; C41-C139 PolarHBondContact SG-SG 2.88Å; P136-C139 HydrophobicContact CB-CB 4.32Å; P136-C139 HydrophobicContact CG-CB 4.11Å; C139-I146 HydrophobicContact CB-CD1 4.46Å; C139-I146 VanDerWaalsContact SG-CD1 3.54Å
140	S	92.5	Very high	93.2	Very high	106 Å²	106	55.6 Å²	55.6	74%	0.741	34%	0.343	S	S	*	.			trans	-146	134.1	174	-179	0	0	0	0	109.8	C41	C41-S140 PolarHBondContact SG-N 3.34Å
141	G	92.9	Very high	93.1	Very high	29 Å²	29	58.5 Å²	58.5	30%	0.299	36%	0.364	S	S	.	.	S	Bend	trans	63.8	-146.1	178.6	0	0	0	0	0	113.9	H40 C41	H40-G141 WeakPolarHBondContact CA-O 3.33Å; C41-G141 PolarHBondContact N-O 3.37Å; C41-G141 PolarHBondContact SG-O 3.34Å
142	Y	94.1	Very high	92.9	Very high	133 Å²	133	62.4 Å²	62.4	52%	0.522	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.1	178.1	179.7	-106	0	0	0	111.2	G38 I39 H40 V144	G38-Y142 WeakPolarHBondContact CA-OH 3.31Å; I39-Y142 WeakPolarHBondContact O-CA 3.5Å; H40-Y142 AromaticContact CD2-CD2 3.9Å; H40-Y142 AromaticContact CE1-CD2 3.43Å; H40-Y142 VanDerWaalsContact CE1-CD2 3.43Å; H40-Y142 WeakPolarHBondContact CE1-CD2 3.43Å; H40-Y142 AromaticContact ND1-CD2 3.81Å; H40-Y142 AromaticContact NE2-CD2 3.47Å; H40-Y142 WeakPolarHBondContact NE2-CD2 3.37Å; H40-Y142 AromaticContact NE2-CG 3.96Å; Y142-V144 HydrophobicContact CE1-CG2 3.79Å
143	V	93.5	Very high	92.7	Very high	31 Å²	31	69.3 Å²	69.3	19%	0.188	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.4	-179.4	-62.3	0	0	0	0	111.4	G38 I39 I146	G38-V143 CarbonylContact C-O 3.51Å; G38-V143 WeakPolarHBondContact CA-O 3.33Å; I39-V143 HydrophobicContact CD1-CG2 4.19Å; I39-V143 HydrophobicContact CG1-CG2 3.7Å; I39-V143 PolarHBondContact N-O 2.99Å; I39-V143 PolarHBondContact O-N 3.4Å; V143-I146 HydrophobicContact CG2-CB 4.2Å; V143-I146 HydrophobicContact CG2-CD1 4.27Å; V143-I146 HydrophobicContact CG2-CG1 4.47Å
144	V	89.6	Confident	92.5	Very high	61 Å²	61	71.5 Å²	71.5	37%	0.37	42%	0.42	S	S	.	.	S	Bend	trans	-89.1	-51.2	173.3	-179.3	0	0	0	0	110.3	Y142	Y142-V144 HydrophobicContact CE1-CG2 3.79Å
145	N	89.2	Confident	92.5	Very high	132 Å²	132	72.3 Å²	72.3	71%	0.706	43%	0.425	S	S	*	.	S	Bend	trans	-101.6	114.8	176.2	-67.6	-44.4	0	0	0	109
146	I	90.6	Very high	92.3	Very high	25 Å²	25	73.2 Å²	73.2	13%	0.128	43%	0.426	C	S	.	.			trans	-113	133.5	179.8	-171.9	168.5	0	0	0	109.1	I39 F130 L131 P136 C139 V143 C148	I39-I146 HydrophobicContact CD1-CD1 3.79Å; I39-I146 HydrophobicContact CD1-CG2 4.43Å; F130-I146 HydrophobicContact CE1-CG2 4.33Å; F130-I146 HydrophobicContact CZ-CG2 4.07Å; L131-I146 HydrophobicContact CD2-CD1 4.15Å; P136-I146 HydrophobicContact CB-CD1 3.58Å; P136-I146 HydrophobicContact CB-CG1 3.73Å; P136-I146 HydrophobicContact CG-CD1 4.02Å; C139-I146 HydrophobicContact CB-CD1 4.46Å; C139-I146 VanDerWaalsContact SG-CD1 3.54Å; V143-I146 HydrophobicContact CG2-CB 4.2Å; V143-I146 HydrophobicContact CG2-CD1 4.27Å; V143-I146 HydrophobicContact CG2-CG1 4.47Å; I146-C148 PolarHBondContact O-N 2.9Å
147	N	92.5	Very high	92.2	Very high	106 Å²	106	74.7 Å²	74.7	57%	0.567	43%	0.429	S	S	*	.			trans	-83.2	92.6	179.7	-168.8	38.3	0	0	0	110	P136 T137	P136-N147 WeakPolarHBondContact CA-O 3.27Å; T137-N147 PolarHBondContact N-O 3.21Å; T137-N147 PolarHBondContact OG1-ND2 3.42Å
148	C	93.8	Very high	92.4	Very high	32 Å²	32	70.8 Å²	70.8	22%	0.216	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-83.6	137.4	179.6	-60.6	0	0	0	0	111.3	C134 I146 V155	C134-C148 HydrophobicContact CB-CB 3.98Å; C134-C148 WeakPolarHBondContact CB-SG 3.22Å; C134-C148 CarbonylContact O-C 3.55Å; C134-C148 WeakPolarHBondContact O-CA 3.34Å; C134-C148 WeakPolarHBondContact O-CB 3.45Å; C134-C148 VanDerWaalsContact SG-CA 3.52Å; C134-C148 WeakPolarHBondContact SG-CB 3.29Å; C134-C148 CovalentContact SG-SG 2.04Å; C134-C148 PolarHBondContact SG-SG 3.23Å; I146-C148 PolarHBondContact O-N 2.9Å; C148-V155 HydrophobicContact CB-CG1 4.24Å; C148-V155 HydrophobicContact CB-CG2 3.95Å
149	T	95.6	Very high	92.6	Very high	95 Å²	95	67.1 Å²	67.1	58%	0.583	38%	0.378	S	S	*	.			trans	-94.8	-13.4	171.5	62.3	0	0	0	0	113	C134 A135 T137	C134-T149 PolarHBondContact O-N 2.66Å; A135-T149 VanDerWaalsContact CB-OG1 3.3Å; A135-T149 WeakPolarHBondContact CB-OG1 3.46Å; A135-T149 PolarHBondContact O-N 2.62Å; A135-T149 PolarHBondContact O-OG1 2.9Å; T137-T149 HydrophobicContact CG2-CG2 3.53Å
150	G	93.4	Very high	92.8	Very high	23 Å²	23	65.9 Å²	65.9	24%	0.237	37%	0.368	C	S	.	.	S	Bend	trans	-68.9	170.5	176.9	0	0	0	0	0	114.4	C134	C134-G150 PolarHBondContact O-N 3.47Å
151	S	94	Very high	93	Very high	61 Å²	61	60.9 Å²	60.9	43%	0.427	33%	0.333	S	S	.	.			trans	-57.8	126.5	-179.9	177	0	0	0	0	111.7	R153 N154 V155	S151-R153 PolarHBondContact O-N 3Å; S151-R153 VanDerWaalsContact O-N 3.09Å; S151-N154 PolarHBondContact O-N 3.45Å; S151-V155 WeakPolarHBondContact O-CG2 3.41Å; S151-V155 PolarHBondContact O-N 3.37Å
152	P	91.4	Very high	93.1	Very high	103 Å²	103	61.8 Å²	61.8	67%	0.669	33%	0.329	S	S	*	.	H	α-helix	trans	-54.4	-36.4	-176.8	-28.5	34.7	0	0	0	113.7	T156	P152-T156 WeakPolarHBondContact O-CB 3.4Å; P152-T156 PolarHBondContact O-N 3.28Å; P152-T156 PolarHBondContact O-OG1 3.04Å
153	R	90.8	Very high	93.2	Very high	197 Å²	197	56.2 Å²	56.2	74%	0.743	31%	0.307	S	S	*	.	H	α-helix	trans	-65.5	-49.1	178.2	-178.7	177.4	174.7	169.4	-0.1	111.4	S151 V155 T156 E157	S151-R153 PolarHBondContact O-N 3Å; S151-R153 VanDerWaalsContact O-N 3.09Å; R153-V155 VanDerWaalsContact C-N 3.33Å; R153-V155 PolarHBondContact O-N 3.45Å; R153-T156 PolarHBondContact O-N 2.87Å; R153-E157 WeakPolarHBondContact O-CB 3.15Å; R153-E157 PolarHBondContact O-N 3.48Å
154	N	92.5	Very high	93.4	Very high	64 Å²	64	54.8 Å²	54.8	34%	0.342	30%	0.298	S	S	.	.	H	α-helix	trans	-67.7	-37	-179.4	-66	-4.2	0	0	0	111.2	V133 S151 E157 S158	V133-N154 HydrophobicContact CG1-CB 3.66Å; S151-N154 PolarHBondContact O-N 3.45Å; N154-E157 PolarHBondContact O-N 2.98Å; N154-S158 VanDerWaalsContact O-CB 3.31Å; N154-S158 WeakPolarHBondContact O-CB 3Å; N154-S158 PolarHBondContact O-N 3.48Å; N154-S158 PolarHBondContact O-OG 3.01Å
155	V	94.1	Very high	93.7	Very high	17 Å²	17	52 Å²	52	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-45.9	174	174	0	0	0	0	110.5	F130 V133 C148 S151 R153 E157 S158 R159	F130-V155 HydrophobicContact CE2-CG1 4.38Å; V133-V155 HydrophobicContact CG1-CG2 4.29Å; C148-V155 HydrophobicContact CB-CG1 4.24Å; C148-V155 HydrophobicContact CB-CG2 3.95Å; S151-V155 WeakPolarHBondContact O-CG2 3.41Å; S151-V155 PolarHBondContact O-N 3.37Å; R153-V155 VanDerWaalsContact C-N 3.33Å; R153-V155 PolarHBondContact O-N 3.45Å; V155-E157 VanDerWaalsContact C-N 3.35Å; V155-E157 PolarHBondContact O-N 3.08Å; V155-S158 WeakPolarHBondContact CA-OG 3.01Å; V155-S158 PolarHBondContact O-N 3.48Å; V155-S158 PolarHBondContact O-OG 2.65Å; V155-R159 PolarHBondContact O-N 3.2Å
156	T	92.4	Very high	94	Very high	61 Å²	61	46.2 Å²	46.2	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176.4	-58.9	0	0	0	0	110.9	P34 P152 R153 S158 R159	P34-T156 HydrophobicContact CG-CG2 3.9Å; P152-T156 WeakPolarHBondContact O-CB 3.4Å; P152-T156 PolarHBondContact O-N 3.28Å; P152-T156 PolarHBondContact O-OG1 3.04Å; R153-T156 PolarHBondContact O-N 2.87Å; T156-S158 VanDerWaalsContact C-N 3.29Å; T156-S158 PolarHBondContact O-N 3.35Å; T156-R159 WeakPolarHBondContact O-CB 3.01Å; T156-R159 PolarHBondContact O-N 3.39Å; T156-R159 VanDerWaalsContact O-N 3.09Å
157	E	92.3	Very high	94.4	Very high	70 Å²	70	45 Å²	45	33%	0.327	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-35.6	179.3	-155.6	-156.9	133.3	0	0	112.5	R127 R153 N154 V155 R159 L160	R127-E157 IonicContact CZ-OE1 2.95Å; R127-E157 VanDerWaalsContact CZ-OE1 3.3Å; R127-E157 PolarHBondContact NE-O 3.45Å; R127-E157 IonicContact NH1-OE1 3.3Å; R127-E157 PolarHBondContact NH1-OE1 2.99Å; R127-E157 PolarHBondContact NH2-O 3.47Å; R127-E157 IonicContact NH2-OE1 3.04Å; R127-E157 PolarHBondContact NH2-OE1 3.28Å; R153-E157 WeakPolarHBondContact O-CB 3.15Å; R153-E157 PolarHBondContact O-N 3.48Å; N154-E157 PolarHBondContact O-N 2.98Å; V155-E157 VanDerWaalsContact C-N 3.35Å; V155-E157 PolarHBondContact O-N 3.08Å; E157-R159 PolarHBondContact O-N 3.35Å; E157-R159 VanDerWaalsContact O-N 3.12Å; E157-L160 WeakPolarHBondContact O-CB 3.26Å; E157-L160 PolarHBondContact O-N 2.75Å
158	S	94.6	Very high	94.6	Very high	4 Å²	4	40 Å²	40	3%	0.028	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-6.9	176.6	72.1	0	0	0	0	113.8	P126 R127 F130 N154 V155 T156	P126-S158 CarbonylContact C-O 3.43Å; P126-S158 WeakPolarHBondContact CA-O 3.41Å; R127-S158 WeakPolarHBondContact CB-O 3.44Å; R127-S158 WeakPolarHBondContact CG-O 3.32Å; R127-S158 PolarHBondContact N-O 2.9Å; F130-S158 WeakPolarHBondContact CD2-OG 3.37Å; N154-S158 VanDerWaalsContact O-CB 3.31Å; N154-S158 WeakPolarHBondContact O-CB 3Å; N154-S158 PolarHBondContact O-N 3.48Å; N154-S158 PolarHBondContact O-OG 3.01Å; V155-S158 WeakPolarHBondContact CA-OG 3.01Å; V155-S158 PolarHBondContact O-N 3.48Å; V155-S158 PolarHBondContact O-OG 2.65Å; T156-S158 VanDerWaalsContact C-N 3.29Å; T156-S158 PolarHBondContact O-N 3.35Å
159	R	94.6	Very high	94.8	Very high	13 Å²	13	40.9 Å²	40.9	5%	0.049	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	1.1	170.6	-64.9	-178.8	170.2	-87.9	4.5	113.9	P34 R37 G124 R125 F130 V155 T156 E157	P34-R159 HydrophobicContact CG-CB 4.2Å; R37-R159 PolarHBondContact O-NH1 2.91Å; R37-R159 VanDerWaalsContact O-NH1 3.12Å; G124-R159 CarbonylContact C-O 3.32Å; G124-R159 VanDerWaalsContact CA-O 3.28Å; G124-R159 WeakPolarHBondContact CA-O 3.44Å; R125-R159 CarbonylContact C-O 2.9Å; R125-R159 PolarHBondContact N-O 2.8Å; R125-R159 CarbonylContact O-C 3.59Å; F130-R159 HydrophobicContact CD2-CG 4.02Å; F130-R159 HydrophobicContact CE2-CG 3.61Å; V155-R159 PolarHBondContact O-N 3.2Å; T156-R159 WeakPolarHBondContact O-CB 3.01Å; T156-R159 PolarHBondContact O-N 3.39Å; T156-R159 VanDerWaalsContact O-N 3.09Å; E157-R159 PolarHBondContact O-N 3.35Å; E157-R159 VanDerWaalsContact O-N 3.12Å
160	L	94.7	Very high	94.9	Very high	21 Å²	21	36.4 Å²	36.4	11%	0.11	19%	0.19	C	C	.	.			trans	-107	55.6	-176.2	-59.4	173.6	0	0	0	111	P34 K120 F121 E157	P34-L160 HydrophobicContact CB-CD2 3.67Å; P34-L160 HydrophobicContact CG-CD2 4.22Å; K120-L160 HydrophobicContact CB-CB 4.25Å; K120-L160 HydrophobicContact CB-CD2 4Å; K120-L160 HydrophobicContact CD-CB 4.31Å; K120-L160 HydrophobicContact CG-CB 4.44Å; F121-L160 HydrophobicContact CD1-CD2 4.04Å; F121-L160 HydrophobicContact CD2-CD2 4.47Å; F121-L160 HydrophobicContact CE1-CD1 4.41Å; F121-L160 HydrophobicContact CE1-CD2 4.1Å; F121-L160 HydrophobicContact CG-CD2 4.23Å; F121-L160 HydrophobicContact CZ-CD1 4.15Å; F121-L160 HydrophobicContact CZ-CD2 4.35Å; E157-L160 WeakPolarHBondContact O-CB 3.26Å; E157-L160 PolarHBondContact O-N 2.75Å
161	S	96	Very high	95.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.			trans	-84.2	-44.1	-177.2	-159.9	0	0	0	0	113.7	R125 P126 Y163 H218 D222	R125-S161 WeakPolarHBondContact O-CB 3.19Å; R125-S161 PolarHBondContact O-N 2.72Å; P126-S161 WeakPolarHBondContact O-CB 3.33Å; S161-Y163 CarbonylContact O-C 3.21Å; S161-Y163 WeakPolarHBondContact O-CA 3.1Å; S161-H218 PolarHBondContact O-CE1 3.41Å; S161-H218 PolarHBondContact O-ND1 3.38Å; S161-H218 PolarHBondContact OG-ND1 3.16Å; S161-D222 WeakPolarHBondContact CB-OD2 3.21Å; S161-D222 PolarHBondContact OG-OD2 2.96Å
162	F	96.1	Very high	95.3	Very high	48 Å²	48	33.1 Å²	33.1	21%	0.211	16%	0.162	C	C	.	.	S	Bend	trans	-91.9	125.2	-170.9	-171.1	-81.4	0	0	0	112.2	A119 K120 I123 R125 D222 V225	A119-F162 CarbonylContact C-O 3.46Å; A119-F162 HydrophobicContact CB-CD1 4.46Å; K120-F162 WeakPolarHBondContact CA-O 3.25Å; K120-F162 VanDerWaalsContact CG-O 3.29Å; K120-F162 WeakPolarHBondContact CG-O 3.44Å; K120-F162 PolarHBondContact N-O 3.45Å; I123-F162 HydrophobicContact CD1-CD1 3.2Å; I123-F162 HydrophobicContact CD1-CE1 3.52Å; I123-F162 HydrophobicContact CD1-CG 4.07Å; I123-F162 HydrophobicContact CG1-CD1 4.45Å; I123-F162 HydrophobicContact CG2-CB 4.04Å; I123-F162 HydrophobicContact CG2-CG 4.42Å; R125-F162 HydrophobicContact CB-CB 3.84Å; F162-D222 WeakPolarHBondContact CD2-OD1 3.21Å; F162-V225 HydrophobicContact CE1-CG1 4.46Å; F162-V225 HydrophobicContact CE2-CG2 4.2Å; F162-V225 HydrophobicContact CZ-CB 4.32Å; F162-V225 HydrophobicContact CZ-CG1 3.95Å; F162-V225 HydrophobicContact CZ-CG2 4.16Å
163	Y	96.3	Very high	95.6	Very high	17 Å²	17	28.2 Å²	28.2	7%	0.067	13%	0.13	C	C	.	.	S	Bend	cis	-95.2	172.6	-21.4	49.8	-99.4	0	0	0	110.4	L115 T116 A119 K120 S161 G165 A168 D222 V225 G226 Q229	L115-Y163 VanDerWaalsContact C-OH 3.29Å; L115-Y163 PolarHBondContact O-OH 3.45Å; T116-Y163 WeakPolarHBondContact CA-OH 3.28Å; T116-Y163 HydrophobicContact CG2-CD2 4.32Å; T116-Y163 HydrophobicContact CG2-CE2 4.07Å; T116-Y163 PolarHBondContact N-OH 3.11Å; T116-Y163 WeakPolarHBondContact OG1-CE2 3.23Å; A119-Y163 HydrophobicContact CB-CD1 3.96Å; A119-Y163 HydrophobicContact CB-CE1 3.67Å; K120-Y163 WeakPolarHBondContact CE-O 3.37Å; S161-Y163 CarbonylContact O-C 3.21Å; S161-Y163 WeakPolarHBondContact O-CA 3.1Å; Y163-G165 PolarHBondContact O-N 3.3Å; Y163-G165 VanDerWaalsContact O-N 3.16Å; Y163-A168 HydrophobicContact CD2-CB 4.22Å; Y163-A168 HydrophobicContact CE2-CB 3.93Å; Y163-D222 VanDerWaalsContact CB-O 3.29Å; Y163-D222 WeakPolarHBondContact CB-O 3.18Å; Y163-V225 HydrophobicContact CD1-CG1 3.6Å; Y163-V225 HydrophobicContact CE1-CG1 4.3Å; Y163-V225 HydrophobicContact CG-CB 4.43Å; Y163-V225 HydrophobicContact CG-CG1 3.87Å; Y163-G226 VanDerWaalsContact CD2-CA 3.48Å; Y163-Q229 HydrophobicContact CE2-CB 4.14Å; Y163-Q229 HydrophobicContact CE2-CG 4.08Å; Y163-Q229 VanDerWaalsContact CE2-OE1 3.3Å; Y163-Q229 VanDerWaalsContact OH-CG 3.29Å; Y163-Q229 WeakPolarHBondContact OH-CG 3.43Å; Y163-Q229 PolarHBondContact OH-OE1 3.29Å
164	S	97.3	Very high	95.9	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.095	C	C	.	.			trans	-66.2	114.9	-174.8	170.7	0	0	0	0	111.7	S167 A168 D222	S164-S167 VanDerWaalsContact CB-OG 3.28Å; S164-S167 WeakPolarHBondContact CB-OG 3.47Å; S164-S167 PolarHBondContact O-N 3.38Å; S164-S167 WeakPolarHBondContact OG-CB 3.46Å; S164-S167 PolarHBondContact OG-N 3.32Å; S164-S167 PolarHBondContact OG-OG 2.93Å; S164-A168 WeakPolarHBondContact O-CB 3.34Å; S164-A168 PolarHBondContact O-N 2.79Å; S164-D222 PolarHBondContact N-O 3.32Å
165	G	95.8	Very high	96.1	Very high	3 Å²	3	17.3 Å²	17.3	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-69.1	-32.4	177.1	0	0	0	0	0	113.9	Y163 S167 F169	Y163-G165 PolarHBondContact O-N 3.3Å; Y163-G165 VanDerWaalsContact O-N 3.16Å; G165-S167 VanDerWaalsContact C-N 3.31Å; G165-S167 PolarHBondContact O-N 3.25Å; G165-F169 WeakPolarHBondContact O-CB 3.45Å; G165-F169 PolarHBondContact O-N 2.85Å
166	H	96	Very high	96.3	Very high	11 Å²	11	16.5 Å²	16.5	5%	0.051	8%	0.082	C	C	.	.	H	α-helix	trans	-64.2	-39.3	172.6	-73.5	88.6	0	0	0	111.3	H57 M60 G170 V208 R212	H57-H166 AromaticContact CD2-CE1 3.46Å; H57-H166 PolarHBondContact CD2-CE1 3.49Å; H57-H166 VanDerWaalsContact CD2-CE1 3.46Å; H57-H166 AromaticContact CD2-NE2 3.62Å; H57-H166 AromaticContact CE1-CE1 3.15Å; H57-H166 PolarHBondContact CE1-CE1 2.8Å; H57-H166 AromaticContact CE1-ND1 3.7Å; H57-H166 AromaticContact CE1-NE2 3.55Å; H57-H166 AromaticContact CG-CE1 3.77Å; H57-H166 AromaticContact CG-NE2 3.52Å; H57-H166 AromaticContact ND1-CE1 3.59Å; H57-H166 AromaticContact ND1-NE2 3.48Å; H57-H166 PolarHBondContact ND1-NE2 3.45Å; H57-H166 AromaticContact NE2-CE1 3.05Å; H57-H166 PolarHBondContact NE2-CE1 2.85Å; H57-H166 AromaticContact NE2-ND1 3.89Å; H57-H166 AromaticContact NE2-NE2 3.65Å; M60-H166 WeakPolarHBondContact CE-O 3.49Å; M60-H166 HydrophobicContact SD-CB 4.27Å; H166-G170 PolarHBondContact O-N 3.16Å; H166-V208 HydrophobicContact CB-CG1 3.94Å; H166-R212 HydrophobicContact CB-CG 3.99Å; H166-R212 PolarHBondContact CD2-NH1 2.92Å; H166-R212 PolarHBondContact CE1-NH1 3.21Å; H166-R212 PolarHBondContact ND1-NH1 3.24Å; H166-R212 PolarHBondContact NE2-NH1 3.19Å
167	S	97.9	Very high	96.4	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-70.1	-46.2	178.7	-54.8	0	0	0	0	111.2	S164 G165 M171	S164-S167 VanDerWaalsContact CB-OG 3.28Å; S164-S167 WeakPolarHBondContact CB-OG 3.47Å; S164-S167 PolarHBondContact O-N 3.38Å; S164-S167 WeakPolarHBondContact OG-CB 3.46Å; S164-S167 PolarHBondContact OG-N 3.32Å; S164-S167 PolarHBondContact OG-OG 2.93Å; G165-S167 VanDerWaalsContact C-N 3.31Å; G165-S167 PolarHBondContact O-N 3.25Å; S167-M171 WeakPolarHBondContact O-CB 3.42Å; S167-M171 PolarHBondContact O-N 3.49Å
168	A	98.1	Very high	96.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-61.3	-55.5	177.6	0	0	0	0	0	113	Y163 S164 G170 M171 Y172 G226 Q229 G230	Y163-A168 HydrophobicContact CD2-CB 4.22Å; Y163-A168 HydrophobicContact CE2-CB 3.93Å; S164-A168 WeakPolarHBondContact O-CB 3.34Å; S164-A168 PolarHBondContact O-N 2.79Å; A168-G170 VanDerWaalsContact C-N 3.3Å; A168-G170 PolarHBondContact O-N 3.15Å; A168-M171 PolarHBondContact O-N 3.36Å; A168-Y172 WeakPolarHBondContact O-CB 3.31Å; A168-Y172 PolarHBondContact O-N 3.19Å; A168-G226 WeakPolarHBondContact CA-O 3.35Å; A168-Q229 VanDerWaalsContact CB-OE1 3.23Å; A168-G230 WeakPolarHBondContact O-CA 3.15Å
169	F	96.8	Very high	96.6	Very high	51 Å²	51	12.3 Å²	12.3	22%	0.224	6%	0.059	C	C	.	.	H	α-helix	trans	-62.6	-39.4	179.9	-176.8	-112.9	0	0	0	111.4	M60 A109 G165 Y172 C173	M60-F169 HydrophobicContact CE-CB 4Å; M60-F169 HydrophobicContact CE-CD1 3.49Å; M60-F169 VanDerWaalsContact CE-CD1 3.49Å; M60-F169 HydrophobicContact CE-CE1 4.42Å; M60-F169 HydrophobicContact CE-CG 4.18Å; M60-F169 HydrophobicContact SD-CD1 3.99Å; A109-F169 HydrophobicContact CB-CE2 4.19Å; G165-F169 WeakPolarHBondContact O-CB 3.45Å; G165-F169 PolarHBondContact O-N 2.85Å; F169-Y172 PolarHBondContact O-N 3.35Å; F169-C173 VanDerWaalsContact CE2-SG 3.52Å; F169-C173 VanDerWaalsContact CZ-SG 3.56Å; F169-C173 WeakPolarHBondContact O-CB 3.32Å; F169-C173 PolarHBondContact O-N 2.85Å; F169-C173 PolarHBondContact O-SG 2.98Å
170	G	97.3	Very high	96.5	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-46.2	-179	0	0	0	0	0	111.8	H166 A168 C173 M174 S205	H166-G170 PolarHBondContact O-N 3.16Å; A168-G170 VanDerWaalsContact C-N 3.3Å; A168-G170 PolarHBondContact O-N 3.15Å; G170-C173 PolarHBondContact O-N 2.96Å; G170-M174 WeakPolarHBondContact O-CB 3.38Å; G170-M174 VanDerWaalsContact O-CG 3.28Å; G170-M174 WeakPolarHBondContact O-CG 3.48Å; G170-M174 PolarHBondContact O-N 2.8Å; G170-S205 VanDerWaalsContact C-OG 3.23Å
171	M	98.4	Very high	96.3	Very high	15 Å²	15	11 Å²	11	7%	0.074	5%	0.054	C	C	.	.	H	α-helix	trans	-68.1	-43.3	179.5	-177.4	56.5	71.6	0	0	110.8	S167 A168 C173 L175 V202 S205 L206 L227 A231	S167-M171 WeakPolarHBondContact O-CB 3.42Å; S167-M171 PolarHBondContact O-N 3.49Å; A168-M171 PolarHBondContact O-N 3.36Å; M171-C173 PolarHBondContact O-N 2.92Å; M171-L175 WeakPolarHBondContact O-CB 3.39Å; M171-L175 PolarHBondContact O-N 2.95Å; M171-L175 HydrophobicContact SD-CB 4.18Å; M171-V202 HydrophobicContact CE-CG1 4.34Å; M171-S205 WeakPolarHBondContact CA-OG 3.31Å; M171-S205 WeakPolarHBondContact CB-OG 3.37Å; M171-S205 PolarHBondContact N-OG 3.23Å; M171-L206 HydrophobicContact CE-CD2 4.08Å; M171-L227 HydrophobicContact CB-CD2 3.95Å; M171-L227 HydrophobicContact CE-CB 4.4Å; M171-L227 HydrophobicContact CE-CD2 3.81Å; M171-L227 VanDerWaalsContact CG-O 3.25Å; M171-L227 WeakPolarHBondContact CG-O 3.32Å; M171-A231 HydrophobicContact CG-CB 3.81Å; M171-A231 HydrophobicContact SD-CB 4.47Å
172	Y	98.3	Very high	96.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-53.9	-54.6	175	171.4	-96.4	0	0	0	111.2	F105 G108 A109 A168 F169 F176 G230 I233 A234	F105-Y172 HydrophobicContact CD2-CE1 4.15Å; F105-Y172 HydrophobicContact CE2-CE1 4.13Å; F105-Y172 PolarHBondContact O-OH 3.31Å; G108-Y172 VanDerWaalsContact CA-OH 3.22Å; G108-Y172 WeakPolarHBondContact CA-OH 3.33Å; A109-Y172 VanDerWaalsContact CA-CE1 3.49Å; A109-Y172 HydrophobicContact CB-CD1 4.1Å; A109-Y172 HydrophobicContact CB-CE1 3.64Å; A109-Y172 VanDerWaalsContact N-CE1 3.28Å; A109-Y172 PolarHBondContact N-OH 3.08Å; A168-Y172 WeakPolarHBondContact O-CB 3.31Å; A168-Y172 PolarHBondContact O-N 3.19Å; F169-Y172 PolarHBondContact O-N 3.35Å; Y172-F176 WeakPolarHBondContact O-CB 3.43Å; Y172-F176 PolarHBondContact O-N 3.02Å; Y172-G230 WeakPolarHBondContact CA-O 3.29Å; Y172-I233 HydrophobicContact CD2-CB 4.15Å; Y172-I233 HydrophobicContact CD2-CG2 3.86Å; Y172-I233 HydrophobicContact CE2-CG2 3.85Å; Y172-A234 HydrophobicContact CD2-CB 3.88Å; Y172-A234 HydrophobicContact CE2-CB 4.25Å
173	C	96.9	Very high	95.6	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-64.5	-48.2	-174.7	-67.3	0	0	0	0	112.3	T64 F105 F169 G170 M171 L177	T64-C173 HydrophobicContact CG2-CB 3.65Å; F105-C173 HydrophobicContact CE2-CB 4.1Å; F105-C173 HydrophobicContact CZ-CB 4.01Å; F105-C173 VanDerWaalsContact CZ-SG 3.53Å; F169-C173 VanDerWaalsContact CE2-SG 3.52Å; F169-C173 VanDerWaalsContact CZ-SG 3.56Å; F169-C173 WeakPolarHBondContact O-CB 3.32Å; F169-C173 PolarHBondContact O-N 2.85Å; F169-C173 PolarHBondContact O-SG 2.98Å; G170-C173 PolarHBondContact O-N 2.96Å; M171-C173 PolarHBondContact O-N 2.92Å; C173-L177 WeakPolarHBondContact O-CG 3.45Å; C173-L177 PolarHBondContact O-N 3.1Å; C173-L177 VanDerWaalsContact O-N 3.09Å
174	M	97.4	Very high	95	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-70.8	-37.8	-176.4	-64.5	-55.9	119	0	0	112.3	T64 G170 L177 S178 L201 F204	T64-M174 HydrophobicContact CG2-CE 4.29Å; T64-M174 WeakPolarHBondContact OG1-CE 3.38Å; G170-M174 WeakPolarHBondContact O-CB 3.38Å; G170-M174 VanDerWaalsContact O-CG 3.28Å; G170-M174 WeakPolarHBondContact O-CG 3.48Å; G170-M174 PolarHBondContact O-N 2.8Å; M174-L177 HydrophobicContact CE-CD1 4.44Å; M174-L177 PolarHBondContact O-N 2.98Å; M174-S178 VanDerWaalsContact O-CB 3.3Å; M174-S178 WeakPolarHBondContact O-CB 3.2Å; M174-S178 PolarHBondContact O-N 2.91Å; M174-L201 HydrophobicContact CB-CB 4.21Å; M174-L201 WeakPolarHBondContact CB-O 3.48Å; M174-L201 VanDerWaalsContact CG-O 3.28Å; M174-L201 WeakPolarHBondContact CG-O 3.18Å; M174-L201 HydrophobicContact SD-CB 4.46Å; M174-L201 HydrophobicContact SD-CD2 3.72Å; M174-F204 HydrophobicContact CE-CD1 4.31Å; M174-F204 HydrophobicContact CE-CE1 4.47Å; M174-F204 HydrophobicContact CG-CD1 4.03Å; M174-F204 HydrophobicContact SD-CD1 3.87Å
175	L	97.9	Very high	94.3	Very high	30 Å²	30	14.9 Å²	14.9	16%	0.157	7%	0.073	C	C	.	.	H	α-helix	trans	-71	-38.7	176.8	-171.4	60.9	0	0	0	111.5	M171 L177 S178 L179 V202 A231 A234 V235	M171-L175 WeakPolarHBondContact O-CB 3.39Å; M171-L175 PolarHBondContact O-N 2.95Å; M171-L175 HydrophobicContact SD-CB 4.18Å; L175-L177 VanDerWaalsContact C-N 3.34Å; L175-L177 PolarHBondContact O-N 3.49Å; L175-S178 WeakPolarHBondContact O-CB 3.42Å; L175-S178 PolarHBondContact O-N 2.94Å; L175-L179 HydrophobicContact CG-CD1 4.3Å; L175-L179 HydrophobicContact CG-CG 4.46Å; L175-L179 VanDerWaalsContact O-CG 3.32Å; L175-L179 WeakPolarHBondContact O-CG 3.5Å; L175-L179 PolarHBondContact O-N 3.01Å; L175-V202 HydrophobicContact CD1-CG2 4.31Å; L175-A231 HydrophobicContact CD2-CB 3.7Å; L175-A234 HydrophobicContact CB-CB 4.01Å; L175-A234 HydrophobicContact CD2-CB 4.11Å; L175-A234 HydrophobicContact CG-CB 4.17Å; L175-V235 HydrophobicContact CD2-CG2 4.26Å
176	F	96.8	Very high	93.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-57.7	-47.5	172.9	-176.6	-78.5	0	0	0	111.1	V101 F105 Y172 S178 L179 Y180 A234 T237 V238 F244	V101-F176 HydrophobicContact CG1-CE1 4.46Å; F105-F176 HydrophobicContact CB-CD1 4.44Å; F105-F176 HydrophobicContact CB-CE1 3.86Å; F105-F176 HydrophobicContact CB-CE2 4.36Å; F105-F176 HydrophobicContact CB-CZ 3.8Å; F105-F176 HydrophobicContact CD2-CB 4.26Å; F105-F176 AromaticContact CD2-CD1 3.49Å; F105-F176 HydrophobicContact CD2-CD1 3.49Å; F105-F176 VanDerWaalsContact CD2-CD1 3.49Å; F105-F176 HydrophobicContact CD2-CD2 4.34Å; F105-F176 AromaticContact CD2-CE1 3.78Å; F105-F176 HydrophobicContact CD2-CE1 3.78Å; F105-F176 AromaticContact CD2-CG 3.78Å; F105-F176 HydrophobicContact CD2-CG 3.78Å; F105-F176 HydrophobicContact CD2-CZ 4.31Å; F105-F176 HydrophobicContact CE2-CB 4.43Å; F105-F176 HydrophobicContact CE2-CD1 4.23Å; F105-F176 HydrophobicContact CE2-CG 4.42Å; F105-F176 HydrophobicContact CG-CD1 4.43Å; F105-F176 HydrophobicContact CG-CE1 4.31Å; Y172-F176 WeakPolarHBondContact O-CB 3.43Å; Y172-F176 PolarHBondContact O-N 3.02Å; F176-S178 VanDerWaalsContact C-N 3.34Å; F176-S178 PolarHBondContact O-N 3.42Å; F176-L179 PolarHBondContact O-N 3.39Å; F176-Y180 WeakPolarHBondContact O-CB 3.49Å; F176-Y180 PolarHBondContact O-N 2.97Å; F176-A234 HydrophobicContact CB-CB 4.47Å; F176-T237 HydrophobicContact CD2-CG2 4.43Å; F176-T237 HydrophobicContact CE2-CG2 3.99Å; F176-V238 HydrophobicContact CD2-CG2 3.59Å; F176-V238 HydrophobicContact CE2-CG2 3.83Å; F176-V238 HydrophobicContact CG-CG2 4.23Å; F176-F244 AromaticContact CE1-CE2 3.71Å; F176-F244 HydrophobicContact CE1-CE2 3.71Å; F176-F244 HydrophobicContact CE1-CZ 4.02Å; F176-F244 HydrophobicContact CE2-CE2 4.14Å; F176-F244 AromaticContact CZ-CE2 3.44Å; F176-F244 HydrophobicContact CZ-CE2 3.44Å; F176-F244 VanDerWaalsContact CZ-CE2 3.44Å; F176-F244 AromaticContact CZ-CZ 3.63Å; F176-F244 HydrophobicContact CZ-CZ 3.63Å
177	L	95.6	Very high	92.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.6	-39.6	176.6	-69.9	174.2	0	0	0	112	C67 I71 C173 M174 L175 L179 Y180 V181 L201	C67-L177 HydrophobicContact CB-CD1 4.21Å; I71-L177 HydrophobicContact CB-CD2 4.49Å; I71-L177 HydrophobicContact CD1-CB 4.24Å; I71-L177 HydrophobicContact CD1-CD1 4.25Å; I71-L177 HydrophobicContact CG2-CD2 4.35Å; C173-L177 WeakPolarHBondContact O-CG 3.45Å; C173-L177 PolarHBondContact O-N 3.1Å; C173-L177 VanDerWaalsContact O-N 3.09Å; M174-L177 HydrophobicContact CE-CD1 4.44Å; M174-L177 PolarHBondContact O-N 2.98Å; L175-L177 VanDerWaalsContact C-N 3.34Å; L175-L177 PolarHBondContact O-N 3.49Å; L177-L179 VanDerWaalsContact C-N 3.35Å; L177-L179 PolarHBondContact O-N 3.28Å; L177-Y180 WeakPolarHBondContact O-CB 3.23Å; L177-Y180 PolarHBondContact O-N 3.18Å; L177-V181 WeakPolarHBondContact O-CB 3.46Å; L177-V181 WeakPolarHBondContact O-CG2 3.38Å; L177-V181 PolarHBondContact O-N 2.82Å; L177-L201 HydrophobicContact CB-CD1 3.96Å; L177-L201 HydrophobicContact CD1-CD2 4.45Å
178	S	96	Very high	91.2	Very high	10 Å²	10	30.6 Å²	30.6	7%	0.07	15%	0.15	C	C	.	.	H	α-helix	trans	-59.7	-43.5	174.8	175	0	0	0	0	112	M174 L175 F176 V181 Q182 Q198	M174-S178 VanDerWaalsContact O-CB 3.3Å; M174-S178 WeakPolarHBondContact O-CB 3.2Å; M174-S178 PolarHBondContact O-N 2.91Å; L175-S178 WeakPolarHBondContact O-CB 3.42Å; L175-S178 PolarHBondContact O-N 2.94Å; F176-S178 VanDerWaalsContact C-N 3.34Å; F176-S178 PolarHBondContact O-N 3.42Å; S178-V181 PolarHBondContact O-N 3.01Å; S178-Q182 PolarHBondContact O-N 2.95Å; S178-Q198 PolarHBondContact O-NE2 3.49Å; S178-Q198 VanDerWaalsContact OG-CB 3.3Å; S178-Q198 WeakPolarHBondContact OG-CB 3.48Å; S178-Q198 VanDerWaalsContact OG-CG 3.23Å; S178-Q198 WeakPolarHBondContact OG-CG 3.39Å
179	L	94.6	Very high	90.2	Very high	37 Å²	37	42.6 Å²	42.6	19%	0.194	20%	0.195	C	C	.	.	H	α-helix	trans	-71.3	-33.4	175.3	-67.1	173.3	0	0	0	112.5	L175 F176 L177 Q182 A183 V235 V238	L175-L179 HydrophobicContact CG-CD1 4.3Å; L175-L179 HydrophobicContact CG-CG 4.46Å; L175-L179 VanDerWaalsContact O-CG 3.32Å; L175-L179 WeakPolarHBondContact O-CG 3.5Å; L175-L179 PolarHBondContact O-N 3.01Å; F176-L179 PolarHBondContact O-N 3.39Å; L177-L179 VanDerWaalsContact C-N 3.35Å; L177-L179 PolarHBondContact O-N 3.28Å; L179-Q182 VanDerWaalsContact O-CB 3.25Å; L179-Q182 WeakPolarHBondContact O-CB 3.33Å; L179-Q182 PolarHBondContact O-N 3.04Å; L179-A183 PolarHBondContact O-N 3.31Å; L179-V235 HydrophobicContact CD1-CG2 4.37Å; L179-V238 HydrophobicContact CB-CG1 4.12Å; L179-V238 HydrophobicContact CB-CG2 4.12Å; L179-V238 HydrophobicContact CD1-CB 4.02Å; L179-V238 HydrophobicContact CD1-CG1 4.31Å; L179-V238 HydrophobicContact CD1-CG2 3.93Å
180	Y	92	Very high	89.4	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-47	171.6	174.7	-91.7	0	0	0	111.1	I71 I72 E76 V101 F176 L177 Q182 A183 R184 F244	I71-Y180 HydrophobicContact CG2-CD1 3.7Å; I71-Y180 HydrophobicContact CG2-CE1 3.97Å; I72-Y180 HydrophobicContact CG1-CE1 4.31Å; E76-Y180 WeakPolarHBondContact CG-OH 3.11Å; E76-Y180 PolarHBondContact OE1-OH 2.91Å; V101-Y180 HydrophobicContact CG1-CD2 4.1Å; V101-Y180 HydrophobicContact CG1-CE2 3.97Å; V101-Y180 HydrophobicContact CG2-CD2 4.36Å; V101-Y180 HydrophobicContact CG2-CE2 3.74Å; F176-Y180 WeakPolarHBondContact O-CB 3.49Å; F176-Y180 PolarHBondContact O-N 2.97Å; L177-Y180 WeakPolarHBondContact O-CB 3.23Å; L177-Y180 PolarHBondContact O-N 3.18Å; Y180-Q182 PolarHBondContact O-N 3.09Å; Y180-A183 PolarHBondContact O-N 3.28Å; Y180-A183 VanDerWaalsContact O-N 3.07Å; Y180-R184 HydrophobicContact CD1-CG 4.31Å; Y180-R184 HydrophobicContact CD2-CG 4.23Å; Y180-R184 HydrophobicContact CE1-CG 3.87Å; Y180-R184 HydrophobicContact CE2-CG 3.78Å; Y180-R184 HydrophobicContact CG-CG 4.47Å; Y180-R184 WeakPolarHBondContact O-CG 3.48Å; Y180-R184 PolarHBondContact O-N 3.5Å; Y180-F244 HydrophobicContact CD2-CD2 4.12Å; Y180-F244 HydrophobicContact CD2-CE1 4.35Å; Y180-F244 AromaticContact CD2-CE2 3.82Å; Y180-F244 HydrophobicContact CD2-CE2 3.82Å; Y180-F244 AromaticContact CD2-CZ 3.96Å; Y180-F244 HydrophobicContact CD2-CZ 3.96Å
181	V	91.7	Very high	88.7	Confident	6 Å²	6	51.9 Å²	51.9	4%	0.036	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-40.7	172.9	166.6	0	0	0	0	110.5	I71 L177 S178 A183 R184 M185 R194 I197 Q198	I71-V181 HydrophobicContact CG2-CG2 3.63Å; L177-V181 WeakPolarHBondContact O-CB 3.46Å; L177-V181 WeakPolarHBondContact O-CG2 3.38Å; L177-V181 PolarHBondContact O-N 2.82Å; S178-V181 PolarHBondContact O-N 3.01Å; V181-A183 PolarHBondContact O-N 3.49Å; V181-R184 PolarHBondContact O-N 2.91Å; V181-M185 HydrophobicContact CG1-CG 4.33Å; V181-M185 HydrophobicContact CG1-SD 3.73Å; V181-M185 WeakPolarHBondContact O-CB 3.24Å; V181-M185 PolarHBondContact O-N 2.97Å; V181-R194 HydrophobicContact CG1-CG 4.09Å; V181-I197 HydrophobicContact CG1-CG2 4.35Å; V181-I197 HydrophobicContact CG2-CG2 4.14Å; V181-Q198 HydrophobicContact CG1-CG 4.22Å
182	Q	91.3	Very high	88.3	Confident	60 Å²	60	57.4 Å²	57.4	28%	0.28	26%	0.26	S	S	.	.	H	α-helix	trans	-55	-53.9	172.3	-170.7	72.4	-0.4	0	0	110.1	S178 L179 Y180 R184 R194 F245	S178-Q182 PolarHBondContact O-N 2.95Å; L179-Q182 VanDerWaalsContact O-CB 3.25Å; L179-Q182 WeakPolarHBondContact O-CB 3.33Å; L179-Q182 PolarHBondContact O-N 3.04Å; Y180-Q182 PolarHBondContact O-N 3.09Å; Q182-R184 PolarHBondContact O-N 3.29Å; Q182-R194 PolarHBondContact O-NE 3.02Å; Q182-R194 PolarHBondContact O-NH2 3.38Å; Q182-F245 HydrophobicContact CB-CE1 4.48Å; Q182-F245 HydrophobicContact CB-CZ 4.17Å; Q182-F245 HydrophobicContact CG-CE1 4.06Å; Q182-F245 HydrophobicContact CG-CZ 4.03Å
183	A	85.9	Confident	87.9	Confident	8 Å²	8	60.8 Å²	60.8	7%	0.066	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-36.7	-175.9	0	0	0	0	0	113.7	L179 Y180 V181 F244 F245	L179-A183 PolarHBondContact O-N 3.31Å; Y180-A183 PolarHBondContact O-N 3.28Å; Y180-A183 VanDerWaalsContact O-N 3.07Å; V181-A183 PolarHBondContact O-N 3.49Å; A183-F244 HydrophobicContact CB-CB 3.81Å; A183-F245 HydrophobicContact CB-CD1 4.16Å; A183-F245 HydrophobicContact CB-CE1 3.88Å; A183-F245 HydrophobicContact CB-CZ 4.08Å
184	R	83.4	Confident	87.6	Confident	32 Å²	32	63.7 Å²	63.7	12%	0.121	29%	0.292	C	S	.	.	H	α-helix	trans	-92.4	-35.6	-171.2	-57.6	-40.8	-166.1	155.1	3	115.1	E76 L79 Y180 V181 Q182 Q186	E76-R184 IonicContact OE1-CZ 3.16Å; E76-R184 IonicContact OE1-NE 3.6Å; E76-R184 IonicContact OE1-NH2 3.65Å; E76-R184 PolarHBondContact OE1-NH2 2.91Å; L79-R184 HydrophobicContact CD1-CB 4.4Å; L79-R184 HydrophobicContact CD1-CG 4.21Å; Y180-R184 HydrophobicContact CD1-CG 4.31Å; Y180-R184 HydrophobicContact CD2-CG 4.23Å; Y180-R184 HydrophobicContact CE1-CG 3.87Å; Y180-R184 HydrophobicContact CE2-CG 3.78Å; Y180-R184 HydrophobicContact CG-CG 4.47Å; Y180-R184 WeakPolarHBondContact O-CG 3.48Å; Y180-R184 PolarHBondContact O-N 3.5Å; V181-R184 PolarHBondContact O-N 2.91Å; Q182-R184 PolarHBondContact O-N 3.29Å; R184-Q186 PolarHBondContact O-N 2.96Å; R184-Q186 VanDerWaalsContact O-N 3.17Å
185	M	82.9	Confident	87.4	Confident	45 Å²	45	66.3 Å²	66.3	22%	0.222	31%	0.309	C	S	.	.			trans	-89.7	77.9	-176.2	-64.1	-175.5	69.8	0	0	111.7	V181 T190 V193 R194 I197	V181-M185 HydrophobicContact CG1-CG 4.33Å; V181-M185 HydrophobicContact CG1-SD 3.73Å; V181-M185 WeakPolarHBondContact O-CB 3.24Å; V181-M185 PolarHBondContact O-N 2.97Å; M185-T190 HydrophobicContact CE-CG2 3.58Å; M185-V193 HydrophobicContact CE-CG1 3.95Å; M185-R194 HydrophobicContact CB-CG 4.41Å; M185-R194 WeakPolarHBondContact O-CD 3.41Å; M185-R194 PolarHBondContact O-NE 3.45Å; M185-I197 HydrophobicContact CE-CD1 4.3Å; M185-I197 HydrophobicContact SD-CD1 4.06Å
186	Q	77.1	Confident	87.2	Confident	116 Å²	116	67.7 Å²	67.7	54%	0.542	32%	0.319	S	S	.	.			trans	-99.2	13.6	179.6	-64.2	-172.5	-26.3	0	0	114.4	R184	R184-Q186 PolarHBondContact O-N 2.96Å; R184-Q186 VanDerWaalsContact O-N 3.17Å
187	G	74.1	Confident	87.1	Confident	25 Å²	25	70.4 Å²	70.4	26%	0.258	33%	0.333	S	S	.	.			trans	-72.4	146.2	-178.3	0	0	0	0	0	112.9	W189 T190	G187-W189 VanDerWaalsContact C-N 3.26Å; G187-W189 PolarHBondContact O-N 3.42Å; G187-T190 PolarHBondContact N-OG1 2.92Å; G187-T190 PolarHBondContact O-N 3.48Å; G187-T190 VanDerWaalsContact O-N 3.13Å; G187-T190 PolarHBondContact O-OG1 2.86Å
188	K	72	Confident	87.2	Confident	203 Å²	203	71.9 Å²	71.9	88%	0.883	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-61.5	-34.9	174.8	-66.3	-176.5	-179.7	179.1	0	112.3	T190	K188-T190 VanDerWaalsContact C-N 3.26Å; K188-T190 PolarHBondContact O-N 3Å
189	W	77.6	Confident	87.2	Confident	252 Å²	252	77.7 Å²	77.7	96%	0.955	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-68.9	-19.3	176.3	-65.5	100.1	0	0	0	114	G187 R191	G187-W189 VanDerWaalsContact C-N 3.26Å; G187-W189 PolarHBondContact O-N 3.42Å; W189-R191 VanDerWaalsContact C-N 3.27Å; W189-R191 PolarHBondContact O-N 3.28Å
190	T	80	Confident	87.3	Confident	24 Å²	24	82.2 Å²	82.2	15%	0.147	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-89.9	16	-177.2	55.5	0	0	0	0	113.5	M185 G187 K188 L192 V193 R194	M185-T190 HydrophobicContact CE-CG2 3.58Å; G187-T190 PolarHBondContact N-OG1 2.92Å; G187-T190 PolarHBondContact O-N 3.48Å; G187-T190 VanDerWaalsContact O-N 3.13Å; G187-T190 PolarHBondContact O-OG1 2.86Å; K188-T190 VanDerWaalsContact C-N 3.26Å; K188-T190 PolarHBondContact O-N 3Å; T190-L192 VanDerWaalsContact C-N 3.26Å; T190-L192 PolarHBondContact O-N 3.31Å; T190-V193 PolarHBondContact O-N 3.19Å; T190-R194 WeakPolarHBondContact O-CB 3.13Å; T190-R194 PolarHBondContact O-N 3.44Å; T190-R194 VanDerWaalsContact O-N 3.14Å
191	R	83.1	Confident	87.6	Confident	223 Å²	223	82.7 Å²	82.7	84%	0.842	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-43.8	-176.5	-177.7	179	175.4	-176.3	-1.1	112.9	W189 P195	W189-R191 VanDerWaalsContact C-N 3.27Å; W189-R191 PolarHBondContact O-N 3.28Å; R191-P195 VanDerWaalsContact O-CD 3.31Å; R191-P195 WeakPolarHBondContact O-CD 3.15Å; R191-P195 WeakPolarHBondContact O-CG 3.07Å
192	L	90.4	Very high	87.9	Confident	130 Å²	130	84.3 Å²	84.3	68%	0.681	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-33.2	179.4	-159.7	65.4	0	0	0	112.9	T190 R194 P195 T196	T190-L192 VanDerWaalsContact C-N 3.26Å; T190-L192 PolarHBondContact O-N 3.31Å; L192-R194 VanDerWaalsContact C-N 3.31Å; L192-R194 PolarHBondContact O-N 3.44Å; L192-P195 WeakPolarHBondContact O-CD 3.3Å; L192-P195 VanDerWaalsContact O-CG 3.29Å; L192-P195 WeakPolarHBondContact O-CG 3.36Å; L192-T196 WeakPolarHBondContact O-CB 3.44Å; L192-T196 PolarHBondContact O-N 2.92Å; L192-T196 VanDerWaalsContact O-N 3.09Å; L192-T196 PolarHBondContact O-OG1 3.03Å
193	V	88.9	Confident	88.2	Confident	72 Å²	72	83 Å²	83	44%	0.436	40%	0.395	S	S	.	.	H	α-helix	trans	-56.5	-44.7	-179.7	-176.1	0	0	0	0	111.9	M185 T190 T196 I197	M185-V193 HydrophobicContact CE-CG1 3.95Å; T190-V193 PolarHBondContact O-N 3.19Å; V193-T196 PolarHBondContact O-N 2.89Å; V193-I197 HydrophobicContact CG1-CD1 3.89Å; V193-I197 HydrophobicContact CG1-CG1 4.5Å; V193-I197 WeakPolarHBondContact O-CG1 3.28Å; V193-I197 PolarHBondContact O-N 3.16Å
194	R	90.2	Very high	88.7	Confident	61 Å²	61	85 Å²	85	23%	0.23	40%	0.402	C	S	.	.	H	α-helix	trans	-61.1	-58.2	-178	-179.6	-166.5	-166.3	-152.4	9.4	112.5	V181 Q182 M185 T190 L192 T196 I197 Q198	V181-R194 HydrophobicContact CG1-CG 4.09Å; Q182-R194 PolarHBondContact O-NE 3.02Å; Q182-R194 PolarHBondContact O-NH2 3.38Å; M185-R194 HydrophobicContact CB-CG 4.41Å; M185-R194 WeakPolarHBondContact O-CD 3.41Å; M185-R194 PolarHBondContact O-NE 3.45Å; T190-R194 WeakPolarHBondContact O-CB 3.13Å; T190-R194 PolarHBondContact O-N 3.44Å; T190-R194 VanDerWaalsContact O-N 3.14Å; L192-R194 VanDerWaalsContact C-N 3.31Å; L192-R194 PolarHBondContact O-N 3.44Å; R194-T196 PolarHBondContact O-N 3.43Å; R194-I197 PolarHBondContact O-N 2.85Å; R194-Q198 VanDerWaalsContact O-CG 3.25Å; R194-Q198 WeakPolarHBondContact O-CG 3.42Å; R194-Q198 PolarHBondContact O-N 2.94Å; R194-Q198 VanDerWaalsContact O-N 3.11Å
195	P	93.6	Very high	89.4	Confident	56 Å²	56	83.5 Å²	83.5	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-63.5	-28.8	177.5	24.2	-33.7	0	0	0	113.1	R191 L192 Q198 F199	R191-P195 VanDerWaalsContact O-CD 3.31Å; R191-P195 WeakPolarHBondContact O-CD 3.15Å; R191-P195 WeakPolarHBondContact O-CG 3.07Å; L192-P195 WeakPolarHBondContact O-CD 3.3Å; L192-P195 VanDerWaalsContact O-CG 3.29Å; L192-P195 WeakPolarHBondContact O-CG 3.36Å; P195-Q198 PolarHBondContact O-N 3.13Å; P195-F199 VanDerWaalsContact O-CB 3.28Å; P195-F199 WeakPolarHBondContact O-CB 3.31Å; P195-F199 PolarHBondContact O-N 2.98Å
196	T	94.9	Very high	90.1	Very high	59 Å²	59	84 Å²	84	36%	0.362	40%	0.4	S	S	.	.	H	α-helix	trans	-64.8	-47.3	174.4	-60.1	0	0	0	0	112.2	L192 V193 R194 Q198 F199 F200	L192-T196 WeakPolarHBondContact O-CB 3.44Å; L192-T196 PolarHBondContact O-N 2.92Å; L192-T196 VanDerWaalsContact O-N 3.09Å; L192-T196 PolarHBondContact O-OG1 3.03Å; V193-T196 PolarHBondContact O-N 2.89Å; R194-T196 PolarHBondContact O-N 3.43Å; T196-Q198 VanDerWaalsContact C-N 3.31Å; T196-Q198 PolarHBondContact O-N 2.99Å; T196-F199 PolarHBondContact O-N 3.42Å; T196-F200 HydrophobicContact CG2-CD2 3.87Å; T196-F200 HydrophobicContact CG2-CE2 3.62Å; T196-F200 WeakPolarHBondContact O-CD2 3.45Å; T196-F200 PolarHBondContact O-N 2.89Å; T196-F200 VanDerWaalsContact O-N 3.12Å
197	I	94.3	Very high	91.1	Very high	58 Å²	58	84 Å²	84	30%	0.297	40%	0.395	S	S	.	.	H	α-helix	trans	-59.7	-45.8	175.6	-67.5	167.3	0	0	0	110.2	V181 M185 V193 R194 F199 F200 L201	V181-I197 HydrophobicContact CG1-CG2 4.35Å; V181-I197 HydrophobicContact CG2-CG2 4.14Å; M185-I197 HydrophobicContact CE-CD1 4.3Å; M185-I197 HydrophobicContact SD-CD1 4.06Å; V193-I197 HydrophobicContact CG1-CD1 3.89Å; V193-I197 HydrophobicContact CG1-CG1 4.5Å; V193-I197 WeakPolarHBondContact O-CG1 3.28Å; V193-I197 PolarHBondContact O-N 3.16Å; R194-I197 PolarHBondContact O-N 2.85Å; I197-F199 VanDerWaalsContact C-N 3.34Å; I197-F199 PolarHBondContact O-N 3.49Å; I197-F200 PolarHBondContact O-N 3.18Å; I197-L201 HydrophobicContact CG2-CD1 3.92Å; I197-L201 HydrophobicContact CG2-CG 4.37Å; I197-L201 VanDerWaalsContact O-CG 3.32Å; I197-L201 WeakPolarHBondContact O-CG 3.39Å; I197-L201 PolarHBondContact O-N 3.04Å
198	Q	96.3	Very high	92.2	Very high	30 Å²	30	82.9 Å²	82.9	14%	0.14	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-42.4	179.5	-67.4	173.6	-37.9	0	0	112.3	S178 V181 R194 P195 T196 L201 V202	S178-Q198 PolarHBondContact O-NE2 3.49Å; S178-Q198 VanDerWaalsContact OG-CB 3.3Å; S178-Q198 WeakPolarHBondContact OG-CB 3.48Å; S178-Q198 VanDerWaalsContact OG-CG 3.23Å; S178-Q198 WeakPolarHBondContact OG-CG 3.39Å; V181-Q198 HydrophobicContact CG1-CG 4.22Å; R194-Q198 VanDerWaalsContact O-CG 3.25Å; R194-Q198 WeakPolarHBondContact O-CG 3.42Å; R194-Q198 PolarHBondContact O-N 2.94Å; R194-Q198 VanDerWaalsContact O-N 3.11Å; P195-Q198 PolarHBondContact O-N 3.13Å; T196-Q198 VanDerWaalsContact C-N 3.31Å; T196-Q198 PolarHBondContact O-N 2.99Å; Q198-L201 PolarHBondContact O-N 3.07Å; Q198-V202 WeakPolarHBondContact O-CG2 3.34Å; Q198-V202 PolarHBondContact O-N 3.16Å
199	F	97	Very high	93.4	Very high	133 Å²	133	73.2 Å²	73.2	58%	0.583	34%	0.341	S	S	*	.	H	α-helix	trans	-57.7	-51	175.5	171.2	-97.7	0	0	0	111.1	P195 T196 I197 L201 V202 A203	P195-F199 VanDerWaalsContact O-CB 3.28Å; P195-F199 WeakPolarHBondContact O-CB 3.31Å; P195-F199 PolarHBondContact O-N 2.98Å; T196-F199 PolarHBondContact O-N 3.42Å; I197-F199 VanDerWaalsContact C-N 3.34Å; I197-F199 PolarHBondContact O-N 3.49Å; F199-L201 PolarHBondContact O-N 3.31Å; F199-V202 PolarHBondContact O-N 3.27Å; F199-A203 HydrophobicContact CE1-CB 4.46Å; F199-A203 HydrophobicContact CZ-CB 4.49Å; F199-A203 WeakPolarHBondContact O-CB 3.29Å; F199-A203 PolarHBondContact O-N 3.42Å
200	F	97.3	Very high	94.4	Very high	131 Å²	131	68.3 Å²	68.3	58%	0.575	32%	0.324	S	S	*	.	H	α-helix	trans	-66.5	-36.1	-178.6	-76.6	-66.3	0	0	0	113.2	T196 I197 F204	T196-F200 HydrophobicContact CG2-CD2 3.87Å; T196-F200 HydrophobicContact CG2-CE2 3.62Å; T196-F200 WeakPolarHBondContact O-CD2 3.45Å; T196-F200 PolarHBondContact O-N 2.89Å; T196-F200 VanDerWaalsContact O-N 3.12Å; I197-F200 PolarHBondContact O-N 3.18Å; F200-F204 WeakPolarHBondContact O-CB 3.38Å; F200-F204 PolarHBondContact O-N 3.4Å
201	L	97.2	Very high	95.3	Very high	13 Å²	13	67.4 Å²	67.4	7%	0.068	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-52.3	173.7	-71	170.8	0	0	0	110.9	I71 M174 L177 I197 Q198 F199 F204 S205	I71-L201 HydrophobicContact CD1-CD1 3.91Å; I71-L201 HydrophobicContact CD1-CD2 3.94Å; I71-L201 HydrophobicContact CD1-CG 4.47Å; M174-L201 HydrophobicContact CB-CB 4.21Å; M174-L201 WeakPolarHBondContact CB-O 3.48Å; M174-L201 VanDerWaalsContact CG-O 3.28Å; M174-L201 WeakPolarHBondContact CG-O 3.18Å; M174-L201 HydrophobicContact SD-CB 4.46Å; M174-L201 HydrophobicContact SD-CD2 3.72Å; L177-L201 HydrophobicContact CB-CD1 3.96Å; L177-L201 HydrophobicContact CD1-CD2 4.45Å; I197-L201 HydrophobicContact CG2-CD1 3.92Å; I197-L201 HydrophobicContact CG2-CG 4.37Å; I197-L201 VanDerWaalsContact O-CG 3.32Å; I197-L201 WeakPolarHBondContact O-CG 3.39Å; I197-L201 PolarHBondContact O-N 3.04Å; Q198-L201 PolarHBondContact O-N 3.07Å; F199-L201 PolarHBondContact O-N 3.31Å; L201-F204 PolarHBondContact O-N 3.37Å; L201-S205 PolarHBondContact O-N 2.85Å
202	V	97.4	Very high	96	Very high	40 Å²	40	56.8 Å²	56.8	24%	0.242	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-40.7	-179.9	176	0	0	0	0	111	M171 L175 Q198 F199 F204 S205 L206	M171-V202 HydrophobicContact CE-CG1 4.34Å; L175-V202 HydrophobicContact CD1-CG2 4.31Å; Q198-V202 WeakPolarHBondContact O-CG2 3.34Å; Q198-V202 PolarHBondContact O-N 3.16Å; F199-V202 PolarHBondContact O-N 3.27Å; V202-F204 VanDerWaalsContact C-N 3.3Å; V202-F204 PolarHBondContact O-N 3.43Å; V202-S205 WeakPolarHBondContact O-CB 3.47Å; V202-S205 PolarHBondContact O-N 3.05Å; V202-S205 VanDerWaalsContact O-N 3.1Å; V202-L206 HydrophobicContact CG1-CD1 4.37Å; V202-L206 HydrophobicContact CG1-CG 4.48Å; V202-L206 WeakPolarHBondContact O-CG 3.25Å; V202-L206 PolarHBondContact O-N 2.85Å
203	A	98	Very high	96.3	Very high	33 Å²	33	53.4 Å²	53.4	27%	0.273	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-39.4	176.4	0	0	0	0	0	111.9	F199 S205 L206 Y207	F199-A203 HydrophobicContact CE1-CB 4.46Å; F199-A203 HydrophobicContact CZ-CB 4.49Å; F199-A203 WeakPolarHBondContact O-CB 3.29Å; F199-A203 PolarHBondContact O-N 3.42Å; A203-S205 PolarHBondContact O-N 3.39Å; A203-L206 PolarHBondContact O-N 2.99Å; A203-Y207 WeakPolarHBondContact O-CB 3.47Å; A203-Y207 PolarHBondContact O-N 3.05Å
204	F	97	Very high	96.7	Very high	50 Å²	50	52.8 Å²	52.8	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-43.2	173.6	177.8	-105.9	0	0	0	111.8	V63 M174 F200 L201 V202 L206 Y207 V208	V63-F204 HydrophobicContact CB-CE1 4.3Å; V63-F204 HydrophobicContact CB-CZ 3.99Å; V63-F204 HydrophobicContact CG1-CD1 4.35Å; V63-F204 HydrophobicContact CG1-CE1 3.65Å; V63-F204 HydrophobicContact CG1-CE2 4.17Å; V63-F204 HydrophobicContact CG1-CZ 3.55Å; V63-F204 HydrophobicContact CG2-CZ 4.26Å; M174-F204 HydrophobicContact CE-CD1 4.31Å; M174-F204 HydrophobicContact CE-CE1 4.47Å; M174-F204 HydrophobicContact CG-CD1 4.03Å; M174-F204 HydrophobicContact SD-CD1 3.87Å; F200-F204 WeakPolarHBondContact O-CB 3.38Å; F200-F204 PolarHBondContact O-N 3.4Å; L201-F204 PolarHBondContact O-N 3.37Å; V202-F204 VanDerWaalsContact C-N 3.3Å; V202-F204 PolarHBondContact O-N 3.43Å; F204-L206 VanDerWaalsContact C-N 3.34Å; F204-L206 PolarHBondContact O-N 3.32Å; F204-Y207 WeakPolarHBondContact O-CB 3.18Å; F204-Y207 PolarHBondContact O-N 3.46Å; F204-V208 HydrophobicContact CD1-CG2 4.47Å; F204-V208 HydrophobicContact CE1-CG2 4.02Å; F204-V208 HydrophobicContact CE2-CG2 4.3Å; F204-V208 HydrophobicContact CZ-CG2 3.93Å; F204-V208 WeakPolarHBondContact O-CG2 3.29Å; F204-V208 PolarHBondContact O-N 3.13Å
205	S	97.4	Very high	97	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.8	-39.7	174.7	178	0	0	0	0	112.8	G170 M171 L201 V202 A203 V208 G209	G170-S205 VanDerWaalsContact C-OG 3.23Å; M171-S205 WeakPolarHBondContact CA-OG 3.31Å; M171-S205 WeakPolarHBondContact CB-OG 3.37Å; M171-S205 PolarHBondContact N-OG 3.23Å; L201-S205 PolarHBondContact O-N 2.85Å; V202-S205 WeakPolarHBondContact O-CB 3.47Å; V202-S205 PolarHBondContact O-N 3.05Å; V202-S205 VanDerWaalsContact O-N 3.1Å; A203-S205 PolarHBondContact O-N 3.39Å; S205-V208 PolarHBondContact O-N 2.7Å; S205-G209 PolarHBondContact O-N 2.68Å; S205-G209 VanDerWaalsContact O-N 3.08Å
206	L	98.2	Very high	97.1	Very high	56 Å²	56	48.3 Å²	48.3	29%	0.293	24%	0.239	S	C	.	.	H	α-helix	trans	-65	-43.1	176.5	-68.3	175.9	0	0	0	110.7	M171 V202 A203 F204 V208 G209 Y210 L227	M171-L206 HydrophobicContact CE-CD2 4.08Å; V202-L206 HydrophobicContact CG1-CD1 4.37Å; V202-L206 HydrophobicContact CG1-CG 4.48Å; V202-L206 WeakPolarHBondContact O-CG 3.25Å; V202-L206 PolarHBondContact O-N 2.85Å; A203-L206 PolarHBondContact O-N 2.99Å; F204-L206 VanDerWaalsContact C-N 3.34Å; F204-L206 PolarHBondContact O-N 3.32Å; L206-V208 PolarHBondContact O-N 3.07Å; L206-G209 CarbonylContact O-C 3.54Å; L206-G209 WeakPolarHBondContact O-CA 3.23Å; L206-G209 PolarHBondContact O-N 3.5Å; L206-Y210 HydrophobicContact CB-CE2 4.19Å; L206-Y210 WeakPolarHBondContact O-CD2 3.31Å; L206-Y210 VanDerWaalsContact O-CG 3.29Å; L206-Y210 PolarHBondContact O-N 2.83Å; L206-L227 HydrophobicContact CD2-CD1 3.92Å
207	Y	98.1	Very high	97.2	Very high	116 Å²	116	45.8 Å²	45.8	46%	0.455	22%	0.223	S	C	.	.	H	α-helix	trans	-56.7	-47.9	174.4	174.8	-109.9	0	0	0	111.7	I55 A203 F204 G209 Y210 T211	I55-Y207 HydrophobicContact CD1-CE1 4.19Å; I55-Y207 HydrophobicContact CG1-CE1 4.33Å; A203-Y207 WeakPolarHBondContact O-CB 3.47Å; A203-Y207 PolarHBondContact O-N 3.05Å; F204-Y207 WeakPolarHBondContact O-CB 3.18Å; F204-Y207 PolarHBondContact O-N 3.46Å; Y207-G209 VanDerWaalsContact C-N 3.27Å; Y207-G209 PolarHBondContact O-N 3.13Å; Y207-Y210 PolarHBondContact O-N 3.2Å; Y207-Y210 VanDerWaalsContact O-N 3.11Å; Y207-T211 HydrophobicContact CD1-CG2 4.47Å; Y207-T211 HydrophobicContact CD2-CG2 4.41Å; Y207-T211 HydrophobicContact CE1-CG2 4.08Å; Y207-T211 HydrophobicContact CE2-CG2 4Å; Y207-T211 WeakPolarHBondContact O-CG2 3.44Å; Y207-T211 PolarHBondContact O-N 3Å
208	V	97.7	Very high	97.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55	-45.4	173.4	172.9	0	0	0	0	110.7	I55 M60 H166 F204 S205 L206 Y210 T211 R212	I55-V208 HydrophobicContact CG1-CG2 4.48Å; I55-V208 HydrophobicContact CG2-CG2 4.37Å; M60-V208 HydrophobicContact CE-CG1 4.39Å; M60-V208 HydrophobicContact SD-CG1 4.44Å; H166-V208 HydrophobicContact CB-CG1 3.94Å; F204-V208 HydrophobicContact CD1-CG2 4.47Å; F204-V208 HydrophobicContact CE1-CG2 4.02Å; F204-V208 HydrophobicContact CE2-CG2 4.3Å; F204-V208 HydrophobicContact CZ-CG2 3.93Å; F204-V208 WeakPolarHBondContact O-CG2 3.29Å; F204-V208 PolarHBondContact O-N 3.13Å; S205-V208 PolarHBondContact O-N 2.7Å; L206-V208 PolarHBondContact O-N 3.07Å; V208-Y210 PolarHBondContact O-N 3.33Å; V208-T211 PolarHBondContact O-N 2.76Å; V208-T211 PolarHBondContact O-OG1 2.76Å; V208-R212 PolarHBondContact O-N 3.31Å
209	G	97.7	Very high	97.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.1	-46.7	174.6	0	0	0	0	0	113.5	S205 L206 Y207 T211 R212	S205-G209 PolarHBondContact O-N 2.68Å; S205-G209 VanDerWaalsContact O-N 3.08Å; L206-G209 CarbonylContact O-C 3.54Å; L206-G209 WeakPolarHBondContact O-CA 3.23Å; L206-G209 PolarHBondContact O-N 3.5Å; Y207-G209 VanDerWaalsContact C-N 3.27Å; Y207-G209 PolarHBondContact O-N 3.13Å; G209-T211 VanDerWaalsContact C-N 3.33Å; G209-T211 PolarHBondContact O-N 3.42Å; G209-R212 WeakPolarHBondContact O-CB 3.33Å; G209-R212 PolarHBondContact O-N 2.99Å; G209-R212 VanDerWaalsContact O-N 3.13Å
210	Y	98.3	Very high	97.4	Very high	150 Å²	150	45.1 Å²	45.1	59%	0.588	21%	0.213	S	C	*	.	H	α-helix	trans	-61	-41.3	177.7	-60.1	-28.8	0	0	0	112.1	L206 Y207 V208 R212 V213 S214	L206-Y210 HydrophobicContact CB-CE2 4.19Å; L206-Y210 WeakPolarHBondContact O-CD2 3.31Å; L206-Y210 VanDerWaalsContact O-CG 3.29Å; L206-Y210 PolarHBondContact O-N 2.83Å; Y207-Y210 PolarHBondContact O-N 3.2Å; Y207-Y210 VanDerWaalsContact O-N 3.11Å; V208-Y210 PolarHBondContact O-N 3.33Å; Y210-R212 PolarHBondContact O-N 3.16Å; Y210-V213 PolarHBondContact O-N 3.47Å; Y210-S214 PolarHBondContact O-N 3.42Å; Y210-S214 PolarHBondContact O-OG 3.46Å
211	T	97.8	Very high	97.5	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.025	20%	0.196	C	C	.	.	H	α-helix	trans	-59.9	-33.5	176.8	67.9	0	0	0	0	112.3	T54 I55 Y207 V208 G209 V213 S214 D215	T54-T211 HydrophobicContact CG2-CG2 3.85Å; I55-T211 HydrophobicContact CG1-CG2 4.25Å; Y207-T211 HydrophobicContact CD1-CG2 4.47Å; Y207-T211 HydrophobicContact CD2-CG2 4.41Å; Y207-T211 HydrophobicContact CE1-CG2 4.08Å; Y207-T211 HydrophobicContact CE2-CG2 4Å; Y207-T211 WeakPolarHBondContact O-CG2 3.44Å; Y207-T211 PolarHBondContact O-N 3Å; V208-T211 PolarHBondContact O-N 2.76Å; V208-T211 PolarHBondContact O-OG1 2.76Å; G209-T211 VanDerWaalsContact C-N 3.33Å; G209-T211 PolarHBondContact O-N 3.42Å; T211-V213 VanDerWaalsContact C-N 3.28Å; T211-V213 PolarHBondContact O-N 3.25Å; T211-S214 WeakPolarHBondContact CA-OG 3.33Å; T211-S214 PolarHBondContact O-N 3.48Å; T211-S214 PolarHBondContact O-OG 2.95Å; T211-D215 WeakPolarHBondContact O-CB 3.34Å; T211-D215 PolarHBondContact O-N 3.38Å; T211-D215 VanDerWaalsContact O-OD2 3.12Å
212	R	97.5	Very high	97.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-30.9	177.2	-63.3	-56.6	83.9	147.9	-6.6	113.5	D53 I55 H166 V208 G209 Y210 D215 K217 H218 V223	D53-R212 IonicContact OD1-CZ 3.65Å; D53-R212 IonicContact OD1-NH1 2.76Å; D53-R212 IonicContact OD1-NH2 3.87Å; I55-R212 VanDerWaalsContact O-CZ 3.25Å; I55-R212 PolarHBondContact O-NH1 2.93Å; I55-R212 PolarHBondContact O-NH2 2.75Å; H166-R212 HydrophobicContact CB-CG 3.99Å; H166-R212 PolarHBondContact CD2-NH1 2.92Å; H166-R212 PolarHBondContact CE1-NH1 3.21Å; H166-R212 PolarHBondContact ND1-NH1 3.24Å; H166-R212 PolarHBondContact NE2-NH1 3.19Å; V208-R212 PolarHBondContact O-N 3.31Å; G209-R212 WeakPolarHBondContact O-CB 3.33Å; G209-R212 PolarHBondContact O-N 2.99Å; G209-R212 VanDerWaalsContact O-N 3.13Å; Y210-R212 PolarHBondContact O-N 3.16Å; R212-D215 IonicContact CZ-OD2 3.53Å; R212-D215 IonicContact NH2-OD2 2.8Å; R212-D215 PolarHBondContact NH2-OD2 3.35Å; R212-K217 PolarHBondContact O-N 3.28Å; R212-H218 HydrophobicContact CB-CB 4.24Å; R212-H218 PolarHBondContact O-N 3.09Å; R212-H218 VanDerWaalsContact O-N 3.13Å; R212-V223 HydrophobicContact CB-CG2 3.85Å
213	V	97.7	Very high	97.6	Very high	59 Å²	59	38.2 Å²	38.2	36%	0.358	18%	0.183	S	C	.	.	H	α-helix	trans	-76.6	-49.7	174.1	-174	0	0	0	0	109.8	Y210 T211 D215 N216 V223	Y210-V213 PolarHBondContact O-N 3.47Å; T211-V213 VanDerWaalsContact C-N 3.28Å; T211-V213 PolarHBondContact O-N 3.25Å; V213-D215 VanDerWaalsContact C-N 3.28Å; V213-D215 PolarHBondContact O-N 2.94Å; V213-N216 PolarHBondContact O-N 2.96Å; V213-V223 HydrophobicContact CG2-CB 4.26Å; V213-V223 HydrophobicContact CG2-CG2 3.77Å
214	S	96.8	Very high	97.6	Very high	60 Å²	60	40.5 Å²	40.5	42%	0.42	19%	0.19	S	C	.	.	H	α-helix	trans	-66.4	-26.8	-178.4	64.2	0	0	0	0	114.2	R51 Y210 T211 N216	R51-S214 PolarHBondContact NH1-O 3.38Å; Y210-S214 PolarHBondContact O-N 3.42Å; Y210-S214 PolarHBondContact O-OG 3.46Å; T211-S214 WeakPolarHBondContact CA-OG 3.33Å; T211-S214 PolarHBondContact O-N 3.48Å; T211-S214 PolarHBondContact O-OG 2.95Å; S214-N216 VanDerWaalsContact C-N 3.28Å
215	D	96.8	Very high	97.7	Very high	8 Å²	8	40.5 Å²	40.5	4%	0.043	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	3.4	176.1	-60.8	-15.6	0	0	0	112.5	T54 T211 R212 V213 K217	T54-D215 WeakPolarHBondContact CB-OD2 3.2Å; T54-D215 PolarHBondContact N-OD2 3.46Å; T54-D215 PolarHBondContact OG1-OD1 3.42Å; T54-D215 PolarHBondContact OG1-OD2 2.92Å; T211-D215 WeakPolarHBondContact O-CB 3.34Å; T211-D215 PolarHBondContact O-N 3.38Å; T211-D215 VanDerWaalsContact O-OD2 3.12Å; R212-D215 IonicContact CZ-OD2 3.53Å; R212-D215 IonicContact NH2-OD2 2.8Å; R212-D215 PolarHBondContact NH2-OD2 3.35Å; V213-D215 VanDerWaalsContact C-N 3.28Å; V213-D215 PolarHBondContact O-N 2.94Å; D215-K217 HydrophobicContact CB-CG 3.71Å; D215-K217 PolarHBondContact O-N 3.47Å
216	N	96.4	Very high	97.7	Very high	15 Å²	15	40.5 Å²	40.5	8%	0.08	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	29.8	-176.8	-53.6	-35.1	0	0	0	113.6	Y48 P49 P128 N129 V213 S214	Y48-N216 VanDerWaalsContact CD1-OD1 3.31Å; Y48-N216 WeakPolarHBondContact CD1-OD1 3.22Å; P49-N216 PolarHBondContact O-ND2 3.42Å; P128-N216 HydrophobicContact CB-CB 4.33Å; N129-N216 HydrophobicContact CB-CB 4.38Å; N129-N216 PolarHBondContact N-O 3.48Å; V213-N216 PolarHBondContact O-N 2.96Å; S214-N216 VanDerWaalsContact C-N 3.28Å
217	K	95.9	Very high	97.7	Very high	5 Å²	5	38.8 Å²	38.8	2%	0.022	19%	0.185	C	C	.	.	S	Bend	trans	-89	-31	-178.1	-61.1	-72.7	169.9	153.2	0	112	R51 D53 R127 R212 D215	R51-K217 WeakPolarHBondContact O-CE 3.46Å; R51-K217 PolarHBondContact O-NZ 2.78Å; D53-K217 VanDerWaalsContact CG-NZ 3.26Å; D53-K217 VanDerWaalsContact OD1-CD 3.26Å; D53-K217 WeakPolarHBondContact OD1-CD 3.43Å; D53-K217 WeakPolarHBondContact OD1-CE 3.37Å; D53-K217 WeakPolarHBondContact OD1-CG 3.28Å; D53-K217 IonicContact OD1-NZ 3.22Å; D53-K217 PolarHBondContact OD1-NZ 3Å; D53-K217 VanDerWaalsContact OD1-NZ 3.16Å; D53-K217 IonicContact OD2-NZ 3.56Å; D53-K217 PolarHBondContact OD2-NZ 3.12Å; R127-K217 WeakPolarHBondContact CD-O 3.3Å; R127-K217 WeakPolarHBondContact CG-O 3.15Å; R212-K217 PolarHBondContact O-N 3.28Å; D215-K217 HydrophobicContact CB-CG 3.71Å; D215-K217 PolarHBondContact O-N 3.47Å
218	H	97.7	Very high	97.8	Very high	5 Å²	5	38.7 Å²	38.7	2%	0.023	19%	0.192	C	C	.	.	S	Bend	trans	-145.1	150.5	-176.4	-72.9	-71.3	0	0	0	110.4	S161 R212 D222 V223	S161-H218 PolarHBondContact O-CE1 3.41Å; S161-H218 PolarHBondContact O-ND1 3.38Å; S161-H218 PolarHBondContact OG-ND1 3.16Å; R212-H218 HydrophobicContact CB-CB 4.24Å; R212-H218 PolarHBondContact O-N 3.09Å; R212-H218 VanDerWaalsContact O-N 3.13Å; H218-D222 HydrophobicContact CB-CB 4.07Å; H218-V223 HydrophobicContact CB-CG2 3.88Å
219	H	97.9	Very high	97.8	Very high	23 Å²	23	39.6 Å²	39.6	11%	0.106	20%	0.197	C	C	.	.			trans	-69.2	154.8	168.3	-59	83.3	0	0	0	109.7	R125 P126 S221 D222 V223	R125-H219 VanDerWaalsContact CZ-CG 3.46Å; R125-H219 VanDerWaalsContact CZ-ND1 3.35Å; R125-H219 PolarHBondContact NE-ND1 2.91Å; R125-H219 PolarHBondContact NH2-CD2 2.89Å; R125-H219 VanDerWaalsContact NH2-CD2 3.25Å; R125-H219 PolarHBondContact NH2-ND1 3.49Å; P126-H219 PolarHBondContact O-CE1 3.22Å; P126-H219 VanDerWaalsContact O-CE1 3.26Å; H219-S221 PolarHBondContact O-N 3.41Å; H219-S221 VanDerWaalsContact O-N 3.16Å; H219-D222 WeakPolarHBondContact CB-OD2 3.11Å; H219-D222 IonicContact CG-OD2 3.61Å; H219-D222 PolarHBondContact N-OD2 3.08Å; H219-D222 VanDerWaalsContact N-OD2 3.07Å; H219-D222 IonicContact ND1-OD2 3.84Å; H219-D222 PolarHBondContact ND1-OD2 2.95Å; H219-D222 WeakPolarHBondContact O-CB 3.5Å; H219-D222 PolarHBondContact O-N 3.42Å; H219-V223 PolarHBondContact O-N 3.27Å
220	W	97.6	Very high	97.8	Very high	180 Å²	180	39.6 Å²	39.6	68%	0.682	20%	0.197	S	C	*	.	H	α-helix	trans	-55.7	-35.3	176.5	70.3	-96.7	0	0	0	112.2	V223 L224	W220-V223 PolarHBondContact O-N 3.18Å; W220-L224 HydrophobicContact CZ3-CD2 3.96Å; W220-L224 WeakPolarHBondContact O-CB 3.37Å; W220-L224 PolarHBondContact O-N 2.98Å
221	S	98.1	Very high	97.9	Very high	31 Å²	31	33.6 Å²	33.6	22%	0.217	18%	0.178	C	C	.	.	H	α-helix	trans	-70.1	-36.6	177.6	53.9	0	0	0	0	112.6	R125 H219 V223 L224 V225	R125-S221 PolarHBondContact NH1-OG 3.34Å; R125-S221 VanDerWaalsContact NH1-OG 3.1Å; H219-S221 PolarHBondContact O-N 3.41Å; H219-S221 VanDerWaalsContact O-N 3.16Å; S221-V223 VanDerWaalsContact C-N 3.27Å; S221-V223 PolarHBondContact O-N 2.94Å; S221-L224 PolarHBondContact O-N 3.39Å; S221-V225 WeakPolarHBondContact O-CG2 3.09Å; S221-V225 PolarHBondContact O-N 2.68Å
222	D	98.2	Very high	97.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-36.6	173.3	-56.9	-26.7	0	0	0	110.7	R125 S161 F162 Y163 S164 H218 H219 G226	R125-D222 IonicContact CZ-OD1 3.56Å; R125-D222 IonicContact NE-OD1 3.85Å; R125-D222 IonicContact NH1-OD1 2.68Å; R125-D222 PolarHBondContact NH1-OD1 3.28Å; R125-D222 IonicContact NH1-OD2 3.78Å; S161-D222 WeakPolarHBondContact CB-OD2 3.21Å; S161-D222 PolarHBondContact OG-OD2 2.96Å; F162-D222 WeakPolarHBondContact CD2-OD1 3.21Å; Y163-D222 VanDerWaalsContact CB-O 3.29Å; Y163-D222 WeakPolarHBondContact CB-O 3.18Å; S164-D222 PolarHBondContact N-O 3.32Å; H218-D222 HydrophobicContact CB-CB 4.07Å; H219-D222 WeakPolarHBondContact CB-OD2 3.11Å; H219-D222 IonicContact CG-OD2 3.61Å; H219-D222 PolarHBondContact N-OD2 3.08Å; H219-D222 VanDerWaalsContact N-OD2 3.07Å; H219-D222 IonicContact ND1-OD2 3.84Å; H219-D222 PolarHBondContact ND1-OD2 2.95Å; H219-D222 WeakPolarHBondContact O-CB 3.5Å; H219-D222 PolarHBondContact O-N 3.42Å; D222-G226 PolarHBondContact O-N 3.05Å
223	V	98.5	Very high	97.9	Very high	8 Å²	8	38.9 Å²	38.9	5%	0.048	21%	0.205	C	C	.	.	H	α-helix	trans	-69.4	-48.4	176.2	169.4	0	0	0	0	110.8	R212 V213 H218 H219 W220 S221 V225 G226 L227	R212-V223 HydrophobicContact CB-CG2 3.85Å; V213-V223 HydrophobicContact CG2-CB 4.26Å; V213-V223 HydrophobicContact CG2-CG2 3.77Å; H218-V223 HydrophobicContact CB-CG2 3.88Å; H219-V223 PolarHBondContact O-N 3.27Å; W220-V223 PolarHBondContact O-N 3.18Å; S221-V223 VanDerWaalsContact C-N 3.27Å; S221-V223 PolarHBondContact O-N 2.94Å; V223-V225 PolarHBondContact O-N 3.28Å; V223-G226 PolarHBondContact O-N 2.99Å; V223-L227 HydrophobicContact CG1-CD1 4.08Å; V223-L227 HydrophobicContact CG1-CG 4.4Å; V223-L227 WeakPolarHBondContact O-CG 3.26Å; V223-L227 PolarHBondContact O-N 2.79Å
224	L	98.5	Very high	97.9	Very high	80 Å²	80	36 Å²	36	42%	0.419	19%	0.188	S	C	.	.	H	α-helix	trans	-58.9	-48.9	-179.7	178.7	61.8	0	0	0	112	W220 S221 G226 L227 L228	W220-L224 HydrophobicContact CZ3-CD2 3.96Å; W220-L224 WeakPolarHBondContact O-CB 3.37Å; W220-L224 PolarHBondContact O-N 2.98Å; S221-L224 PolarHBondContact O-N 3.39Å; L224-G226 VanDerWaalsContact C-N 3.3Å; L224-G226 PolarHBondContact O-N 3.09Å; L224-L227 PolarHBondContact O-N 3.42Å; L224-L228 HydrophobicContact CD1-CD1 4.34Å; L224-L228 HydrophobicContact CD1-CG 4.37Å; L224-L228 HydrophobicContact CG-CD1 4.21Å; L224-L228 WeakPolarHBondContact O-CG 3.44Å; L224-L228 PolarHBondContact O-N 2.86Å
225	V	98.5	Very high	97.9	Very high	50 Å²	50	35.5 Å²	35.5	30%	0.303	18%	0.182	S	C	.	.	H	α-helix	trans	-62.2	-40.2	177.9	175.2	0	0	0	0	110.8	F162 Y163 S221 V223 L228 Q229	F162-V225 HydrophobicContact CE1-CG1 4.46Å; F162-V225 HydrophobicContact CE2-CG2 4.2Å; F162-V225 HydrophobicContact CZ-CB 4.32Å; F162-V225 HydrophobicContact CZ-CG1 3.95Å; F162-V225 HydrophobicContact CZ-CG2 4.16Å; Y163-V225 HydrophobicContact CD1-CG1 3.6Å; Y163-V225 HydrophobicContact CE1-CG1 4.3Å; Y163-V225 HydrophobicContact CG-CB 4.43Å; Y163-V225 HydrophobicContact CG-CG1 3.87Å; S221-V225 WeakPolarHBondContact O-CG2 3.09Å; S221-V225 PolarHBondContact O-N 2.68Å; V223-V225 PolarHBondContact O-N 3.28Å; V225-L228 PolarHBondContact O-N 3.29Å; V225-Q229 VanDerWaalsContact O-CB 3.31Å; V225-Q229 WeakPolarHBondContact O-CB 3.06Å; V225-Q229 PolarHBondContact O-N 3.07Å
226	G	98.4	Very high	97.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-49.1	174.4	0	0	0	0	0	112.3	Y163 A168 D222 V223 L224 L228 Q229 G230	Y163-G226 VanDerWaalsContact CD2-CA 3.48Å; A168-G226 WeakPolarHBondContact CA-O 3.35Å; D222-G226 PolarHBondContact O-N 3.05Å; V223-G226 PolarHBondContact O-N 2.99Å; L224-G226 VanDerWaalsContact C-N 3.3Å; L224-G226 PolarHBondContact O-N 3.09Å; G226-L228 PolarHBondContact O-N 3.16Å; G226-Q229 PolarHBondContact O-N 3.22Å; G226-G230 PolarHBondContact O-N 2.93Å
227	L	98.6	Very high	97.9	Very high	20 Å²	20	38 Å²	38	11%	0.105	20%	0.195	C	C	.	.	H	α-helix	trans	-59.3	-47.2	177.1	-64.7	172	0	0	0	111.5	M171 L206 V223 L224 Q229 G230 A231	M171-L227 HydrophobicContact CB-CD2 3.95Å; M171-L227 HydrophobicContact CE-CB 4.4Å; M171-L227 HydrophobicContact CE-CD2 3.81Å; M171-L227 VanDerWaalsContact CG-O 3.25Å; M171-L227 WeakPolarHBondContact CG-O 3.32Å; L206-L227 HydrophobicContact CD2-CD1 3.92Å; V223-L227 HydrophobicContact CG1-CD1 4.08Å; V223-L227 HydrophobicContact CG1-CG 4.4Å; V223-L227 WeakPolarHBondContact O-CG 3.26Å; V223-L227 PolarHBondContact O-N 2.79Å; L224-L227 PolarHBondContact O-N 3.42Å; L227-Q229 PolarHBondContact O-N 3.43Å; L227-G230 PolarHBondContact O-N 3.45Å; L227-A231 WeakPolarHBondContact O-CB 3.28Å; L227-A231 PolarHBondContact O-N 3.08Å
228	L	98.6	Very high	97.7	Very high	114 Å²	114	37.8 Å²	37.8	60%	0.597	20%	0.195	S	C	*	.	H	α-helix	trans	-61.4	-43.9	179.1	-70.9	174.6	0	0	0	112.1	L224 V225 G226 A231 L232	L224-L228 HydrophobicContact CD1-CD1 4.34Å; L224-L228 HydrophobicContact CD1-CG 4.37Å; L224-L228 HydrophobicContact CG-CD1 4.21Å; L224-L228 WeakPolarHBondContact O-CG 3.44Å; L224-L228 PolarHBondContact O-N 2.86Å; V225-L228 PolarHBondContact O-N 3.29Å; G226-L228 PolarHBondContact O-N 3.16Å; L228-A231 PolarHBondContact O-N 2.04Å; L228-L232 WeakPolarHBondContact O-CB 3.49Å; L228-L232 PolarHBondContact O-N 3.03Å
229	Q	98.5	Very high	97.4	Very high	20 Å²	20	43.1 Å²	43.1	9%	0.093	22%	0.219	C	C	.	.	H	α-helix	trans	-65.9	-45.8	179	179.3	-85.4	-40	0	0	111.7	S112 Y163 A168 V225 G226 L227 A231 L232 I233	S112-Q229 PolarHBondContact OG-NE2 3.45Å; S112-Q229 PolarHBondContact OG-OE1 3.11Å; Y163-Q229 HydrophobicContact CE2-CB 4.14Å; Y163-Q229 HydrophobicContact CE2-CG 4.08Å; Y163-Q229 VanDerWaalsContact CE2-OE1 3.3Å; Y163-Q229 VanDerWaalsContact OH-CG 3.29Å; Y163-Q229 WeakPolarHBondContact OH-CG 3.43Å; Y163-Q229 PolarHBondContact OH-OE1 3.29Å; A168-Q229 VanDerWaalsContact CB-OE1 3.23Å; V225-Q229 VanDerWaalsContact O-CB 3.31Å; V225-Q229 WeakPolarHBondContact O-CB 3.06Å; V225-Q229 PolarHBondContact O-N 3.07Å; G226-Q229 PolarHBondContact O-N 3.22Å; L227-Q229 PolarHBondContact O-N 3.43Å; Q229-A231 VanDerWaalsContact C-N 3.3Å; Q229-A231 PolarHBondContact O-N 2.82Å; Q229-L232 PolarHBondContact O-N 2.91Å; Q229-I233 WeakPolarHBondContact O-CG1 3.47Å; Q229-I233 PolarHBondContact O-N 2.75Å
230	G	98.4	Very high	97	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-42.2	176.3	0	0	0	0	0	111.9	A168 Y172 G226 L227 I233 A234	A168-G230 WeakPolarHBondContact O-CA 3.15Å; Y172-G230 WeakPolarHBondContact CA-O 3.29Å; G226-G230 PolarHBondContact O-N 2.93Å; L227-G230 PolarHBondContact O-N 3.45Å; G230-I233 PolarHBondContact O-N 3.22Å; G230-A234 WeakPolarHBondContact O-CB 3.33Å; G230-A234 PolarHBondContact O-N 2.94Å
231	A	98.6	Very high	96.5	Very high	24 Å²	24	44.9 Å²	44.9	20%	0.198	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-45.9	176.2	0	0	0	0	0	112.1	M171 L175 L227 L228 Q229 I233 A234 V235	M171-A231 HydrophobicContact CG-CB 3.81Å; M171-A231 HydrophobicContact SD-CB 4.47Å; L175-A231 HydrophobicContact CD2-CB 3.7Å; L227-A231 WeakPolarHBondContact O-CB 3.28Å; L227-A231 PolarHBondContact O-N 3.08Å; L228-A231 PolarHBondContact O-N 2.04Å; Q229-A231 VanDerWaalsContact C-N 3.3Å; Q229-A231 PolarHBondContact O-N 2.82Å; A231-I233 PolarHBondContact O-N 3.43Å; A231-A234 PolarHBondContact O-N 3.04Å; A231-V235 WeakPolarHBondContact O-CG2 3.39Å; A231-V235 PolarHBondContact O-N 2.68Å
232	L	98.5	Very high	95.9	Very high	99 Å²	99	43.7 Å²	43.7	52%	0.518	23%	0.225	S	C	.	.	H	α-helix	trans	-57.8	-49.9	177.5	176.5	61.9	0	0	0	111.3	L228 Q229 A234 V235 L236	L228-L232 WeakPolarHBondContact O-CB 3.49Å; L228-L232 PolarHBondContact O-N 3.03Å; Q229-L232 PolarHBondContact O-N 2.91Å; L232-A234 VanDerWaalsContact C-N 3.33Å; L232-A234 PolarHBondContact O-N 2.57Å; L232-V235 PolarHBondContact O-N 3Å; L232-L236 HydrophobicContact CD1-CD1 3.96Å; L232-L236 HydrophobicContact CD1-CG 4.05Å; L232-L236 HydrophobicContact CG-CD1 4.01Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 VanDerWaalsContact O-CG 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.28Å; L232-L236 PolarHBondContact O-N 2.97Å
233	I	98.3	Very high	94.9	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.077	24%	0.244	C	C	.	.	H	α-helix	trans	-65.3	-37.1	180	-62.2	-54.4	0	0	0	111.5	G108 V111 L115 Y172 Q229 G230 A231 L236 T237	G108-I233 WeakPolarHBondContact O-CG2 3.44Å; V111-I233 HydrophobicContact CG1-CD1 4.21Å; V111-I233 HydrophobicContact CG1-CG2 4.44Å; L115-I233 HydrophobicContact CD1-CD1 3.89Å; L115-I233 HydrophobicContact CD1-CG1 4.28Å; Y172-I233 HydrophobicContact CD2-CB 4.15Å; Y172-I233 HydrophobicContact CD2-CG2 3.86Å; Y172-I233 HydrophobicContact CE2-CG2 3.85Å; Q229-I233 WeakPolarHBondContact O-CG1 3.47Å; Q229-I233 PolarHBondContact O-N 2.75Å; G230-I233 PolarHBondContact O-N 3.22Å; A231-I233 PolarHBondContact O-N 3.43Å; I233-L236 HydrophobicContact CD1-CD1 4.49Å; I233-L236 PolarHBondContact O-N 3.33Å; I233-T237 VanDerWaalsContact O-CB 3.23Å; I233-T237 WeakPolarHBondContact O-CB 3.45Å; I233-T237 PolarHBondContact O-N 3.17Å; I233-T237 PolarHBondContact O-OG1 3.35Å
234	A	97.6	Very high	93.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-46.9	175.1	0	0	0	0	0	111.6	Y172 L175 F176 G230 A231 L232 T237 V238	Y172-A234 HydrophobicContact CD2-CB 3.88Å; Y172-A234 HydrophobicContact CE2-CB 4.25Å; L175-A234 HydrophobicContact CB-CB 4.01Å; L175-A234 HydrophobicContact CD2-CB 4.11Å; L175-A234 HydrophobicContact CG-CB 4.17Å; F176-A234 HydrophobicContact CB-CB 4.47Å; G230-A234 WeakPolarHBondContact O-CB 3.33Å; G230-A234 PolarHBondContact O-N 2.94Å; A231-A234 PolarHBondContact O-N 3.04Å; L232-A234 VanDerWaalsContact C-N 3.33Å; L232-A234 PolarHBondContact O-N 2.57Å; A234-T237 PolarHBondContact O-N 3.26Å; A234-V238 WeakPolarHBondContact O-CB 3.28Å; A234-V238 VanDerWaalsContact O-CG2 3.3Å; A234-V238 WeakPolarHBondContact O-CG2 3.5Å; A234-V238 PolarHBondContact O-N 3.07Å
235	V	96.9	Very high	92.2	Very high	49 Å²	49	48.8 Å²	48.8	30%	0.297	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-49.7	177.4	172.7	0	0	0	0	110.9	L175 L179 A231 L232 T237 V238 Q239	L175-V235 HydrophobicContact CD2-CG2 4.26Å; L179-V235 HydrophobicContact CD1-CG2 4.37Å; A231-V235 WeakPolarHBondContact O-CG2 3.39Å; A231-V235 PolarHBondContact O-N 2.68Å; L232-V235 PolarHBondContact O-N 3Å; V235-T237 PolarHBondContact O-N 3.39Å; V235-V238 PolarHBondContact O-N 3.43Å; V235-Q239 HydrophobicContact CG1-CG 4.21Å; V235-Q239 WeakPolarHBondContact O-CB 3.42Å; V235-Q239 VanDerWaalsContact O-CG 3.31Å; V235-Q239 WeakPolarHBondContact O-CG 3.49Å; V235-Q239 PolarHBondContact O-N 3.26Å
236	L	96.5	Very high	90.8	Very high	68 Å²	68	53 Å²	53	36%	0.356	26%	0.261	S	S	.	.	H	α-helix	trans	-61.6	-43.2	179.6	-68.2	178.1	0	0	0	112.1	L232 I233 Q239 Y240	L232-L236 HydrophobicContact CD1-CD1 3.96Å; L232-L236 HydrophobicContact CD1-CG 4.05Å; L232-L236 HydrophobicContact CG-CD1 4.01Å; L232-L236 HydrophobicContact CG-CG 4.44Å; L232-L236 VanDerWaalsContact O-CG 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.28Å; L232-L236 PolarHBondContact O-N 2.97Å; I233-L236 HydrophobicContact CD1-CD1 4.49Å; I233-L236 PolarHBondContact O-N 3.33Å; L236-Q239 PolarHBondContact O-N 2.95Å; L236-Y240 HydrophobicContact CB-CD2 4.48Å; L236-Y240 HydrophobicContact CD2-CD2 3.89Å; L236-Y240 HydrophobicContact CD2-CE2 3.67Å; L236-Y240 WeakPolarHBondContact O-CB 3.13Å; L236-Y240 WeakPolarHBondContact O-CD2 3.37Å; L236-Y240 PolarHBondContact O-N 3.18Å
237	T	95.4	Very high	88.6	Confident	6 Å²	6	61.6 Å²	61.6	4%	0.037	30%	0.301	C	S	.	.	I	π-helix	trans	-62.3	-46.6	178.2	-55.8	0	0	0	0	110.4	T104 F176 I233 A234 V235 V241 S242	T104-T237 WeakPolarHBondContact O-CG2 3.21Å; F176-T237 HydrophobicContact CD2-CG2 4.43Å; F176-T237 HydrophobicContact CE2-CG2 3.99Å; I233-T237 VanDerWaalsContact O-CB 3.23Å; I233-T237 WeakPolarHBondContact O-CB 3.45Å; I233-T237 PolarHBondContact O-N 3.17Å; I233-T237 PolarHBondContact O-OG1 3.35Å; A234-T237 PolarHBondContact O-N 3.26Å; V235-T237 PolarHBondContact O-N 3.39Å; T237-V241 HydrophobicContact CG2-CB 4.21Å; T237-V241 HydrophobicContact CG2-CG2 4.48Å; T237-V241 CarbonylContact O-C 3.03Å; T237-V241 WeakPolarHBondContact O-CA 3.48Å; T237-V241 VanDerWaalsContact O-CB 3.24Å; T237-V241 WeakPolarHBondContact O-CB 3.32Å; T237-V241 PolarHBondContact O-N 3.12Å; T237-S242 PolarHBondContact O-N 3.19Å
238	V	93.3	Very high	86.3	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.012	32%	0.318	C	S	.	.	I	π-helix	trans	-70.2	-38.5	-178.4	174.8	0	0	0	0	111.8	F176 L179 A234 V235 S242 F244 F245	F176-V238 HydrophobicContact CD2-CG2 3.59Å; F176-V238 HydrophobicContact CE2-CG2 3.83Å; F176-V238 HydrophobicContact CG-CG2 4.23Å; L179-V238 HydrophobicContact CB-CG1 4.12Å; L179-V238 HydrophobicContact CB-CG2 4.12Å; L179-V238 HydrophobicContact CD1-CB 4.02Å; L179-V238 HydrophobicContact CD1-CG1 4.31Å; L179-V238 HydrophobicContact CD1-CG2 3.93Å; A234-V238 WeakPolarHBondContact O-CB 3.28Å; A234-V238 VanDerWaalsContact O-CG2 3.3Å; A234-V238 WeakPolarHBondContact O-CG2 3.5Å; A234-V238 PolarHBondContact O-N 3.07Å; V235-V238 PolarHBondContact O-N 3.43Å; V238-S242 WeakPolarHBondContact CA-OG 3.39Å; V238-S242 PolarHBondContact O-OG 3.08Å; V238-F244 HydrophobicContact CG1-CD2 4.13Å; V238-F244 HydrophobicContact CG2-CD2 4.49Å; V238-F245 HydrophobicContact CG1-CD2 3.79Å; V238-F245 HydrophobicContact CG1-CE2 3.45Å; V238-F245 VanDerWaalsContact CG1-CE2 3.45Å
239	Q	90.4	Very high	83.3	Confident	116 Å²	116	66.8 Å²	66.8	54%	0.542	33%	0.325	S	S	.	.	I	π-helix	trans	-75.6	-41.3	-177.7	-72.7	-176.2	-10.2	0	0	113.6	V235 L236	V235-Q239 HydrophobicContact CG1-CG 4.21Å; V235-Q239 WeakPolarHBondContact O-CB 3.42Å; V235-Q239 VanDerWaalsContact O-CG 3.31Å; V235-Q239 WeakPolarHBondContact O-CG 3.49Å; V235-Q239 PolarHBondContact O-N 3.26Å; L236-Q239 PolarHBondContact O-N 2.95Å
240	Y	89.4	Confident	80.4	Confident	176 Å²	176	70.7 Å²	70.7	69%	0.69	35%	0.352	S	S	*	.	I	π-helix	trans	-108.9	-25.6	-169.7	-62.3	-71.8	0	0	0	114.3	L236	L236-Y240 HydrophobicContact CB-CD2 4.48Å; L236-Y240 HydrophobicContact CD2-CD2 3.89Å; L236-Y240 HydrophobicContact CD2-CE2 3.67Å; L236-Y240 WeakPolarHBondContact O-CB 3.13Å; L236-Y240 WeakPolarHBondContact O-CD2 3.37Å; L236-Y240 PolarHBondContact O-N 3.18Å
241	V	87.9	Confident	77.4	Confident	65 Å²	65	75.7 Å²	75.7	39%	0.394	39%	0.385	S	S	.	.	I	π-helix	trans	-103	-36.1	-177.2	-167.7	0	0	0	0	111.1	T104 F107 T237	T104-V241 HydrophobicContact CG2-CG1 4.05Å; F107-V241 HydrophobicContact CD1-CG1 4.18Å; F107-V241 HydrophobicContact CE1-CG2 4.31Å; T237-V241 HydrophobicContact CG2-CB 4.21Å; T237-V241 HydrophobicContact CG2-CG2 4.48Å; T237-V241 CarbonylContact O-C 3.03Å; T237-V241 WeakPolarHBondContact O-CA 3.48Å; T237-V241 VanDerWaalsContact O-CB 3.24Å; T237-V241 WeakPolarHBondContact O-CB 3.32Å; T237-V241 PolarHBondContact O-N 3.12Å
242	S	84.7	Confident	74.4	Confident	5 Å²	5	82.6 Å²	82.6	4%	0.035	42%	0.417	C	S	.	.			trans	-86.1	147.2	-179.9	98.2	0	0	0	0	112.6	T237 V238 F244	T237-S242 PolarHBondContact O-N 3.19Å; V238-S242 WeakPolarHBondContact CA-OG 3.39Å; V238-S242 PolarHBondContact O-OG 3.08Å; S242-F244 VanDerWaalsContact C-N 3.28Å; S242-F244 WeakPolarHBondContact OG-CB 3.47Å; S242-F244 WeakPolarHBondContact OG-CD2 3.18Å; S242-F244 VanDerWaalsContact OG-CG 3.23Å; S242-F244 WeakPolarHBondContact OG-CG 3.47Å; S242-F244 PolarHBondContact OG-N 2.91Å
243	D	77.9	Confident	71.5	Confident	77 Å²	77	81.7 Å²	81.7	41%	0.412	42%	0.419	S	S	.	.			trans	-90.1	17.7	169.1	-67.5	-36.9	0	0	0	112.2	K100 F245 K246	K100-D243 IonicContact NZ-OD2 3.32Å; D243-F245 PolarHBondContact O-N 3.4Å; D243-K246 HydrophobicContact CB-CD 4.42Å; D243-K246 PolarHBondContact O-N 3.07Å; D243-K246 WeakPolarHBondContact OD1-CD 3.39Å; D243-K246 WeakPolarHBondContact OD1-CE 3.22Å; D243-K246 IonicContact OD1-NZ 3.18Å; D243-K246 PolarHBondContact OD1-NZ 2.97Å
244	F	74.6	Confident	68.8	Low	16 Å²	16	83.3 Å²	83.3	7%	0.07	43%	0.429	C	S	.	.	S	Bend	trans	-64.3	-37.7	-169.3	-64.5	-11.6	0	0	0	113.7	V101 F176 Y180 A183 V238 S242	V101-F244 HydrophobicContact CB-CE1 4.19Å; V101-F244 HydrophobicContact CB-CZ 4.09Å; V101-F244 HydrophobicContact CG1-CE1 4.41Å; V101-F244 HydrophobicContact CG1-CZ 3.87Å; V101-F244 HydrophobicContact CG2-CE1 3.52Å; V101-F244 HydrophobicContact CG2-CZ 3.85Å; F176-F244 AromaticContact CE1-CE2 3.71Å; F176-F244 HydrophobicContact CE1-CE2 3.71Å; F176-F244 HydrophobicContact CE1-CZ 4.02Å; F176-F244 HydrophobicContact CE2-CE2 4.14Å; F176-F244 AromaticContact CZ-CE2 3.44Å; F176-F244 HydrophobicContact CZ-CE2 3.44Å; F176-F244 VanDerWaalsContact CZ-CE2 3.44Å; F176-F244 AromaticContact CZ-CZ 3.63Å; F176-F244 HydrophobicContact CZ-CZ 3.63Å; Y180-F244 HydrophobicContact CD2-CD2 4.12Å; Y180-F244 HydrophobicContact CD2-CE1 4.35Å; Y180-F244 AromaticContact CD2-CE2 3.82Å; Y180-F244 HydrophobicContact CD2-CE2 3.82Å; Y180-F244 AromaticContact CD2-CZ 3.96Å; Y180-F244 HydrophobicContact CD2-CZ 3.96Å; A183-F244 HydrophobicContact CB-CB 3.81Å; V238-F244 HydrophobicContact CG1-CD2 4.13Å; V238-F244 HydrophobicContact CG2-CD2 4.49Å; S242-F244 VanDerWaalsContact C-N 3.28Å; S242-F244 WeakPolarHBondContact OG-CB 3.47Å; S242-F244 WeakPolarHBondContact OG-CD2 3.18Å; S242-F244 VanDerWaalsContact OG-CG 3.23Å; S242-F244 WeakPolarHBondContact OG-CG 3.47Å; S242-F244 PolarHBondContact OG-N 2.91Å
245	F	65.9	Low	66.1	Low	103 Å²	103	90 Å²	90	45%	0.452	46%	0.461	S	S	.	.	S	Bend	trans	-96.4	-7.2	-179.2	-69.6	-73.4	0	0	0	113.9	Q182 A183 V238 D243 Q247	Q182-F245 HydrophobicContact CB-CE1 4.48Å; Q182-F245 HydrophobicContact CB-CZ 4.17Å; Q182-F245 HydrophobicContact CG-CE1 4.06Å; Q182-F245 HydrophobicContact CG-CZ 4.03Å; A183-F245 HydrophobicContact CB-CD1 4.16Å; A183-F245 HydrophobicContact CB-CE1 3.88Å; A183-F245 HydrophobicContact CB-CZ 4.08Å; V238-F245 HydrophobicContact CG1-CD2 3.79Å; V238-F245 HydrophobicContact CG1-CE2 3.45Å; V238-F245 VanDerWaalsContact CG1-CE2 3.45Å; D243-F245 PolarHBondContact O-N 3.4Å; F245-Q247 PolarHBondContact O-N 3.26Å
246	K	67.4	Low	63.6	Low	138 Å²	138	90.8 Å²	90.8	60%	0.6	47%	0.472	S	S	*	.	S	Bend	trans	-67.7	120.2	169.6	-67.9	-177.4	-169.9	159.6	0	107	D243 R248	D243-K246 HydrophobicContact CB-CD 4.42Å; D243-K246 PolarHBondContact O-N 3.07Å; D243-K246 WeakPolarHBondContact OD1-CD 3.39Å; D243-K246 WeakPolarHBondContact OD1-CE 3.22Å; D243-K246 IonicContact OD1-NZ 3.18Å; D243-K246 PolarHBondContact OD1-NZ 2.97Å; K246-R248 PolarHBondContact O-N 3.01Å
247	Q	52.2	Low	61.1	Low	180 Å²	180	91.8 Å²	91.8	84%	0.841	48%	0.478	S	S	*	.			trans	-52.2	120.3	169.1	-76.1	178.9	-5.8	0	0	106.6	F245 T249	F245-Q247 PolarHBondContact O-N 3.26Å; Q247-T249 PolarHBondContact O-N 3.36Å
248	R	52.2	Low	58.8	Low	123 Å²	123	98.3 Å²	98.3	46%	0.464	51%	0.508	S	S	.	.			trans	-62.5	100.1	162.3	-75.5	-177.9	179	158.8	-1.8	103.5	K246 P250	K246-R248 PolarHBondContact O-N 3.01Å; R248-P250 WeakPolarHBondContact O-CD 3.01Å
249	T	35.3	Very low	56.5	Low	121 Å²	121	103.9 Å²	103.9	74%	0.742	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-48.3	121.6	172.9	-29.3	0	0	0	0	104.8	Q247 P251	Q247-T249 PolarHBondContact O-N 3.36Å; T249-P251 VanDerWaalsContact O-N 3.17Å
250	P	36.4	Very low	54.6	Low	102 Å²	102	100.8 Å²	100.8	66%	0.662	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-51.2	132.5	167.9	21.2	-28.8	0	0	0	105.2	R248 L252	R248-P250 WeakPolarHBondContact O-CD 3.01Å; P250-L252 PolarHBondContact O-N 3.18Å
251	P	35.1	Very low	52.6	Low	104 Å²	104	99.3 Å²	99.3	68%	0.675	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-49.2	135.6	166	22.4	-29.8	0	0	0	105.7	T249 C253	T249-P251 VanDerWaalsContact O-N 3.17Å; P251-C253 PolarHBondContact O-N 3.23Å
252	L	37	Very low	50.6	Low	169 Å²	169	103.3 Å²	103.3	89%	0.885	54%	0.541	S	S	*	.			trans	-60.2	71.8	172	-165.3	102.7	0	0	0	107.3	P250 T254	P250-L252 PolarHBondContact O-N 3.18Å; L252-T254 PolarHBondContact O-N 3.26Å
253	C	36.9	Very low	48.6	Very low	81 Å²	81	110.5 Å²	110.5	55%	0.547	57%	0.574	S	S	.	*			trans	-80.3	103.6	170.1	-80.5	0	0	0	0	104.5	P251	P251-C253 PolarHBondContact O-N 3.23Å
254	T	42.1	Very low	46.9	Very low	48 Å²	48	114 Å²	114	29%	0.294	59%	0.592	S	S	.	*			trans	70.3	69.2	141	14.3	0	0	0	0	116	L252 A256 D257 E258	L252-T254 PolarHBondContact O-N 3.26Å; T254-A256 HydrophobicContact CG2-CB 3.87Å; T254-A256 PolarHBondContact O-N 3.25Å; T254-A256 VanDerWaalsContact O-N 3.17Å; T254-D257 VanDerWaalsContact CB-N 3.34Å; T254-D257 WeakPolarHBondContact CB-OD2 3.21Å; T254-D257 HydrophobicContact CG2-CB 3.89Å; T254-D257 WeakPolarHBondContact CG2-OD1 3.35Å; T254-D257 WeakPolarHBondContact CG2-OD2 3.47Å; T254-D257 PolarHBondContact O-N 3.29Å; T254-D257 PolarHBondContact OG1-OD2 3.1Å; T254-E258 PolarHBondContact O-N 2.58Å
255	Q	39.8	Very low	45.4	Very low	142 Å²	142	121.9 Å²	121.9	66%	0.664	63%	0.629	S	S	*	*	H	α-helix	trans	-52.5	-22	141.4	-82	-165.6	-21.1	0	0	111.3	Q259	Q255-Q259 VanDerWaalsContact O-CB 3.23Å; Q255-Q259 WeakPolarHBondContact O-CB 3.34Å; Q255-Q259 WeakPolarHBondContact O-CG 3.06Å; Q255-Q259 PolarHBondContact O-N 3.15Å
256	A	44.3	Very low	43.9	Very low	65 Å²	65	122.2 Å²	122.2	54%	0.537	64%	0.643	S	S	.	*	H	α-helix	trans	-77.5	-18.5	172.8	0	0	0	0	0	115.1	T254 A260	T254-A256 HydrophobicContact CG2-CB 3.87Å; T254-A256 PolarHBondContact O-N 3.25Å; T254-A256 VanDerWaalsContact O-N 3.17Å; A256-A260 WeakPolarHBondContact O-CB 3.47Å; A256-A260 PolarHBondContact O-N 3.5Å
257	D	45.7	Very low	42.3	Very low	89 Å²	89	124.2 Å²	124.2	48%	0.476	65%	0.652	S	S	.	*	H	α-helix	trans	-90.6	-38.7	175.5	-68.9	-28.5	0	0	0	110.5	T254 A260 E261	T254-D257 VanDerWaalsContact CB-N 3.34Å; T254-D257 WeakPolarHBondContact CB-OD2 3.21Å; T254-D257 HydrophobicContact CG2-CB 3.89Å; T254-D257 WeakPolarHBondContact CG2-OD1 3.35Å; T254-D257 WeakPolarHBondContact CG2-OD2 3.47Å; T254-D257 PolarHBondContact O-N 3.29Å; T254-D257 PolarHBondContact OG1-OD2 3.1Å; D257-A260 PolarHBondContact O-N 3.15Å; D257-E261 PolarHBondContact O-N 2.9Å
258	E	46.2	Very low	41.4	Very low	142 Å²	142	121.2 Å²	121.2	66%	0.664	65%	0.648	S	S	*	*	H	α-helix	trans	-65.2	-39.4	173.1	-77.9	179	153.3	0	0	111.5	T254 E262	T254-E258 PolarHBondContact O-N 2.58Å; E258-E262 PolarHBondContact O-N 2.7Å
259	Q	45.1	Very low	40.5	Very low	120 Å²	120	122.3 Å²	122.3	56%	0.561	66%	0.663	S	S	*	*	H	α-helix	trans	-71.3	-27.8	173.3	-72.4	-179.1	-15.8	0	0	113.2	Q255 Q263	Q255-Q259 VanDerWaalsContact O-CB 3.23Å; Q255-Q259 WeakPolarHBondContact O-CB 3.34Å; Q255-Q259 WeakPolarHBondContact O-CG 3.06Å; Q255-Q259 PolarHBondContact O-N 3.15Å; Q259-Q263 WeakPolarHBondContact O-CB 3.43Å; Q259-Q263 WeakPolarHBondContact O-CG 3.46Å; Q259-Q263 PolarHBondContact O-N 3.17Å
260	A	50.6	Low	40.7	Very low	50 Å²	50	121.8 Å²	121.8	41%	0.413	66%	0.662	S	S	.	*	H	α-helix	trans	-76.8	-35.1	175.9	0	0	0	0	0	112.1	A256 D257 L264	A256-A260 WeakPolarHBondContact O-CB 3.47Å; A256-A260 PolarHBondContact O-N 3.5Å; D257-A260 PolarHBondContact O-N 3.15Å; A260-L264 WeakPolarHBondContact O-CB 3.46Å; A260-L264 PolarHBondContact O-N 3.45Å; A260-L264 VanDerWaalsContact O-N 3.15Å
261	E	46.9	Very low	40.7	Very low	146 Å²	146	125.7 Å²	125.7	68%	0.682	67%	0.671	S	S	*	*	H	α-helix	trans	-68.2	-43.2	170.6	-90.3	-177.6	145.6	0	0	111.5	D257 Q263 L264 E265	D257-E261 PolarHBondContact O-N 2.9Å; E261-Q263 PolarHBondContact O-N 2.02Å; E261-L264 PolarHBondContact O-N 3.18Å; E261-E265 PolarHBondContact O-N 3.33Å
262	E	46.6	Very low	40.6	Very low	148 Å²	148	126.8 Å²	126.8	69%	0.692	68%	0.679	S	S	*	*	H	α-helix	trans	-64.8	-34.9	175.9	-100.1	-174.8	135.5	0	0	113.3	E258	E258-E262 PolarHBondContact O-N 2.7Å
263	Q	43.1	Very low	40.5	Very low	156 Å²	156	126.3 Å²	126.3	73%	0.729	68%	0.676	S	S	*	*	H	α-helix	trans	-77.5	-24.5	176.7	-79.2	-168.7	-20.9	0	0	113.7	Q259 E261	Q259-Q263 WeakPolarHBondContact O-CB 3.43Å; Q259-Q263 WeakPolarHBondContact O-CG 3.46Å; Q259-Q263 PolarHBondContact O-N 3.17Å; E261-Q263 PolarHBondContact O-N 2.02Å
264	L	42.5	Very low	40.1	Very low	151 Å²	151	129.1 Å²	129.1	79%	0.791	69%	0.686	S	S	*	*	H	α-helix	trans	-77.8	-31.1	177.5	-148.7	81.3	0	0	0	112	A260 E261 C266	A260-L264 WeakPolarHBondContact O-CB 3.46Å; A260-L264 PolarHBondContact O-N 3.45Å; A260-L264 VanDerWaalsContact O-N 3.15Å; E261-L264 PolarHBondContact O-N 3.18Å; L264-C266 VanDerWaalsContact C-N 3.28Å; L264-C266 PolarHBondContact O-N 2.97Å
265	E	41.4	Very low	39.4	Very low	181 Å²	181	131.9 Å²	131.9	85%	0.846	71%	0.707	S	S	*	*	H	α-helix	trans	-71.7	-20.1	175.3	-111.6	-174.1	115	0	0	113.5	E261	E261-E265 PolarHBondContact O-N 3.33Å
266	C	35.9	Very low	38.9	Very low	110 Å²	110	133 Å²	133	74%	0.743	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	13.6	-170.9	-138.2	0	0	0	0	114.7	L264	L264-C266 VanDerWaalsContact C-N 3.28Å; L264-C266 PolarHBondContact O-N 2.97Å
267	K	33.8	Very low	38.3	Very low	180 Å²	180	138.1 Å²	138.1	78%	0.783	73%	0.725	S	S	*	*			trans	-104.8	111.3	177.7	-135.8	177	-173	179	0	110.8	N269	K267-N269 PolarHBondContact O-N 2.86Å
268	P	33.4	Very low	37.4	Very low	118 Å²	118	136.7 Å²	136.7	77%	0.766	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-67.4	128.5	173	7.3	2.2	0	0	0	109.2
269	N	32.8	Very low	36.6	Very low	145 Å²	145	137.7 Å²	137.7	78%	0.775	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-65.6	133.6	176	-158.2	17.2	0	0	0	109.8	K267 Q271	K267-N269 PolarHBondContact O-N 2.86Å; N269-Q271 PolarHBondContact O-N 2.84Å
270	P	38.5	Very low	35.9	Very low	111 Å²	111	139.3 Å²	139.3	72%	0.721	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-68.5	125.6	173.7	-10.9	25.8	0	0	0	109.8
271	Q	36.3	Very low	35	Very low	183 Å²	183	147.4 Å²	147.4	86%	0.855	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-71.1	144.7	170.6	-71.4	-175.5	-34.9	0	0	110.6	N269	N269-Q271 PolarHBondContact O-N 2.84Å
272	P	34.1	Very low	34.3	Very low	128 Å²	128	145.4 Å²	145.4	83%	0.831	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-73	150.6	175.2	-7.5	24.4	0	0	0	112
273	L	34.1	Very low	33.5	Very low	158 Å²	158	147 Å²	147	83%	0.827	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-60.2	165.4	174.5	-123	85.5	0	0	0	113.8
274	D	29.5	Very low	33.6	Very low	141 Å²	141	145.2 Å²	145.2	75%	0.754	78%	0.781	S	S	*	*			trans	90.8	127.8	171.5	-59.5	-22.7	0	0	0	114.9
275	S	27.5	Very low	33	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	78%	0.776	S	S	*	*			cis	-170.2	144.4	15.3	27.9	0	0	0	0	111.5
276	Q	28.9	Very low	32.8	Very low	167 Å²	167	141.2 Å²	141.2	78%	0.78	78%	0.781	S	S	*	*			trans	69.8	132.5	142.1	-83	-170.5	6.1	0	0	124.7
277	H	31.1	Very low	32.7	Very low	171 Å²	171	144.2 Å²	144.2	79%	0.792	81%	0.814	S	S	*	*			trans	71.4	118.7	155.6	-74.2	79.9	0	0	0	116.9
278	G	26.9	Very low	32.6	Very low	60 Å²	60	142.5 Å²	142.5	62%	0.619	82%	0.815	S	S	*	*			cis	115.4	99.2	23.6	0	0	0	0	0	109.2
279	N	29.2	Very low	32.6	Very low	163 Å²	163	143.7 Å²	143.7	87%	0.872	82%	0.818	S	S	*	*			trans	162.1	130.2	134.4	-84.1	-16.6	0	0	0	114.8
280	H	30.6	Very low	32.6	Very low	154 Å²	154	143.7 Å²	143.7	71%	0.713	82%	0.82	S	S	*	*			trans	-14	140.9	152.5	-76.5	-89.5	0	0	0	119.2
281	Y	31.7	Very low	32.2	Very low	219 Å²	219	145.6 Å²	145.6	86%	0.859	83%	0.826	S	S	*	*				179.7	152.9	91.6	-100.8	-79.5	0	0	0	112.8
282	S	31.9	Very low	31.9	Very low	104 Å²	104	143.3 Å²	143.3	73%	0.727	82%	0.824	S	S	*	*			trans	-68.9	161.6	178.9	-40.2	0	0	0	0	115.1
283	H	31.3	Very low	31.8	Very low	182 Å²	182	144.3 Å²	144.3	84%	0.843	82%	0.824	S	S	*	*			trans	3.6	168.9	153.9	-98	-48	0	0	0	121.7
284	P	43.6	Very low	31.6	Very low	118 Å²	118	143.3 Å²	143.3	77%	0.766	82%	0.824	S	S	*	*			cis	-139.3	-168.5	7.5	31.1	-4.6	0	0	0	115
285	G	31.6	Very low	31.8	Very low	67 Å²	67	143.5 Å²	143.5	69%	0.691	83%	0.829	S	S	*	*			trans	-87.6	-155.2	-174.6	0	0	0	0	0	118.6
286	L	36.2	Very low	32.2	Very low	182 Å²	182	146.7 Å²	146.7	95%	0.953	84%	0.837	S	S	*	*			trans	88.4	111.6	-177	-88.5	92.3	0	0	0	118.1
287	A	33.1	Very low	32.5	Very low	173 Å²	173	144.8 Å²	144.8	100%	1.43	84%	0.842	S	S	*	*				-138.7	0	114.6	0	0	0	0	0	108.2

Retrieved 287 of 287 residues in 108.7 ms (Link to these results)

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