A0A087Y9I2_POEFO Loading...

Ras-related protein Rab-4

The small GTPases Rab are key regulators of intracellular membrane trafficking, from the formation of transport vesicles to their fusion with membranes. Rabs cycle between an inactive GDP-bound form and an active GTP-bound form that is able to recruit to membranes different sets of downstream effectors directly responsible for vesicle formation, movement, tethering and fusion.

AlphaFold DB (A0A3B3UFC4), UniProt , Accession A0A087Y9I2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 213 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	44.1	Very low	84	Confident	237 Å²	237	60.1 Å²	60.1	100%	1.167	32%	0.319	S	S	*	.				0	124.2	0	-67	174.7	-176.1	0	0	106.1	E3	M1-E3 PolarHBondContact O-N 3.39Å
2	S	59.4	Low	85.1	Confident	103 Å²	103	55.1 Å²	55.1	72%	0.72	29%	0.292	S	S	*	.			trans	-67.8	120.7	177.5	58.4	0	0	0	0	108.3	S4	S2-S4 PolarHBondContact O-N 3.24Å; S2-S4 VanDerWaalsContact O-N 3.12Å
3	E	68.4	Low	86.1	Confident	141 Å²	141	50.8 Å²	50.8	66%	0.659	27%	0.27	S	S	*	.			trans	-63.8	113.2	170.4	-71.9	-179.5	173.2	0	0	107.6	M1 Y5 I49	M1-E3 PolarHBondContact O-N 3.39Å; E3-Y5 WeakPolarHBondContact O-CD1 3.31Å; E3-I49 HydrophobicContact CB-CD1 3.52Å; E3-I49 WeakPolarHBondContact OE2-CD1 3.39Å
4	S	86.6	Confident	86.9	Confident	65 Å²	65	47.2 Å²	47.2	46%	0.455	25%	0.251	S	S	.	.			trans	-73.1	135.2	-178.7	68.7	0	0	0	0	110.2	S2 T56	S2-S4 PolarHBondContact O-N 3.24Å; S2-S4 VanDerWaalsContact O-N 3.12Å; S4-T56 WeakPolarHBondContact O-CG2 3.43Å
5	Y	91.8	Very high	87.5	Confident	40 Å²	40	44.1 Å²	44.1	16%	0.157	23%	0.234	C	C	.	.			trans	-126.9	156.1	175.4	52.9	-91.2	0	0	0	110.6	E3 F7 L8 I49 K58 G190 D191 A192	E3-Y5 WeakPolarHBondContact O-CD1 3.31Å; Y5-F7 VanDerWaalsContact CD2-O 3.29Å; Y5-F7 WeakPolarHBondContact CD2-O 3.33Å; Y5-L8 HydrophobicContact CD2-CB 4.28Å; Y5-L8 HydrophobicContact CE2-CB 3.73Å; Y5-L8 HydrophobicContact CE2-CD1 4.34Å; Y5-I49 HydrophobicContact CD1-CD1 4.14Å; Y5-K58 HydrophobicContact CD1-CB 3.83Å; Y5-K58 HydrophobicContact CD1-CD 3.77Å; Y5-K58 HydrophobicContact CD1-CG 4.43Å; Y5-K58 HydrophobicContact CD2-CB 3.92Å; Y5-K58 HydrophobicContact CE1-CB 4.18Å; Y5-K58 HydrophobicContact CE1-CD 3.42Å; Y5-K58 VanDerWaalsContact CE1-CD 3.42Å; Y5-K58 HydrophobicContact CE1-CG 4.45Å; Y5-K58 HydrophobicContact CE2-CB 4.27Å; Y5-K58 HydrophobicContact CG-CB 3.68Å; Y5-K58 HydrophobicContact CG-CD 4.44Å; Y5-G190 CarbonylContact O-C 3.59Å; Y5-G190 VanDerWaalsContact O-CA 3.25Å; Y5-G190 WeakPolarHBondContact O-CA 3.21Å; Y5-D191 PolarHBondContact O-N 3.38Å; Y5-A192 WeakPolarHBondContact O-CB 3.26Å; Y5-A192 PolarHBondContact O-N 3.43Å
6	D	92.7	Very high	88	Confident	16 Å²	16	43.3 Å²	43.3	9%	0.086	23%	0.23	C	C	.	.	S	Bend	trans	-83.8	-40.9	176	-61.5	-61.2	0	0	0	111.1	K55 T56 G190 A193	D6-K55 HydrophobicContact CB-CD 4.33Å; D6-K55 WeakPolarHBondContact OD2-CA 3.41Å; D6-T56 PolarHBondContact N-O 2.7Å; D6-T56 PolarHBondContact OD2-N 3.3Å; D6-G190 PolarHBondContact O-N 3.33Å; D6-A193 HydrophobicContact CB-CB 4.36Å; D6-A193 WeakPolarHBondContact O-CB 3.23Å
7	F	94.7	Very high	88.4	Confident	19 Å²	19	43 Å²	43	8%	0.083	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	149.5	-177.7	-63.3	-84.2	0	0	0	111.4	Y5 F9 K55 T56 V57 K58 L170 I173 I187 Q188 Y189	Y5-F7 VanDerWaalsContact CD2-O 3.29Å; Y5-F7 WeakPolarHBondContact CD2-O 3.33Å; F7-F9 HydrophobicContact CB-CD1 4.25Å; F7-F9 HydrophobicContact CB-CE1 3.63Å; F7-F9 HydrophobicContact CB-CZ 3.92Å; F7-F9 HydrophobicContact CD1-CE1 4.21Å; F7-F9 HydrophobicContact CG-CE1 4.09Å; F7-F9 HydrophobicContact CG-CZ 4.25Å; F7-K55 HydrophobicContact CE2-CD 4.25Å; F7-K55 HydrophobicContact CE2-CG 4.3Å; F7-T56 PolarHBondContact N-O 3.38Å; F7-V57 HydrophobicContact CB-CG1 4.41Å; F7-V57 HydrophobicContact CB-CG2 4.42Å; F7-V57 CarbonylContact O-C 3.57Å; F7-V57 WeakPolarHBondContact O-CA 3.26Å; F7-K58 PolarHBondContact O-N 2.8Å; F7-L170 HydrophobicContact CD2-CD2 3.67Å; F7-L170 HydrophobicContact CE2-CD2 3.72Å; F7-L170 HydrophobicContact CG-CD2 4.26Å; F7-L170 HydrophobicContact CZ-CD2 4.34Å; F7-I173 HydrophobicContact CD1-CD1 4.45Å; F7-I173 HydrophobicContact CE1-CD1 4.32Å; F7-I187 HydrophobicContact CD1-CG2 4.31Å; F7-Q188 CarbonylContact C-O 3.59Å; F7-Q188 WeakPolarHBondContact CA-O 3.25Å; F7-Y189 HydrophobicContact CD1-CD1 4.15Å; F7-Y189 HydrophobicContact CD1-CE1 4.31Å; F7-Y189 AromaticContact CE1-CD1 3.77Å; F7-Y189 HydrophobicContact CE1-CD1 3.77Å; F7-Y189 AromaticContact CE1-CE1 3.52Å; F7-Y189 HydrophobicContact CE1-CE1 3.52Å; F7-Y189 HydrophobicContact CZ-CD1 4.49Å; F7-Y189 HydrophobicContact CZ-CE1 4.15Å
8	L	95.4	Very high	88.7	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.3	165.9	175.8	160.8	0	0	0	108.2	Y5 K58 Q60 I187 Q188	Y5-L8 HydrophobicContact CD2-CB 4.28Å; Y5-L8 HydrophobicContact CE2-CB 3.73Å; Y5-L8 HydrophobicContact CE2-CD1 4.34Å; L8-K58 CarbonylContact C-O 3.58Å; L8-K58 VanDerWaalsContact CA-O 3.26Å; L8-K58 WeakPolarHBondContact CA-O 3.17Å; L8-K58 HydrophobicContact CB-CB 4.49Å; L8-Q60 HydrophobicContact CD1-CG 4.23Å; L8-Q60 HydrophobicContact CD2-CG 4.34Å; L8-Q60 HydrophobicContact CG-CG 4.21Å; L8-I187 CarbonylContact O-C 3.34Å; L8-I187 WeakPolarHBondContact O-CA 3.14Å; L8-Q188 HydrophobicContact CB-CB 4.26Å; L8-Q188 HydrophobicContact CD2-CB 4.44Å; L8-Q188 HydrophobicContact CD2-CG 4.41Å; L8-Q188 PolarHBondContact N-O 3.02Å; L8-Q188 PolarHBondContact O-N 3.01Å
9	F	96.9	Very high	89.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.7	176.4	-59.4	-25.8	0	0	0	110.9	F7 F11 V57 K58 L59 Q60 A166 I169 L170 I173 I187	F7-F9 HydrophobicContact CB-CD1 4.25Å; F7-F9 HydrophobicContact CB-CE1 3.63Å; F7-F9 HydrophobicContact CB-CZ 3.92Å; F7-F9 HydrophobicContact CD1-CE1 4.21Å; F7-F9 HydrophobicContact CG-CE1 4.09Å; F7-F9 HydrophobicContact CG-CZ 4.25Å; F9-F11 HydrophobicContact CB-CD1 3.97Å; F9-F11 HydrophobicContact CB-CE1 3.66Å; F9-F11 HydrophobicContact CD2-CE1 4.16Å; F9-F11 HydrophobicContact CG-CE1 4.35Å; F9-V57 HydrophobicContact CD2-CG1 3.35Å; F9-V57 HydrophobicContact CE2-CG1 3.52Å; F9-V57 HydrophobicContact CE2-CG2 4.23Å; F9-V57 HydrophobicContact CG-CG1 3.88Å; F9-V57 HydrophobicContact CZ-CG1 4.19Å; F9-K58 PolarHBondContact N-O 2.77Å; F9-L59 HydrophobicContact CB-CD2 3.99Å; F9-L59 HydrophobicContact CD2-CD2 4.05Å; F9-L59 HydrophobicContact CG-CD2 4.48Å; F9-Q60 PolarHBondContact O-N 2.83Å; F9-A166 HydrophobicContact CD2-CB 4.25Å; F9-A166 HydrophobicContact CE2-CB 4.29Å; F9-I169 HydrophobicContact CD1-CG2 4.21Å; F9-I169 HydrophobicContact CD2-CB 4.4Å; F9-I169 HydrophobicContact CD2-CD1 4.27Å; F9-I169 HydrophobicContact CD2-CG2 4.19Å; F9-I169 HydrophobicContact CE1-CG2 3.86Å; F9-I169 HydrophobicContact CE2-CB 4.03Å; F9-I169 HydrophobicContact CE2-CG2 3.84Å; F9-I169 HydrophobicContact CG-CG2 4.39Å; F9-I169 HydrophobicContact CZ-CB 4.31Å; F9-I169 HydrophobicContact CZ-CG2 3.67Å; F9-L170 HydrophobicContact CE2-CD2 4.38Å; F9-L170 HydrophobicContact CE2-CG 4.06Å; F9-L170 HydrophobicContact CZ-CD2 3.76Å; F9-L170 HydrophobicContact CZ-CG 3.89Å; F9-I173 HydrophobicContact CE1-CD1 3.92Å; F9-I173 HydrophobicContact CZ-CD1 4.01Å; F9-I187 HydrophobicContact CD1-CB 4.26Å; F9-I187 HydrophobicContact CD1-CG1 3.86Å; F9-I187 HydrophobicContact CD1-CG2 3.9Å; F9-I187 HydrophobicContact CE1-CB 4.41Å; F9-I187 HydrophobicContact CE1-CG1 4.06Å; F9-I187 HydrophobicContact CE1-CG2 3.67Å
10	K	96.6	Very high	89.5	Confident	33 Å²	33	39.7 Å²	39.7	14%	0.143	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119.8	171.6	166	161.3	177.8	-160.9	0	111.5	W62 Y77 R79 G80 A81 A82 G83 G186	K10-W62 HydrophobicContact CB-CE3 4.47Å; K10-W62 HydrophobicContact CB-CH2 4.01Å; K10-W62 HydrophobicContact CB-CZ3 3.6Å; K10-W62 HydrophobicContact CD-CE3 4.09Å; K10-W62 HydrophobicContact CD-CH2 3.54Å; K10-W62 HydrophobicContact CD-CZ2 4.07Å; K10-W62 HydrophobicContact CD-CZ3 3.59Å; K10-W62 HydrophobicContact CG-CE3 3.68Å; K10-W62 HydrophobicContact CG-CH2 3.69Å; K10-W62 HydrophobicContact CG-CZ3 3.2Å; K10-Y77 WeakPolarHBondContact CE-O 3.48Å; K10-Y77 PolarHBondContact NZ-O 2.95Å; K10-R79 PolarHBondContact NZ-O 3.24Å; K10-G80 VanDerWaalsContact CD-O 3.27Å; K10-G80 WeakPolarHBondContact CD-O 3.41Å; K10-G80 WeakPolarHBondContact CG-O 3.43Å; K10-A81 HydrophobicContact CG-CB 4.37Å; K10-A82 PolarHBondContact O-N 3.05Å; K10-G83 PolarHBondContact O-N 3.04Å; K10-G186 PolarHBondContact N-O 2.87Å
11	F	97.9	Very high	89.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	148.5	-176.5	-84.9	32.3	0	0	0	111.9	F9 L59 Q60 I61 W62 G83 L85 F162 C165 A166 I169	F9-F11 HydrophobicContact CB-CD1 3.97Å; F9-F11 HydrophobicContact CB-CE1 3.66Å; F9-F11 HydrophobicContact CD2-CE1 4.16Å; F9-F11 HydrophobicContact CG-CE1 4.35Å; F11-L59 HydrophobicContact CD1-CD2 4.3Å; F11-L59 HydrophobicContact CD2-CD1 4.34Å; F11-L59 HydrophobicContact CE1-CD2 3.88Å; F11-L59 HydrophobicContact CE2-CD1 4.02Å; F11-L59 HydrophobicContact CE2-CD2 4.11Å; F11-L59 HydrophobicContact CZ-CD1 4.47Å; F11-L59 HydrophobicContact CZ-CD2 3.78Å; F11-Q60 PolarHBondContact N-O 2.95Å; F11-I61 HydrophobicContact CB-CB 4.45Å; F11-I61 HydrophobicContact CB-CG1 4.07Å; F11-I61 HydrophobicContact CB-CG2 4.33Å; F11-I61 WeakPolarHBondContact O-CA 3.45Å; F11-W62 VanDerWaalsContact O-CE3 3.31Å; F11-W62 PolarHBondContact O-N 2.66Å; F11-G83 CarbonylContact C-O 3.55Å; F11-G83 VanDerWaalsContact CA-O 3.27Å; F11-G83 WeakPolarHBondContact CA-O 2.83Å; F11-L85 HydrophobicContact CD2-CD1 4.4Å; F11-F162 HydrophobicContact CD2-CD1 4.06Å; F11-F162 HydrophobicContact CE2-CD1 4.38Å; F11-C165 HydrophobicContact CE2-CB 3.59Å; F11-C165 HydrophobicContact CZ-CB 3.76Å; F11-C165 VanDerWaalsContact CZ-SG 3.56Å; F11-A166 HydrophobicContact CZ-CB 4.12Å; F11-I169 HydrophobicContact CD1-CD1 4.44Å; F11-I169 HydrophobicContact CE1-CD1 3.41Å; F11-I169 VanDerWaalsContact CE1-CD1 3.41Å; F11-I169 HydrophobicContact CZ-CD1 3.85Å
12	L	97.2	Very high	92.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	151.4	169.1	-53.6	172	0	0	0	110.6	I14 W62 Y78 A81 G83 A84 L85	L12-I14 HydrophobicContact CB-CG2 3.89Å; L12-I14 HydrophobicContact CD1-CG2 4.48Å; L12-W62 WeakPolarHBondContact CA-O 3.25Å; L12-W62 HydrophobicContact CD2-CB 3.92Å; L12-Y78 HydrophobicContact CD1-CD1 4.12Å; L12-Y78 HydrophobicContact CD1-CD2 4.2Å; L12-Y78 HydrophobicContact CD1-CE1 4.48Å; L12-Y78 HydrophobicContact CD1-CG 3.96Å; L12-A81 HydrophobicContact CD1-CB 3.65Å; L12-A81 HydrophobicContact CD2-CB 4.35Å; L12-A81 HydrophobicContact CG-CB 3.67Å; L12-G83 PolarHBondContact N-O 3.45Å; L12-A84 HydrophobicContact CB-CB 4.05Å; L12-A84 CarbonylContact O-C 3.25Å; L12-A84 VanDerWaalsContact O-CA 3.24Å; L12-A84 WeakPolarHBondContact O-CA 3.4Å; L12-L85 PolarHBondContact O-N 2.76Å
13	V	97.6	Very high	94.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.6	161.3	-166.3	0	0	0	0	107.5	K21 I61 W62 T64 L85 V87 F162	V13-K21 HydrophobicContact CB-CB 4.41Å; V13-K21 HydrophobicContact CG1-CB 3.6Å; V13-K21 HydrophobicContact CG1-CD 4.13Å; V13-K21 HydrophobicContact CG1-CG 3.8Å; V13-I61 HydrophobicContact CG2-CG2 3.63Å; V13-W62 PolarHBondContact N-O 3.27Å; V13-T64 PolarHBondContact O-N 2.83Å; V13-T64 PolarHBondContact O-OG1 2.97Å; V13-L85 HydrophobicContact CG1-CB 4.32Å; V13-V87 HydrophobicContact CG1-CG2 3.73Å; V13-F162 HydrophobicContact CG2-CE1 4.41Å; V13-F162 HydrophobicContact CG2-CZ 4.42Å
14	I	97	Very high	95.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	156.8	-171.2	64.2	171.6	0	0	0	111.4	L12 K21 T64 Y78 L85 L86 V87 W102 A106	L12-I14 HydrophobicContact CB-CG2 3.89Å; L12-I14 HydrophobicContact CD1-CG2 4.48Å; I14-K21 VanDerWaalsContact C-CD 3.42Å; I14-T64 HydrophobicContact CG2-CG2 4.32Å; I14-Y78 HydrophobicContact CG2-CE2 4.4Å; I14-Y78 WeakPolarHBondContact CG2-OH 3.41Å; I14-L85 PolarHBondContact N-O 3.29Å; I14-L86 HydrophobicContact CD1-CD1 4.04Å; I14-L86 HydrophobicContact CG1-CB 4.35Å; I14-L86 HydrophobicContact CG1-CD1 3.88Å; I14-V87 PolarHBondContact O-N 3.1Å; I14-W102 HydrophobicContact CB-CE3 4.09Å; I14-W102 HydrophobicContact CB-CZ3 4.44Å; I14-W102 HydrophobicContact CD1-CB 4.49Å; I14-A106 HydrophobicContact CD1-CB 3.8Å
15	G	96.9	Very high	96	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	137.3	170	-175.8	0	0	0	0	0	112.4	K21 G66 V87 W102	G15-K21 WeakPolarHBondContact O-CE 3.41Å; G15-K21 PolarHBondContact O-NZ 2.83Å; G15-G66 WeakPolarHBondContact O-CA 3.5Å; G15-V87 WeakPolarHBondContact CA-O 3.31Å; G15-W102 WeakPolarHBondContact O-CZ2 3.12Å
16	N	95.6	Very high	96.2	Very high	32 Å²	32	13.9 Å²	13.9	17%	0.171	9%	0.092	C	C	.	.			trans	-56.8	159.6	-176.2	-83.3	29	0	0	0	113.3	T19 K21 T95 A98 W102	N16-T19 HydrophobicContact CB-CG2 4.01Å; N16-T19 WeakPolarHBondContact O-CG2 3.48Å; N16-T19 PolarHBondContact O-OG1 3.48Å; N16-K21 PolarHBondContact O-NZ 2.82Å; N16-T95 HydrophobicContact CB-CG2 3.96Å; N16-A98 VanDerWaalsContact OD1-CB 3.26Å; N16-A98 WeakPolarHBondContact OD1-CB 3.44Å; N16-W102 PolarHBondContact OD1-NE1 3.18Å
17	A	94.2	Very high	96.4	Very high	38 Å²	38	13.9 Å²	13.9	31%	0.314	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	147.2	171.6	0	0	0	0	0	110.5	T19 G66 Q67	A17-T19 VanDerWaalsContact C-N 3.26Å; A17-T19 PolarHBondContact O-N 3.36Å; A17-G66 PolarHBondContact N-O 3.09Å; A17-Q67 HydrophobicContact CB-CG 3.75Å
18	G	94.2	Very high	96.5	Very high	47 Å²	47	13 Å²	13	49%	0.485	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	-4.8	177	0	0	0	0	0	116.1	G20 K122	G18-G20 PolarHBondContact O-N 3.2Å; G18-K122 VanDerWaalsContact O-CE 3.3Å; G18-K122 WeakPolarHBondContact O-CE 3.42Å; G18-K122 PolarHBondContact O-NZ 2.88Å
19	T	96.9	Very high	96.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	-73.9	-6.6	177.6	61	0	0	0	0	114.3	N16 A17 D89 T95 N121	N16-T19 HydrophobicContact CB-CG2 4.01Å; N16-T19 WeakPolarHBondContact O-CG2 3.48Å; N16-T19 PolarHBondContact O-OG1 3.48Å; A17-T19 VanDerWaalsContact C-N 3.26Å; A17-T19 PolarHBondContact O-N 3.36Å; T19-D89 HydrophobicContact CG2-CB 4.22Å; T19-T95 HydrophobicContact CG2-CG2 3.66Å; T19-N121 PolarHBondContact O-ND2 2.77Å
20	G	96.6	Very high	96.4	Very high	15 Å²	15	20.4 Å²	20.4	16%	0.155	12%	0.123	C	C	.	.			trans	89.3	22.5	176.1	0	0	0	0	0	115.8	G18 S22 C23 L24	G18-G20 PolarHBondContact O-N 3.2Å; G20-S22 PolarHBondContact O-N 3.18Å; G20-C23 PolarHBondContact O-N 3.28Å; G20-L24 WeakPolarHBondContact O-CG 3.4Å; G20-L24 PolarHBondContact O-N 3.12Å
21	K	96.8	Very high	96.2	Very high	9 Å²	9	24 Å²	24	4%	0.039	14%	0.139	C	C	.	.	H	α-helix	trans	-53	-51	176.8	-60.6	-173.2	-59.5	-67.8	0	113.6	V13 I14 G15 N16 C23 L24 L25 D63 T64 V87	V13-K21 HydrophobicContact CB-CB 4.41Å; V13-K21 HydrophobicContact CG1-CB 3.6Å; V13-K21 HydrophobicContact CG1-CD 4.13Å; V13-K21 HydrophobicContact CG1-CG 3.8Å; I14-K21 VanDerWaalsContact C-CD 3.42Å; G15-K21 WeakPolarHBondContact O-CE 3.41Å; G15-K21 PolarHBondContact O-NZ 2.83Å; N16-K21 PolarHBondContact O-NZ 2.82Å; K21-C23 VanDerWaalsContact C-N 3.32Å; K21-C23 PolarHBondContact O-N 3.13Å; K21-L24 WeakPolarHBondContact O-CB 3.33Å; K21-L24 PolarHBondContact O-N 3.15Å; K21-L25 PolarHBondContact O-N 3.17Å; K21-D63 WeakPolarHBondContact CB-OD1 3.22Å; K21-T64 WeakPolarHBondContact CE-O 3.48Å; K21-V87 HydrophobicContact CG-CB 4.02Å; K21-V87 HydrophobicContact CG-CG1 4.47Å; K21-V87 HydrophobicContact CG-CG2 4.1Å
22	S	95.8	Very high	95.9	Very high	17 Å²	17	32.7 Å²	32.7	12%	0.119	17%	0.171	C	C	.	.	H	α-helix	trans	-63.7	-39	178	-41.8	0	0	0	0	111.7	G20 L25 H26 T40 D63	G20-S22 PolarHBondContact O-N 3.18Å; S22-L25 PolarHBondContact O-N 2.98Å; S22-H26 VanDerWaalsContact O-CB 3.3Å; S22-H26 WeakPolarHBondContact O-CB 3.47Å; S22-H26 PolarHBondContact O-N 3.01Å; S22-T40 PolarHBondContact OG-OG1 3.19Å; S22-D63 WeakPolarHBondContact CA-OD2 3.45Å; S22-D63 VanDerWaalsContact CB-OD2 3.25Å; S22-D63 WeakPolarHBondContact CB-OD2 3.25Å; S22-D63 PolarHBondContact OG-OD2 2.8Å
23	C	96.6	Very high	95.4	Very high	7 Å²	7	36.1 Å²	36.1	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-65.7	-39	175.9	-54.8	0	0	0	0	111.7	G20 K21 H26 Q27 F33 A152	G20-C23 PolarHBondContact O-N 3.28Å; K21-C23 VanDerWaalsContact C-N 3.32Å; K21-C23 PolarHBondContact O-N 3.13Å; C23-H26 PolarHBondContact O-N 3.36Å; C23-Q27 WeakPolarHBondContact O-CB 3.46Å; C23-Q27 PolarHBondContact O-N 2.96Å; C23-F33 HydrophobicContact CB-CD2 4.31Å; C23-F33 HydrophobicContact CB-CE2 3.91Å; C23-A152 HydrophobicContact CB-CB 3.67Å
24	L	97.8	Very high	94.8	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-45.4	174.1	-74.9	171.9	0	0	0	111.5	G20 K21 Q27 F28 V87 N121 A152 V158	G20-L24 WeakPolarHBondContact O-CG 3.4Å; G20-L24 PolarHBondContact O-N 3.12Å; K21-L24 WeakPolarHBondContact O-CB 3.33Å; K21-L24 PolarHBondContact O-N 3.15Å; L24-Q27 PolarHBondContact O-N 3.26Å; L24-F28 VanDerWaalsContact O-CB 3.29Å; L24-F28 WeakPolarHBondContact O-CB 3.48Å; L24-F28 PolarHBondContact O-N 2.9Å; L24-V87 HydrophobicContact CD1-CG1 3.77Å; L24-V87 HydrophobicContact CD1-CG2 3.95Å; L24-N121 HydrophobicContact CD1-CB 4.3Å; L24-A152 HydrophobicContact CD2-CB 3.93Å; L24-A152 HydrophobicContact CG-CB 4.16Å; L24-V158 HydrophobicContact CD2-CB 4.45Å; L24-V158 HydrophobicContact CD2-CG1 4.2Å; L24-V158 HydrophobicContact CD2-CG2 3.66Å
25	L	96.8	Very high	93.6	Very high	10 Å²	10	46.1 Å²	46.1	5%	0.052	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-46.9	176.2	177.6	59.3	0	0	0	111.2	K21 S22 F28 I29 I61 D63	K21-L25 PolarHBondContact O-N 3.17Å; S22-L25 PolarHBondContact O-N 2.98Å; L25-F28 PolarHBondContact O-N 2.83Å; L25-I29 HydrophobicContact CD1-CD1 3.54Å; L25-I29 HydrophobicContact CD1-CG1 4.11Å; L25-I29 HydrophobicContact CG-CD1 3.98Å; L25-I29 WeakPolarHBondContact O-CG1 3.41Å; L25-I29 PolarHBondContact O-N 2.78Å; L25-I61 HydrophobicContact CD1-CB 3.82Å; L25-I61 HydrophobicContact CD1-CD1 3.74Å; L25-I61 HydrophobicContact CD1-CG1 4.4Å; L25-I61 HydrophobicContact CD1-CG2 3.7Å; L25-D63 HydrophobicContact CD2-CB 3.67Å
26	H	95.6	Very high	92.5	Very high	39 Å²	39	54.6 Å²	54.6	18%	0.181	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-46.2	179.4	-165.2	-84.4	0	0	0	111.8	S22 C23 F28 I29 E30 R32 K34	S22-H26 VanDerWaalsContact O-CB 3.3Å; S22-H26 WeakPolarHBondContact O-CB 3.47Å; S22-H26 PolarHBondContact O-N 3.01Å; C23-H26 PolarHBondContact O-N 3.36Å; H26-F28 VanDerWaalsContact C-N 3.29Å; H26-F28 PolarHBondContact O-N 2.88Å; H26-I29 PolarHBondContact O-N 2.82Å; H26-E30 IonicContact CD2-OE1 3.16Å; H26-E30 IonicContact CE1-OE2 3.9Å; H26-E30 PolarHBondContact CE1-OE2 3.24Å; H26-E30 IonicContact ND1-OE2 2.93Å; H26-E30 VanDerWaalsContact NE2-CD 3.26Å; H26-E30 IonicContact NE2-OE1 3.88Å; H26-E30 PolarHBondContact NE2-OE1 3.26Å; H26-E30 IonicContact NE2-OE2 3.34Å; H26-E30 PolarHBondContact NE2-OE2 3.43Å; H26-E30 VanDerWaalsContact NE2-OE2 3.1Å; H26-E30 WeakPolarHBondContact O-CB 3.19Å; H26-E30 PolarHBondContact O-N 3.49Å; H26-R32 PolarHBondContact ND1-O 2.94Å; H26-K34 HydrophobicContact CB-CB 4.31Å
27	Q	97.4	Very high	91.4	Very high	16 Å²	16	55.7 Å²	55.7	8%	0.075	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-37.4	176.6	-177.8	68.5	-30.7	0	0	111.4	C23 L24 K31 R32 A152 G155 V158	C23-Q27 WeakPolarHBondContact O-CB 3.46Å; C23-Q27 PolarHBondContact O-N 2.96Å; L24-Q27 PolarHBondContact O-N 3.26Å; Q27-K31 WeakPolarHBondContact O-CA 3.48Å; Q27-K31 PolarHBondContact O-N 3.26Å; Q27-R32 PolarHBondContact OE1-O 2.83Å; Q27-A152 VanDerWaalsContact CD-O 3.26Å; Q27-A152 VanDerWaalsContact CG-O 3.29Å; Q27-A152 WeakPolarHBondContact CG-O 3.34Å; Q27-A152 PolarHBondContact NE2-O 3.12Å; Q27-G155 VanDerWaalsContact NE2-N 3.13Å; Q27-V158 HydrophobicContact CB-CG1 4.23Å; Q27-V158 HydrophobicContact CG-CB 4.33Å; Q27-V158 HydrophobicContact CG-CG1 4.13Å; Q27-V158 HydrophobicContact CG-CG2 4.06Å
28	F	97.6	Very high	90.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-44.9	175	176.8	-118.2	0	0	0	112.3	L24 L25 H26 K48 I50 L59 I61 V158 E159 F162	L24-F28 VanDerWaalsContact O-CB 3.29Å; L24-F28 WeakPolarHBondContact O-CB 3.48Å; L24-F28 PolarHBondContact O-N 2.9Å; L25-F28 PolarHBondContact O-N 2.83Å; H26-F28 VanDerWaalsContact C-N 3.29Å; H26-F28 PolarHBondContact O-N 2.88Å; F28-K48 HydrophobicContact CD1-CB 4.47Å; F28-K48 HydrophobicContact CD1-CD 4.16Å; F28-K48 HydrophobicContact CE1-CB 3.78Å; F28-K48 HydrophobicContact CE1-CD 3.8Å; F28-K48 HydrophobicContact CE1-CG 4.12Å; F28-K48 HydrophobicContact CE2-CD 4.25Å; F28-K48 HydrophobicContact CZ-CB 4.31Å; F28-K48 HydrophobicContact CZ-CD 3.85Å; F28-K48 HydrophobicContact CZ-CG 4.2Å; F28-K48 WeakPolarHBondContact O-CD 3.37Å; F28-K48 PolarHBondContact O-NZ 3.29Å; F28-I50 HydrophobicContact CE2-CG2 4.28Å; F28-I50 HydrophobicContact CZ-CG2 3.73Å; F28-L59 HydrophobicContact CE1-CD1 4.16Å; F28-L59 HydrophobicContact CZ-CD1 4.05Å; F28-I61 HydrophobicContact CD1-CD1 3.76Å; F28-I61 HydrophobicContact CE1-CD1 3.66Å; F28-V158 HydrophobicContact CB-CG1 3.95Å; F28-E159 HydrophobicContact CE2-CG 4.37Å; F28-F162 HydrophobicContact CB-CD2 3.8Å; F28-F162 HydrophobicContact CB-CE2 3.54Å; F28-F162 HydrophobicContact CB-CZ 4.26Å; F28-F162 HydrophobicContact CD1-CD1 4.21Å; F28-F162 AromaticContact CD1-CD2 3.85Å; F28-F162 HydrophobicContact CD1-CD2 3.85Å; F28-F162 HydrophobicContact CD1-CE1 4.36Å; F28-F162 HydrophobicContact CD1-CE2 4.04Å; F28-F162 AromaticContact CD1-CG 3.96Å; F28-F162 HydrophobicContact CD1-CG 3.96Å; F28-F162 HydrophobicContact CD1-CZ 4.28Å; F28-F162 HydrophobicContact CD2-CB 4.13Å; F28-F162 AromaticContact CD2-CD2 3.51Å; F28-F162 HydrophobicContact CD2-CD2 3.51Å; F28-F162 HydrophobicContact CD2-CE2 4.18Å; F28-F162 AromaticContact CD2-CG 3.98Å; F28-F162 HydrophobicContact CD2-CG 3.98Å; F28-F162 HydrophobicContact CE1-CB 4.18Å; F28-F162 HydrophobicContact CE1-CD1 4.19Å; F28-F162 HydrophobicContact CE1-CD2 4.29Å; F28-F162 AromaticContact CE1-CG 3.96Å; F28-F162 HydrophobicContact CE1-CG 3.96Å; F28-F162 HydrophobicContact CE2-CB 3.69Å; F28-F162 AromaticContact CE2-CD2 3.99Å; F28-F162 HydrophobicContact CE2-CD2 3.99Å; F28-F162 AromaticContact CE2-CG 4Å; F28-F162 HydrophobicContact CE2-CG 4Å; F28-F162 AromaticContact CG-CD2 3.43Å; F28-F162 HydrophobicContact CG-CD2 3.43Å; F28-F162 VanDerWaalsContact CG-CD2 3.43Å; F28-F162 AromaticContact CG-CE2 3.66Å; F28-F162 HydrophobicContact CG-CE2 3.66Å; F28-F162 AromaticContact CG-CG 3.96Å; F28-F162 HydrophobicContact CG-CG 3.96Å; F28-F162 HydrophobicContact CG-CZ 4.33Å; F28-F162 HydrophobicContact CZ-CB 3.71Å; F28-F162 HydrophobicContact CZ-CD2 4.34Å; F28-F162 AromaticContact CZ-CG 3.98Å; F28-F162 HydrophobicContact CZ-CG 3.98Å
29	I	95.6	Very high	90.2	Very high	55 Å²	55	64.9 Å²	64.9	28%	0.282	32%	0.315	S	S	.	.	H	α-helix	trans	-76.3	-57.9	-176.6	-66.9	174.9	0	0	0	111.1	L25 H26 K48	L25-I29 HydrophobicContact CD1-CD1 3.54Å; L25-I29 HydrophobicContact CD1-CG1 4.11Å; L25-I29 HydrophobicContact CG-CD1 3.98Å; L25-I29 WeakPolarHBondContact O-CG1 3.41Å; L25-I29 PolarHBondContact O-N 2.78Å; H26-I29 PolarHBondContact O-N 2.82Å; I29-K48 HydrophobicContact CG1-CB 4.46Å; I29-K48 PolarHBondContact O-NZ 3.38Å
30	E	93.8	Very high	89.3	Confident	109 Å²	109	65.6 Å²	65.6	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-94.2	-8.5	-168.7	-56.6	-163.5	-178.1	0	0	114.2	H26 R32	H26-E30 IonicContact CD2-OE1 3.16Å; H26-E30 IonicContact CE1-OE2 3.9Å; H26-E30 PolarHBondContact CE1-OE2 3.24Å; H26-E30 IonicContact ND1-OE2 2.93Å; H26-E30 VanDerWaalsContact NE2-CD 3.26Å; H26-E30 IonicContact NE2-OE1 3.88Å; H26-E30 PolarHBondContact NE2-OE1 3.26Å; H26-E30 IonicContact NE2-OE2 3.34Å; H26-E30 PolarHBondContact NE2-OE2 3.43Å; H26-E30 VanDerWaalsContact NE2-OE2 3.1Å; H26-E30 WeakPolarHBondContact O-CB 3.19Å; H26-E30 PolarHBondContact O-N 3.49Å; E30-R32 PolarHBondContact O-N 3.22Å
31	K	93.3	Very high	88.4	Confident	108 Å²	108	71.2 Å²	71.2	47%	0.47	34%	0.344	S	S	.	.	S	Bend	trans	56.1	29.4	-174.7	-57.2	-63.6	-168.3	173.3	0	112.7	Q27 E159	Q27-K31 WeakPolarHBondContact O-CA 3.48Å; Q27-K31 PolarHBondContact O-N 3.26Å; K31-E159 IonicContact NZ-OE1 2.61Å; K31-E159 IonicContact NZ-OE2 2.67Å; K31-E159 PolarHBondContact NZ-OE2 3.07Å
32	R	90.1	Very high	87.5	Confident	183 Å²	183	71.3 Å²	71.3	69%	0.691	35%	0.348	S	S	*	.	S	Bend	trans	-136.1	141.2	175.4	-66.6	-177.3	-178	-178.3	0	111.5	H26 Q27 E30	H26-R32 PolarHBondContact ND1-O 2.94Å; Q27-R32 PolarHBondContact OE1-O 2.83Å; E30-R32 PolarHBondContact O-N 3.22Å
33	F	86.9	Confident	87	Confident	72 Å²	72	72.1 Å²	72.1	32%	0.316	35%	0.352	S	S	.	.			trans	-70.3	140.8	170.4	-176.5	-115.1	0	0	0	110.5	C23 D35 A152 L153	C23-F33 HydrophobicContact CB-CD2 4.31Å; C23-F33 HydrophobicContact CB-CE2 3.91Å; F33-D35 HydrophobicContact CD1-CB 4.39Å; F33-D35 HydrophobicContact CE1-CB 4.32Å; F33-D35 WeakPolarHBondContact CE1-OD1 3.4Å; F33-A152 HydrophobicContact CD2-CB 4.3Å; F33-A152 WeakPolarHBondContact CD2-O 3.39Å; F33-A152 HydrophobicContact CE2-CB 4.29Å; F33-L153 HydrophobicContact CB-CD1 4.24Å; F33-L153 HydrophobicContact CD1-CD1 3.52Å; F33-L153 HydrophobicContact CD2-CB 4.3Å; F33-L153 HydrophobicContact CD2-CD1 4.32Å; F33-L153 HydrophobicContact CE1-CD1 3.86Å; F33-L153 HydrophobicContact CE2-CB 4.42Å; F33-L153 HydrophobicContact CG-CD1 3.77Å; F33-L153 HydrophobicContact CZ-CD1 4.4Å
34	K	84.8	Confident	86.6	Confident	68 Å²	68	76 Å²	76	30%	0.296	37%	0.369	S	S	.	.			trans	-102.9	98.6	176	-174.7	177.5	-177.6	178.1	0	108.2	H26	H26-K34 HydrophobicContact CB-CB 4.31Å
35	D	72.9	Confident	86.4	Confident	141 Å²	141	81.2 Å²	81.2	75%	0.754	39%	0.392	S	S	*	.	S	Bend	trans	-67.7	-42.1	-174.1	-137	-4.1	0	0	0	111.8	F33 S37	F33-D35 HydrophobicContact CD1-CB 4.39Å; F33-D35 HydrophobicContact CE1-CB 4.32Å; F33-D35 WeakPolarHBondContact CE1-OD1 3.4Å; D35-S37 PolarHBondContact O-N 3.45Å
36	E	72.7	Confident	86.3	Confident	178 Å²	178	81 Å²	81	83%	0.832	39%	0.393	S	S	*	.	S	Bend	trans	-97.6	79.4	176	-64.5	-173.6	174.3	0	0	111.2
37	S	72.9	Confident	86.3	Confident	56 Å²	56	81.7 Å²	81.7	39%	0.392	40%	0.402	S	S	.	.			trans	-96.3	104.8	171.5	71.9	0	0	0	0	111.2	D35	D35-S37 PolarHBondContact O-N 3.45Å
38	N	80.8	Confident	86.3	Confident	151 Å²	151	83.1 Å²	83.1	81%	0.807	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-65.6	158.8	165.4	-73.3	-33.4	0	0	0	110.8	T40	N38-T40 PolarHBondContact O-N 3.45Å
39	H	82.8	Confident	86.2	Confident	126 Å²	126	85.2 Å²	85.2	58%	0.583	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-60	127.4	172.8	-67.2	-50	0	0	0	111.3	I41	H39-I41 PolarHBondContact O-N 3.3Å
40	T	78.3	Confident	86.2	Confident	15 Å²	15	83.2 Å²	83.2	9%	0.092	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-61.2	124.7	174	-37.8	0	0	0	0	110.4	S22 N38 E44 A65	S22-T40 PolarHBondContact OG-OG1 3.19Å; N38-T40 PolarHBondContact O-N 3.45Å; T40-E44 HydrophobicContact CG2-CB 4.48Å; T40-E44 HydrophobicContact CG2-CG 4Å; T40-A65 VanDerWaalsContact O-CB 3.23Å; T40-A65 WeakPolarHBondContact O-CB 3.39Å
41	I	78.1	Confident	86.2	Confident	134 Å²	134	82.3 Å²	82.3	69%	0.687	41%	0.414	S	S	*	.			trans	-100.5	115.6	172.7	-57.5	176.9	0	0	0	107.5	H39 V43 F70	H39-I41 PolarHBondContact O-N 3.3Å; I41-V43 PolarHBondContact O-N 3.01Å; I41-F70 HydrophobicContact CG2-CE1 4.22Å; I41-F70 HydrophobicContact CG2-CZ 4.17Å
42	G	77.8	Confident	86.3	Confident	11 Å²	11	77.2 Å²	77.2	11%	0.113	39%	0.392	C	S	.	.	S	Bend	trans	76	-111.5	-176.8	0	0	0	0	0	112.4	A65	G42-A65 VanDerWaalsContact O-CB 3.24Å; G42-A65 WeakPolarHBondContact O-CB 3.39Å; G42-A65 PolarHBondContact O-N 3.33Å
43	V	84.2	Confident	86	Confident	34 Å²	34	72.3 Å²	72.3	21%	0.206	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	135.7	-174	178.5	0	0	0	0	110.7	I41 W62 D63 T64 T74 Y77	I41-V43 PolarHBondContact O-N 3.01Å; V43-W62 HydrophobicContact CG1-CB 3.84Å; V43-W62 HydrophobicContact CG1-CG 4.2Å; V43-D63 CarbonylContact C-O 3.49Å; V43-D63 VanDerWaalsContact CA-O 3.25Å; V43-D63 WeakPolarHBondContact CA-O 3.49Å; V43-D63 WeakPolarHBondContact CG1-O 3.26Å; V43-T64 HydrophobicContact CG2-CG2 4.36Å; V43-T74 HydrophobicContact CG2-CG2 4.17Å; V43-Y77 HydrophobicContact CB-CD2 4.35Å; V43-Y77 HydrophobicContact CB-CE1 4.35Å; V43-Y77 HydrophobicContact CB-CE2 4.06Å; V43-Y77 HydrophobicContact CG1-CD1 4.16Å; V43-Y77 HydrophobicContact CG1-CE1 4.15Å; V43-Y77 HydrophobicContact CG1-CG 4.36Å; V43-Y77 HydrophobicContact CG2-CD1 4.48Å; V43-Y77 HydrophobicContact CG2-CD2 3.51Å; V43-Y77 HydrophobicContact CG2-CE2 3.53Å; V43-Y77 HydrophobicContact CG2-CG 3.99Å
44	E	89.4	Confident	86	Confident	88 Å²	88	76.4 Å²	76.4	41%	0.411	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	149.2	169.4	-75.5	-177.7	-166.9	0	0	110.5	T40 W62 D63	T40-E44 HydrophobicContact CG2-CB 4.48Å; T40-E44 HydrophobicContact CG2-CG 4Å; E44-W62 CarbonylContact O-C 3.39Å; E44-W62 WeakPolarHBondContact O-CA 3.35Å; E44-D63 HydrophobicContact CB-CB 4.27Å; E44-D63 PolarHBondContact N-O 3.43Å; E44-D63 PolarHBondContact O-N 3.36Å
45	F	93.1	Very high	86.3	Confident	111 Å²	111	76 Å²	76	49%	0.487	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.5	-178.5	175.1	-96.5	0	0	0	111	Q60 I61 W62	F45-Q60 HydrophobicContact CE2-CB 3.83Å; F45-Q60 HydrophobicContact CE2-CG 4.05Å; F45-Q60 HydrophobicContact CZ-CB 4.21Å; F45-Q60 HydrophobicContact CZ-CG 3.96Å; F45-I61 WeakPolarHBondContact CA-O 3.43Å; F45-W62 HydrophobicContact CD2-CD2 4.23Å; F45-W62 AromaticContact CD2-CE2 3.95Å; F45-W62 HydrophobicContact CD2-CZ2 4.23Å; F45-W62 HydrophobicContact CE2-CH2 4.18Å; F45-W62 HydrophobicContact CE2-CZ2 4.05Å; F45-W62 HydrophobicContact CE2-CZ3 4.44Å
46	G	94.8	Very high	87.4	Confident	7 Å²	7	71.5 Å²	71.5	7%	0.072	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	155.5	170.2	0	0	0	0	0	111.4	I61	G46-I61 PolarHBondContact N-O 2.92Å; G46-I61 PolarHBondContact O-N 2.8Å
47	S	96.1	Very high	88.5	Confident	53 Å²	53	63 Å²	63	37%	0.371	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.3	171.7	73.7	0	0	0	0	111.9	L59	S47-L59 WeakPolarHBondContact CA-O 3.23Å; S47-L59 WeakPolarHBondContact CB-O 3.25Å
48	K	95.9	Very high	89.7	Confident	45 Å²	45	63 Å²	63	20%	0.196	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	137.6	177	-178	158.1	179.9	159.4	0	110.4	F28 I29 I50 L59	F28-K48 HydrophobicContact CD1-CB 4.47Å; F28-K48 HydrophobicContact CD1-CD 4.16Å; F28-K48 HydrophobicContact CE1-CB 3.78Å; F28-K48 HydrophobicContact CE1-CD 3.8Å; F28-K48 HydrophobicContact CE1-CG 4.12Å; F28-K48 HydrophobicContact CE2-CD 4.25Å; F28-K48 HydrophobicContact CZ-CB 4.31Å; F28-K48 HydrophobicContact CZ-CD 3.85Å; F28-K48 HydrophobicContact CZ-CG 4.2Å; F28-K48 WeakPolarHBondContact O-CD 3.37Å; F28-K48 PolarHBondContact O-NZ 3.29Å; I29-K48 HydrophobicContact CG1-CB 4.46Å; I29-K48 PolarHBondContact O-NZ 3.38Å; K48-I50 HydrophobicContact CG-CG2 4.14Å; K48-L59 PolarHBondContact N-O 3.04Å; K48-L59 PolarHBondContact O-N 2.89Å
49	I	96.1	Very high	90.5	Very high	45 Å²	45	55.8 Å²	55.8	23%	0.231	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.5	171.4	-67.1	175.3	0	0	0	108.2	E3 Y5 T56 V57 K58	E3-I49 HydrophobicContact CB-CD1 3.52Å; E3-I49 WeakPolarHBondContact OE2-CD1 3.39Å; Y5-I49 HydrophobicContact CD1-CD1 4.14Å; I49-T56 HydrophobicContact CG2-CG2 3.26Å; I49-V57 WeakPolarHBondContact CA-O 3.42Å; I49-K58 HydrophobicContact CD1-CD 4.41Å; I49-K58 HydrophobicContact CD1-CG 4.48Å; I49-K58 HydrophobicContact CG1-CB 3.87Å; I49-K58 HydrophobicContact CG1-CD 4.31Å; I49-K58 HydrophobicContact CG1-CG 3.87Å
50	I	96.1	Very high	91.2	Very high	12 Å²	12	52 Å²	52	6%	0.062	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	155.5	177.9	58.3	169.2	0	0	0	110.3	F28 K48 V52 V57 L59 V163 A166	F28-I50 HydrophobicContact CE2-CG2 4.28Å; F28-I50 HydrophobicContact CZ-CG2 3.73Å; K48-I50 HydrophobicContact CG-CG2 4.14Å; I50-V52 HydrophobicContact CD1-CG2 3.56Å; I50-V52 HydrophobicContact CG1-CG2 3.89Å; I50-V57 HydrophobicContact CG1-CB 4.26Å; I50-V57 PolarHBondContact N-O 3.01Å; I50-V57 PolarHBondContact O-N 3.43Å; I50-L59 HydrophobicContact CD1-CD1 3.62Å; I50-L59 HydrophobicContact CD1-CD2 4.45Å; I50-L59 HydrophobicContact CD1-CG 4.02Å; I50-L59 HydrophobicContact CG1-CD1 4.23Å; I50-L59 HydrophobicContact CG1-CG 4.18Å; I50-V163 HydrophobicContact CD1-CG2 4.14Å; I50-A166 HydrophobicContact CD1-CB 3.96Å
51	S	94.4	Very high	92.1	Very high	90 Å²	90	51.3 Å²	51.3	63%	0.629	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	126.8	170.8	-169.9	0	0	0	0	109.9	K55	S51-K55 CarbonylContact C-O 3.43Å; S51-K55 WeakPolarHBondContact CA-O 3.29Å
52	V	93.6	Very high	92.9	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.012	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	116.6	-179.2	-173.8	0	0	0	0	108.5	I50 N54 K55 V163 A166 R167 L170	I50-V52 HydrophobicContact CD1-CG2 3.56Å; I50-V52 HydrophobicContact CG1-CG2 3.89Å; V52-N54 VanDerWaalsContact C-N 3.31Å; V52-N54 PolarHBondContact O-N 2.97Å; V52-K55 PolarHBondContact N-O 3.08Å; V52-K55 WeakPolarHBondContact O-CB 3.17Å; V52-K55 PolarHBondContact O-N 3.05Å; V52-V163 HydrophobicContact CG2-CG1 4.41Å; V52-A166 HydrophobicContact CG2-CB 4.13Å; V52-R167 HydrophobicContact CG1-CB 3.72Å; V52-R167 HydrophobicContact CG1-CG 4.19Å; V52-L170 HydrophobicContact CB-CD1 3.85Å; V52-L170 HydrophobicContact CG1-CD1 3.74Å
53	V	85.3	Confident	93.7	Very high	80 Å²	80	46.1 Å²	46.1	49%	0.485	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	50.1	176.6	-165.7	0	0	0	0	111.7	K55 R167	V53-K55 PolarHBondContact O-N 2.61Å; V53-K55 VanDerWaalsContact O-N 3.12Å; V53-R167 HydrophobicContact CG2-CG 4.09Å
54	N	86.6	Confident	94	Very high	157 Å²	157	44.5 Å²	44.5	84%	0.84	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.7	12.2	-177.8	-53.1	-32.3	0	0	0	115.9	V52	V52-N54 VanDerWaalsContact C-N 3.31Å; V52-N54 PolarHBondContact O-N 2.97Å
55	K	91.9	Very high	93.9	Very high	61 Å²	61	40.3 Å²	40.3	27%	0.265	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143.7	169.7	-60.9	-63	-173.1	177.7	0	110.3	D6 F7 S51 V52 V53 V57 L170	D6-K55 HydrophobicContact CB-CD 4.33Å; D6-K55 WeakPolarHBondContact OD2-CA 3.41Å; F7-K55 HydrophobicContact CE2-CD 4.25Å; F7-K55 HydrophobicContact CE2-CG 4.3Å; S51-K55 CarbonylContact C-O 3.43Å; S51-K55 WeakPolarHBondContact CA-O 3.29Å; V52-K55 PolarHBondContact N-O 3.08Å; V52-K55 WeakPolarHBondContact O-CB 3.17Å; V52-K55 PolarHBondContact O-N 3.05Å; V53-K55 PolarHBondContact O-N 2.61Å; V53-K55 VanDerWaalsContact O-N 3.12Å; K55-V57 HydrophobicContact CB-CG2 4.48Å; K55-L170 HydrophobicContact CB-CD1 4.36Å
56	T	94.9	Very high	93.2	Very high	46 Å²	46	35.5 Å²	35.5	28%	0.282	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	118	172.4	-59.4	0	0	0	0	108.7	S4 D6 F7 I49	S4-T56 WeakPolarHBondContact O-CG2 3.43Å; D6-T56 PolarHBondContact N-O 2.7Å; D6-T56 PolarHBondContact OD2-N 3.3Å; F7-T56 PolarHBondContact N-O 3.38Å; I49-T56 HydrophobicContact CG2-CG2 3.26Å
57	V	96.4	Very high	92.5	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.2	-175.7	-176.1	0	0	0	0	109.6	F7 F9 I49 I50 K55 L59 L170	F7-V57 HydrophobicContact CB-CG1 4.41Å; F7-V57 HydrophobicContact CB-CG2 4.42Å; F7-V57 CarbonylContact O-C 3.57Å; F7-V57 WeakPolarHBondContact O-CA 3.26Å; F9-V57 HydrophobicContact CD2-CG1 3.35Å; F9-V57 HydrophobicContact CE2-CG1 3.52Å; F9-V57 HydrophobicContact CE2-CG2 4.23Å; F9-V57 HydrophobicContact CG-CG1 3.88Å; F9-V57 HydrophobicContact CZ-CG1 4.19Å; I49-V57 WeakPolarHBondContact CA-O 3.42Å; I50-V57 HydrophobicContact CG1-CB 4.26Å; I50-V57 PolarHBondContact N-O 3.01Å; I50-V57 PolarHBondContact O-N 3.43Å; K55-V57 HydrophobicContact CB-CG2 4.48Å; V57-L59 HydrophobicContact CG1-CD2 3.78Å; V57-L170 HydrophobicContact CG2-CD1 4.01Å
58	K	97	Very high	91.4	Very high	54 Å²	54	42 Å²	42	24%	0.235	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	111.5	168.7	-174	169.9	-178.1	175.7	0	109.7	Y5 F7 L8 F9 I49	Y5-K58 HydrophobicContact CD1-CB 3.83Å; Y5-K58 HydrophobicContact CD1-CD 3.77Å; Y5-K58 HydrophobicContact CD1-CG 4.43Å; Y5-K58 HydrophobicContact CD2-CB 3.92Å; Y5-K58 HydrophobicContact CE1-CB 4.18Å; Y5-K58 HydrophobicContact CE1-CD 3.42Å; Y5-K58 VanDerWaalsContact CE1-CD 3.42Å; Y5-K58 HydrophobicContact CE1-CG 4.45Å; Y5-K58 HydrophobicContact CE2-CB 4.27Å; Y5-K58 HydrophobicContact CG-CB 3.68Å; Y5-K58 HydrophobicContact CG-CD 4.44Å; F7-K58 PolarHBondContact O-N 2.8Å; L8-K58 CarbonylContact C-O 3.58Å; L8-K58 VanDerWaalsContact CA-O 3.26Å; L8-K58 WeakPolarHBondContact CA-O 3.17Å; L8-K58 HydrophobicContact CB-CB 4.49Å; F9-K58 PolarHBondContact N-O 2.77Å; I49-K58 HydrophobicContact CD1-CD 4.41Å; I49-K58 HydrophobicContact CD1-CG 4.48Å; I49-K58 HydrophobicContact CG1-CB 3.87Å; I49-K58 HydrophobicContact CG1-CD 4.31Å; I49-K58 HydrophobicContact CG1-CG 3.87Å
59	L	97.8	Very high	90.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.3	170.4	-57.4	-173.9	0	0	0	109.3	F9 F11 F28 S47 K48 I50 V57 I61 F162 A166	F9-L59 HydrophobicContact CB-CD2 3.99Å; F9-L59 HydrophobicContact CD2-CD2 4.05Å; F9-L59 HydrophobicContact CG-CD2 4.48Å; F11-L59 HydrophobicContact CD1-CD2 4.3Å; F11-L59 HydrophobicContact CD2-CD1 4.34Å; F11-L59 HydrophobicContact CE1-CD2 3.88Å; F11-L59 HydrophobicContact CE2-CD1 4.02Å; F11-L59 HydrophobicContact CE2-CD2 4.11Å; F11-L59 HydrophobicContact CZ-CD1 4.47Å; F11-L59 HydrophobicContact CZ-CD2 3.78Å; F28-L59 HydrophobicContact CE1-CD1 4.16Å; F28-L59 HydrophobicContact CZ-CD1 4.05Å; S47-L59 WeakPolarHBondContact CA-O 3.23Å; S47-L59 WeakPolarHBondContact CB-O 3.25Å; K48-L59 PolarHBondContact N-O 3.04Å; K48-L59 PolarHBondContact O-N 2.89Å; I50-L59 HydrophobicContact CD1-CD1 3.62Å; I50-L59 HydrophobicContact CD1-CD2 4.45Å; I50-L59 HydrophobicContact CD1-CG 4.02Å; I50-L59 HydrophobicContact CG1-CD1 4.23Å; I50-L59 HydrophobicContact CG1-CG 4.18Å; V57-L59 HydrophobicContact CG1-CD2 3.78Å; L59-I61 HydrophobicContact CB-CD1 4.14Å; L59-I61 HydrophobicContact CB-CG1 4Å; L59-F162 HydrophobicContact CD1-CB 4.17Å; L59-F162 HydrophobicContact CD1-CD1 4.45Å; L59-A166 HydrophobicContact CD2-CB 4.22Å
60	Q	97.2	Very high	89.6	Confident	48 Å²	48	49 Å²	49	22%	0.224	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	122.4	162.9	-73.2	-167.5	-37.8	0	0	107	L8 F9 F11 F45 W62	L8-Q60 HydrophobicContact CD1-CG 4.23Å; L8-Q60 HydrophobicContact CD2-CG 4.34Å; L8-Q60 HydrophobicContact CG-CG 4.21Å; F9-Q60 PolarHBondContact O-N 2.83Å; F11-Q60 PolarHBondContact N-O 2.95Å; F45-Q60 HydrophobicContact CE2-CB 3.83Å; F45-Q60 HydrophobicContact CE2-CG 4.05Å; F45-Q60 HydrophobicContact CZ-CB 4.21Å; F45-Q60 HydrophobicContact CZ-CG 3.96Å; Q60-W62 HydrophobicContact CB-CE3 4.24Å; Q60-W62 HydrophobicContact CB-CH2 3.49Å; Q60-W62 VanDerWaalsContact CB-CH2 3.49Å; Q60-W62 HydrophobicContact CB-CZ3 3.25Å; Q60-W62 HydrophobicContact CG-CH2 4.37Å; Q60-W62 WeakPolarHBondContact O-CZ3 3.48Å
61	I	97.7	Very high	88.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.5	-168.5	-51.9	163	0	0	0	108.5	F11 V13 L25 F28 F45 G46 L59 F162	F11-I61 HydrophobicContact CB-CB 4.45Å; F11-I61 HydrophobicContact CB-CG1 4.07Å; F11-I61 HydrophobicContact CB-CG2 4.33Å; F11-I61 WeakPolarHBondContact O-CA 3.45Å; V13-I61 HydrophobicContact CG2-CG2 3.63Å; L25-I61 HydrophobicContact CD1-CB 3.82Å; L25-I61 HydrophobicContact CD1-CD1 3.74Å; L25-I61 HydrophobicContact CD1-CG1 4.4Å; L25-I61 HydrophobicContact CD1-CG2 3.7Å; F28-I61 HydrophobicContact CD1-CD1 3.76Å; F28-I61 HydrophobicContact CE1-CD1 3.66Å; F45-I61 WeakPolarHBondContact CA-O 3.43Å; G46-I61 PolarHBondContact N-O 2.92Å; G46-I61 PolarHBondContact O-N 2.8Å; L59-I61 HydrophobicContact CB-CD1 4.14Å; L59-I61 HydrophobicContact CB-CG1 4Å; I61-F162 HydrophobicContact CD1-CD1 3.97Å; I61-F162 HydrophobicContact CD1-CE1 3.76Å; I61-F162 HydrophobicContact CG1-CE1 4.39Å; I61-F162 HydrophobicContact CG2-CE1 4.17Å
62	W	95.8	Very high	87.7	Confident	36 Å²	36	50.5 Å²	50.5	14%	0.136	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	109.9	175.6	-70.3	-100.3	0	0	0	108.6	K10 F11 L12 V13 V43 E44 F45 Q60 Y77	K10-W62 HydrophobicContact CB-CE3 4.47Å; K10-W62 HydrophobicContact CB-CH2 4.01Å; K10-W62 HydrophobicContact CB-CZ3 3.6Å; K10-W62 HydrophobicContact CD-CE3 4.09Å; K10-W62 HydrophobicContact CD-CH2 3.54Å; K10-W62 HydrophobicContact CD-CZ2 4.07Å; K10-W62 HydrophobicContact CD-CZ3 3.59Å; K10-W62 HydrophobicContact CG-CE3 3.68Å; K10-W62 HydrophobicContact CG-CH2 3.69Å; K10-W62 HydrophobicContact CG-CZ3 3.2Å; F11-W62 VanDerWaalsContact O-CE3 3.31Å; F11-W62 PolarHBondContact O-N 2.66Å; L12-W62 WeakPolarHBondContact CA-O 3.25Å; L12-W62 HydrophobicContact CD2-CB 3.92Å; V13-W62 PolarHBondContact N-O 3.27Å; V43-W62 HydrophobicContact CG1-CB 3.84Å; V43-W62 HydrophobicContact CG1-CG 4.2Å; E44-W62 CarbonylContact O-C 3.39Å; E44-W62 WeakPolarHBondContact O-CA 3.35Å; F45-W62 HydrophobicContact CD2-CD2 4.23Å; F45-W62 AromaticContact CD2-CE2 3.95Å; F45-W62 HydrophobicContact CD2-CZ2 4.23Å; F45-W62 HydrophobicContact CE2-CH2 4.18Å; F45-W62 HydrophobicContact CE2-CZ2 4.05Å; F45-W62 HydrophobicContact CE2-CZ3 4.44Å; Q60-W62 HydrophobicContact CB-CE3 4.24Å; Q60-W62 HydrophobicContact CB-CH2 3.49Å; Q60-W62 VanDerWaalsContact CB-CH2 3.49Å; Q60-W62 HydrophobicContact CB-CZ3 3.25Å; Q60-W62 HydrophobicContact CG-CH2 4.37Å; Q60-W62 WeakPolarHBondContact O-CZ3 3.48Å; W62-Y77 AromaticContact CD1-CD1 3.31Å; W62-Y77 AromaticContact CD1-CE1 3.71Å; W62-Y77 HydrophobicContact CG-CD1 4.16Å; W62-Y77 AromaticContact NE1-CD1 3.62Å; W62-Y77 AromaticContact NE1-CE1 3.87Å
63	D	93.9	Very high	86.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	122.5	169.9	174.5	40.5	0	0	0	109.4	K21 S22 L25 V43 E44	K21-D63 WeakPolarHBondContact CB-OD1 3.22Å; S22-D63 WeakPolarHBondContact CA-OD2 3.45Å; S22-D63 VanDerWaalsContact CB-OD2 3.25Å; S22-D63 WeakPolarHBondContact CB-OD2 3.25Å; S22-D63 PolarHBondContact OG-OD2 2.8Å; L25-D63 HydrophobicContact CD2-CB 3.67Å; V43-D63 CarbonylContact C-O 3.49Å; V43-D63 VanDerWaalsContact CA-O 3.25Å; V43-D63 WeakPolarHBondContact CA-O 3.49Å; V43-D63 WeakPolarHBondContact CG1-O 3.26Å; E44-D63 HydrophobicContact CB-CB 4.27Å; E44-D63 PolarHBondContact N-O 3.43Å; E44-D63 PolarHBondContact O-N 3.36Å
64	T	90.8	Very high	86.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	144.2	-172.2	63.9	0	0	0	0	112.1	V13 I14 K21 V43 G66 T74	V13-T64 PolarHBondContact O-N 2.83Å; V13-T64 PolarHBondContact O-OG1 2.97Å; I14-T64 HydrophobicContact CG2-CG2 4.32Å; K21-T64 WeakPolarHBondContact CE-O 3.48Å; V43-T64 HydrophobicContact CG2-CG2 4.36Å; T64-G66 PolarHBondContact O-N 3.45Å; T64-T74 HydrophobicContact CG2-CG2 4.45Å
65	A	86.6	Confident	86.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-58.3	126.7	169.9	0	0	0	0	0	110.7	T40 G42 F70 T74	T40-A65 VanDerWaalsContact O-CB 3.23Å; T40-A65 WeakPolarHBondContact O-CB 3.39Å; G42-A65 VanDerWaalsContact O-CB 3.24Å; G42-A65 WeakPolarHBondContact O-CB 3.39Å; G42-A65 PolarHBondContact O-N 3.33Å; A65-F70 HydrophobicContact CB-CB 3.75Å; A65-F70 HydrophobicContact CB-CD2 4.01Å; A65-F70 HydrophobicContact CB-CG 4.22Å; A65-T74 HydrophobicContact CB-CG2 4.32Å
66	G	79.6	Confident	86	Confident	10 Å²	10	50 Å²	50	10%	0.103	25%	0.245	C	C	.	.			trans	-88.2	-2.2	179.4	0	0	0	0	0	114.6	G15 A17 T64	G15-G66 WeakPolarHBondContact O-CA 3.5Å; A17-G66 PolarHBondContact N-O 3.09Å; T64-G66 PolarHBondContact O-N 3.45Å
67	Q	79.9	Confident	85.8	Confident	38 Å²	38	51.7 Å²	51.7	18%	0.178	25%	0.247	C	C	.	.	S	Bend	trans	-81.8	132.4	176.4	-61.7	-174.8	25.9	0	0	109.8	A17 R69 F70	A17-Q67 HydrophobicContact CB-CG 3.75Å; Q67-R69 PolarHBondContact O-N 3.18Å; Q67-R69 VanDerWaalsContact O-N 3.13Å; Q67-F70 HydrophobicContact CB-CD2 3.93Å; Q67-F70 HydrophobicContact CB-CE2 4.41Å; Q67-F70 PolarHBondContact O-N 3.2Å
68	E	72.9	Confident	85.6	Confident	159 Å²	159	51.7 Å²	51.7	74%	0.743	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-52.5	-36.1	178.8	67	-165.2	-177.3	0	0	113.8	F70 R71	E68-F70 PolarHBondContact O-N 2.77Å; E68-F70 VanDerWaalsContact O-N 3.12Å; E68-R71 WeakPolarHBondContact O-CB 3.17Å; E68-R71 PolarHBondContact O-N 2.93Å
69	R	75.7	Confident	85.3	Confident	184 Å²	184	58.5 Å²	58.5	69%	0.694	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-62.6	-21.2	179.7	-63.8	-177.4	-64.2	-174.9	-1.2	113	Q67	Q67-R69 PolarHBondContact O-N 3.18Å; Q67-R69 VanDerWaalsContact O-N 3.13Å
70	F	78.3	Confident	84.9	Confident	53 Å²	53	59 Å²	59	23%	0.232	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-102.6	2.1	176	-58.8	-56.3	0	0	0	113.2	I41 A65 Q67 E68 S72 V73 T74	I41-F70 HydrophobicContact CG2-CE1 4.22Å; I41-F70 HydrophobicContact CG2-CZ 4.17Å; A65-F70 HydrophobicContact CB-CB 3.75Å; A65-F70 HydrophobicContact CB-CD2 4.01Å; A65-F70 HydrophobicContact CB-CG 4.22Å; Q67-F70 HydrophobicContact CB-CD2 3.93Å; Q67-F70 HydrophobicContact CB-CE2 4.41Å; Q67-F70 PolarHBondContact O-N 3.2Å; E68-F70 PolarHBondContact O-N 2.77Å; E68-F70 VanDerWaalsContact O-N 3.12Å; F70-S72 VanDerWaalsContact C-N 3.27Å; F70-S72 PolarHBondContact O-N 3Å; F70-V73 WeakPolarHBondContact O-CB 3.29Å; F70-V73 PolarHBondContact O-N 2.97Å; F70-T74 PolarHBondContact O-N 2.81Å
71	R	74.1	Confident	84.8	Confident	44 Å²	44	56.7 Å²	56.7	17%	0.166	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-39	-175.1	-159.2	-179.9	-172.3	110.5	5.7	111.8	E68 V73 T74 R75 T101 D105	E68-R71 WeakPolarHBondContact O-CB 3.17Å; E68-R71 PolarHBondContact O-N 2.93Å; R71-V73 VanDerWaalsContact C-N 3.33Å; R71-V73 PolarHBondContact O-N 3.24Å; R71-T74 PolarHBondContact O-N 3.26Å; R71-T74 PolarHBondContact O-OG1 3.35Å; R71-R75 WeakPolarHBondContact O-CG 3.29Å; R71-R75 PolarHBondContact O-N 3.42Å; R71-T101 PolarHBondContact NH2-O 2.82Å; R71-D105 IonicContact CZ-OD2 3.14Å; R71-D105 IonicContact NE-OD2 2.76Å; R71-D105 PolarHBondContact NE-OD2 3.05Å; R71-D105 IonicContact NH2-OD2 2.88Å; R71-D105 PolarHBondContact NH2-OD2 3.29Å
72	S	75.1	Confident	84.7	Confident	88 Å²	88	56.9 Å²	56.9	62%	0.615	27%	0.267	S	S	*	.	H	α-helix	trans	-61.6	-38	175.5	57.5	0	0	0	0	113.2	F70 T74 R75	F70-S72 VanDerWaalsContact C-N 3.27Å; F70-S72 PolarHBondContact O-N 3Å; S72-T74 VanDerWaalsContact C-N 3.32Å; S72-R75 PolarHBondContact O-N 3Å
73	V	77.1	Confident	84.8	Confident	71 Å²	71	55.2 Å²	55.2	43%	0.43	26%	0.261	S	S	.	.	H	α-helix	trans	-66.2	-37.1	177.6	-177	0	0	0	0	110.8	F70 R71 S76	F70-V73 WeakPolarHBondContact O-CB 3.29Å; F70-V73 PolarHBondContact O-N 2.97Å; R71-V73 VanDerWaalsContact C-N 3.33Å; R71-V73 PolarHBondContact O-N 3.24Å; V73-S76 PolarHBondContact O-OG 3.4Å
74	T	80.3	Confident	85	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-76	-22.5	-177.5	63.7	0	0	0	0	113.9	V43 T64 A65 F70 R71 S72 S76 Y77 Y78	V43-T74 HydrophobicContact CG2-CG2 4.17Å; T64-T74 HydrophobicContact CG2-CG2 4.45Å; A65-T74 HydrophobicContact CB-CG2 4.32Å; F70-T74 PolarHBondContact O-N 2.81Å; R71-T74 PolarHBondContact O-N 3.26Å; R71-T74 PolarHBondContact O-OG1 3.35Å; S72-T74 VanDerWaalsContact C-N 3.32Å; T74-S76 VanDerWaalsContact C-N 3.3Å; T74-S76 PolarHBondContact O-N 2.9Å; T74-Y77 WeakPolarHBondContact O-CB 3.39Å; T74-Y77 PolarHBondContact O-N 3.48Å; T74-Y78 WeakPolarHBondContact O-CD2 3.39Å
75	R	80.9	Confident	85.4	Confident	131 Å²	131	55.2 Å²	55.2	49%	0.494	26%	0.261	S	S	.	.	H	α-helix	trans	-59.4	-36.8	-173.1	-72.7	-172.1	174.5	169.6	-3.8	113.8	R71 S72 Y77 Y78 L109	R71-R75 WeakPolarHBondContact O-CG 3.29Å; R71-R75 PolarHBondContact O-N 3.42Å; S72-R75 PolarHBondContact O-N 3Å; R75-Y77 PolarHBondContact O-N 3.43Å; R75-Y78 WeakPolarHBondContact O-CB 3.23Å; R75-Y78 PolarHBondContact O-N 3.43Å; R75-Y78 VanDerWaalsContact O-N 3.16Å; R75-L109 HydrophobicContact CB-CD1 4.16Å; R75-L109 HydrophobicContact CG-CD1 3.71Å
76	S	85	Confident	85.9	Confident	86 Å²	86	55.2 Å²	55.2	60%	0.601	26%	0.261	S	S	*	.	H	α-helix	trans	-61.9	-24.5	179.7	57.3	0	0	0	0	112.8	V73 T74	V73-S76 PolarHBondContact O-OG 3.4Å; T74-S76 VanDerWaalsContact C-N 3.3Å; T74-S76 PolarHBondContact O-N 2.9Å
77	Y	89.5	Confident	86.8	Confident	82 Å²	82	54.8 Å²	54.8	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-81.4	-19	-179.5	-65.4	-88.1	0	0	0	113.3	K10 V43 W62 T74 R75 R79	K10-Y77 WeakPolarHBondContact CE-O 3.48Å; K10-Y77 PolarHBondContact NZ-O 2.95Å; V43-Y77 HydrophobicContact CB-CD2 4.35Å; V43-Y77 HydrophobicContact CB-CE1 4.35Å; V43-Y77 HydrophobicContact CB-CE2 4.06Å; V43-Y77 HydrophobicContact CG1-CD1 4.16Å; V43-Y77 HydrophobicContact CG1-CE1 4.15Å; V43-Y77 HydrophobicContact CG1-CG 4.36Å; V43-Y77 HydrophobicContact CG2-CD1 4.48Å; V43-Y77 HydrophobicContact CG2-CD2 3.51Å; V43-Y77 HydrophobicContact CG2-CE2 3.53Å; V43-Y77 HydrophobicContact CG2-CG 3.99Å; W62-Y77 AromaticContact CD1-CD1 3.31Å; W62-Y77 AromaticContact CD1-CE1 3.71Å; W62-Y77 HydrophobicContact CG-CD1 4.16Å; W62-Y77 AromaticContact NE1-CD1 3.62Å; W62-Y77 AromaticContact NE1-CE1 3.87Å; T74-Y77 WeakPolarHBondContact O-CB 3.39Å; T74-Y77 PolarHBondContact O-N 3.48Å; R75-Y77 PolarHBondContact O-N 3.43Å; Y77-R79 VanDerWaalsContact C-N 3.32Å; Y77-R79 PolarHBondContact O-N 3.22Å
78	Y	92.3	Very high	87.7	Confident	1 Å²	1	53 Å²	53	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-65.2	-38.8	-179.5	-80.4	-120.7	0	0	0	111.9	L12 I14 T74 R75 G80 A81 W102 D105 A106 L109 A110	L12-Y78 HydrophobicContact CD1-CD1 4.12Å; L12-Y78 HydrophobicContact CD1-CD2 4.2Å; L12-Y78 HydrophobicContact CD1-CE1 4.48Å; L12-Y78 HydrophobicContact CD1-CG 3.96Å; I14-Y78 HydrophobicContact CG2-CE2 4.4Å; I14-Y78 WeakPolarHBondContact CG2-OH 3.41Å; T74-Y78 WeakPolarHBondContact O-CD2 3.39Å; R75-Y78 WeakPolarHBondContact O-CB 3.23Å; R75-Y78 PolarHBondContact O-N 3.43Å; R75-Y78 VanDerWaalsContact O-N 3.16Å; Y78-G80 PolarHBondContact O-N 2.83Å; Y78-A81 WeakPolarHBondContact O-CB 3.12Å; Y78-A81 PolarHBondContact O-N 3.3Å; Y78-W102 WeakPolarHBondContact OH-CZ3 3.48Å; Y78-D105 HydrophobicContact CE1-CB 4.21Å; Y78-A106 HydrophobicContact CE1-CB 4.24Å; Y78-L109 HydrophobicContact CD1-CB 3.81Å; Y78-L109 HydrophobicContact CD1-CD1 4.12Å; Y78-L109 HydrophobicContact CG-CB 3.88Å; Y78-L109 HydrophobicContact CG-CD1 4.16Å; Y78-A110 VanDerWaalsContact O-CA 3.28Å; Y78-A110 WeakPolarHBondContact O-CA 3.49Å; Y78-A110 WeakPolarHBondContact O-CB 3.38Å
79	R	90.8	Very high	89	Confident	196 Å²	196	45.9 Å²	45.9	74%	0.74	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	126.1	-177.5	-173.9	-179.7	177.9	114.1	-1.3	110.8	K10 Y77	K10-R79 PolarHBondContact NZ-O 3.24Å; Y77-R79 VanDerWaalsContact C-N 3.32Å; Y77-R79 PolarHBondContact O-N 3.22Å
80	G	88.4	Confident	90.1	Very high	10 Å²	10	37.1 Å²	37.1	10%	0.103	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	28.6	179.8	0	0	0	0	0	113.9	K10 Y78 G184 G186	K10-G80 VanDerWaalsContact CD-O 3.27Å; K10-G80 WeakPolarHBondContact CD-O 3.41Å; K10-G80 WeakPolarHBondContact CG-O 3.43Å; Y78-G80 PolarHBondContact O-N 2.83Å; G80-G184 WeakPolarHBondContact CA-O 3.46Å; G80-G186 WeakPolarHBondContact O-CA 3.47Å
81	A	95.3	Very high	91	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.008	18%	0.178	C	C	.	.			trans	-82.6	127.3	163.2	0	0	0	0	0	111.1	K10 L12 Y78 A110 I114	K10-A81 HydrophobicContact CG-CB 4.37Å; L12-A81 HydrophobicContact CD1-CB 3.65Å; L12-A81 HydrophobicContact CD2-CB 4.35Å; L12-A81 HydrophobicContact CG-CB 3.67Å; Y78-A81 WeakPolarHBondContact O-CB 3.12Å; Y78-A81 PolarHBondContact O-N 3.3Å; A81-A110 HydrophobicContact CB-CB 4.13Å; A81-I114 HydrophobicContact CB-CD1 3.9Å
82	A	96.3	Very high	92.2	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.033	18%	0.181	C	C	.	.	S	Bend	trans	-83.9	-32.1	175.6	0	0	0	0	0	111.3	K10 V115 I169 I187	K10-A82 PolarHBondContact O-N 3.05Å; A82-V115 PolarHBondContact O-N 3.04Å; A82-I169 HydrophobicContact CB-CD1 3.99Å; A82-I187 HydrophobicContact CB-CD1 4.4Å; A82-I187 HydrophobicContact CB-CG1 3.79Å
83	G	97.6	Very high	93.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	161	178.5	0	0	0	0	0	113.6	K10 F11 L12 V115	K10-G83 PolarHBondContact O-N 3.04Å; F11-G83 CarbonylContact C-O 3.55Å; F11-G83 VanDerWaalsContact CA-O 3.27Å; F11-G83 WeakPolarHBondContact CA-O 2.83Å; L12-G83 PolarHBondContact N-O 3.45Å; G83-V115 CarbonylContact C-O 3.56Å; G83-V115 WeakPolarHBondContact CA-O 3.37Å
84	A	98.1	Very high	94.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	147.5	170.2	0	0	0	0	0	112.4	L12 I114 V115 I116 I117	L12-A84 HydrophobicContact CB-CB 4.05Å; L12-A84 CarbonylContact O-C 3.25Å; L12-A84 VanDerWaalsContact O-CA 3.24Å; L12-A84 WeakPolarHBondContact O-CA 3.4Å; A84-I114 HydrophobicContact CB-CD1 3.92Å; A84-V115 PolarHBondContact N-O 2.89Å; A84-I116 HydrophobicContact CB-CG1 4.36Å; A84-I116 VanDerWaalsContact O-CA 3.32Å; A84-I116 WeakPolarHBondContact O-CA 3.48Å; A84-I117 PolarHBondContact O-N 3.49Å
85	L	98.6	Very high	95.2	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.3	161	-84	65.5	0	0	0	107.7	F11 L12 V13 I14 V87 I117 A161 F162 C165	F11-L85 HydrophobicContact CD2-CD1 4.4Å; L12-L85 PolarHBondContact O-N 2.76Å; V13-L85 HydrophobicContact CG1-CB 4.32Å; I14-L85 PolarHBondContact N-O 3.29Å; L85-V87 HydrophobicContact CB-CG2 4.3Å; L85-I117 WeakPolarHBondContact CA-O 3.11Å; L85-A161 HydrophobicContact CD2-CB 3.98Å; L85-F162 HydrophobicContact CD1-CD1 3.99Å; L85-F162 HydrophobicContact CD1-CE1 4.03Å; L85-F162 HydrophobicContact CD2-CD1 4.19Å; L85-F162 HydrophobicContact CD2-CD2 4.14Å; L85-F162 HydrophobicContact CD2-CE1 3.81Å; L85-F162 HydrophobicContact CD2-CE2 3.74Å; L85-F162 HydrophobicContact CD2-CG 4.35Å; L85-F162 HydrophobicContact CD2-CZ 3.57Å; L85-C165 HydrophobicContact CD1-CB 4.49Å
86	L	98.6	Very high	96	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	112	174.8	174	60.4	0	0	0	108.3	I14 L99 W102 L103 I116 I117 L118 C119 L145	I14-L86 HydrophobicContact CD1-CD1 4.04Å; I14-L86 HydrophobicContact CG1-CB 4.35Å; I14-L86 HydrophobicContact CG1-CD1 3.88Å; L86-L99 HydrophobicContact CD1-CD2 3.8Å; L86-L99 HydrophobicContact CD2-CD2 3.78Å; L86-L99 HydrophobicContact CG-CD2 3.52Å; L86-W102 HydrophobicContact CD1-CB 3.48Å; L86-W102 VanDerWaalsContact CD1-CB 3.48Å; L86-W102 HydrophobicContact CD1-CG 4.27Å; L86-L103 HydrophobicContact CD2-CB 4.09Å; L86-I116 HydrophobicContact CB-CG2 3.76Å; L86-I116 HydrophobicContact CD2-CG2 4.49Å; L86-I117 PolarHBondContact N-O 2.89Å; L86-L118 HydrophobicContact CD2-CD1 4.17Å; L86-L118 HydrophobicContact CG-CD1 4.09Å; L86-L118 CarbonylContact O-C 3.53Å; L86-L118 WeakPolarHBondContact O-CA 3.5Å; L86-C119 PolarHBondContact O-N 3.44Å; L86-L145 HydrophobicContact CD2-CD1 4.47Å
87	V	98.7	Very high	96.6	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.2	-165.6	-168.8	0	0	0	0	111.3	V13 I14 G15 K21 L24 L85 C119 N121	V13-V87 HydrophobicContact CG1-CG2 3.73Å; I14-V87 PolarHBondContact O-N 3.1Å; G15-V87 WeakPolarHBondContact CA-O 3.31Å; K21-V87 HydrophobicContact CG-CB 4.02Å; K21-V87 HydrophobicContact CG-CG1 4.47Å; K21-V87 HydrophobicContact CG-CG2 4.1Å; L24-V87 HydrophobicContact CD1-CG1 3.77Å; L24-V87 HydrophobicContact CD1-CG2 3.95Å; L85-V87 HydrophobicContact CB-CG2 4.3Å; V87-C119 WeakPolarHBondContact CA-O 3.21Å; V87-C119 HydrophobicContact CG1-CB 4.47Å; V87-C119 HydrophobicContact CG2-CB 4.25Å; V87-N121 HydrophobicContact CG1-CB 3.85Å
88	Y	98.8	Very high	97	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	167.7	164.4	75.8	-79.5	0	0	0	110.4	I90 Y96 L99 L118 C119 G120 N121 V131 A136 F147	Y88-I90 HydrophobicContact CE2-CG2 3.95Å; Y88-Y96 HydrophobicContact CD1-CD2 4.48Å; Y88-Y96 HydrophobicContact CD2-CD2 4.03Å; Y88-Y96 HydrophobicContact CD2-CG 4.47Å; Y88-Y96 HydrophobicContact CE1-CD2 4.4Å; Y88-Y96 AromaticContact CE2-CD2 3.97Å; Y88-Y96 HydrophobicContact CE2-CD2 3.97Å; Y88-Y96 HydrophobicContact CG-CD2 4.3Å; Y88-L99 HydrophobicContact CD1-CD1 3.9Å; Y88-L99 HydrophobicContact CD1-CD2 4.25Å; Y88-L99 HydrophobicContact CE1-CD1 4.47Å; Y88-L99 HydrophobicContact CG-CD1 4.2Å; Y88-L118 HydrophobicContact CD1-CD1 3.86Å; Y88-L118 HydrophobicContact CD1-CG 4.4Å; Y88-L118 HydrophobicContact CE1-CD1 4.09Å; Y88-L118 HydrophobicContact CE1-CD2 4.37Å; Y88-L118 HydrophobicContact CE1-CG 4.13Å; Y88-C119 WeakPolarHBondContact CD1-O 3.37Å; Y88-C119 PolarHBondContact N-O 2.84Å; Y88-G120 VanDerWaalsContact CZ-CA 3.41Å; Y88-N121 PolarHBondContact O-N 2.92Å; Y88-V131 HydrophobicContact CE2-CB 3.97Å; Y88-V131 HydrophobicContact CE2-CG1 3.81Å; Y88-V131 HydrophobicContact CE2-CG2 4.21Å; Y88-A136 HydrophobicContact CE1-CB 4.38Å; Y88-A136 WeakPolarHBondContact OH-CB 3.28Å; Y88-F147 HydrophobicContact CE1-CE2 4.03Å; Y88-F147 WeakPolarHBondContact OH-CE2 3.44Å; Y88-F147 WeakPolarHBondContact OH-CZ 3.5Å
89	D	98.6	Very high	97.3	Very high	9 Å²	9	31.1 Å²	31.1	5%	0.048	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.4	175.9	-178.6	-4.1	0	0	0	109.5	T19 T91 S92 T95 K122	T19-D89 HydrophobicContact CG2-CB 4.22Å; D89-T91 PolarHBondContact O-N 3.3Å; D89-T91 PolarHBondContact OD1-N 3.04Å; D89-T91 PolarHBondContact OD1-OG1 3.39Å; D89-T91 VanDerWaalsContact OD1-OG1 3.1Å; D89-T91 PolarHBondContact OD2-OG1 3.16Å; D89-S92 PolarHBondContact O-N 3.18Å; D89-S92 VanDerWaalsContact O-N 3.1Å; D89-T95 HydrophobicContact CB-CG2 4.39Å; D89-T95 PolarHBondContact N-OG1 3.19Å; D89-T95 PolarHBondContact O-OG1 3.26Å; D89-K122 WeakPolarHBondContact OD1-CD 3.28Å; D89-K122 WeakPolarHBondContact OD2-CD 3.5Å; D89-K122 WeakPolarHBondContact OD2-CE 3.38Å; D89-K122 IonicContact OD2-NZ 2.81Å; D89-K122 PolarHBondContact OD2-NZ 2.88Å
90	I	98.8	Very high	97.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.6	-178.8	68	161.5	0	0	0	113.1	Y88 S92 N121 E130 V131	Y88-I90 HydrophobicContact CE2-CG2 3.95Å; I90-S92 VanDerWaalsContact C-N 3.33Å; I90-N121 PolarHBondContact N-O 3.03Å; I90-N121 VanDerWaalsContact N-O 3.08Å; I90-E130 PolarHBondContact O-N 2.98Å; I90-V131 PolarHBondContact O-N 3.38Å; I90-V131 VanDerWaalsContact O-N 3.09Å
91	T	98.7	Very high	97.9	Very high	27 Å²	27	29 Å²	29	17%	0.166	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	9.9	178.3	78.3	0	0	0	0	112.3	D89 L125 D128 E130	D89-T91 PolarHBondContact O-N 3.3Å; D89-T91 PolarHBondContact OD1-N 3.04Å; D89-T91 PolarHBondContact OD1-OG1 3.39Å; D89-T91 VanDerWaalsContact OD1-OG1 3.1Å; D89-T91 PolarHBondContact OD2-OG1 3.16Å; T91-L125 HydrophobicContact CG2-CB 3.63Å; T91-L125 HydrophobicContact CG2-CD1 4.3Å; T91-D128 WeakPolarHBondContact CA-O 3.29Å; T91-D128 WeakPolarHBondContact CB-O 3.43Å; T91-D128 HydrophobicContact CG2-CB 4.04Å; T91-E130 VanDerWaalsContact O-CD 3.32Å
92	S	98.4	Very high	97.9	Very high	30 Å²	30	29.1 Å²	29.1	21%	0.21	16%	0.157	C	C	.	.			trans	-141.5	100.3	179.5	-176.2	0	0	0	0	112	D89 I90 E94 T95	D89-S92 PolarHBondContact O-N 3.18Å; D89-S92 VanDerWaalsContact O-N 3.1Å; I90-S92 VanDerWaalsContact C-N 3.33Å; S92-E94 PolarHBondContact O-N 3.22Å; S92-T95 PolarHBondContact O-N 3.27Å; S92-T95 VanDerWaalsContact O-N 3.1Å; S92-T95 PolarHBondContact O-OG1 2.9Å
93	R	98.4	Very high	97.9	Very high	70 Å²	70	29.1 Å²	29.1	26%	0.264	16%	0.157	S	C	.	.	H	α-helix	trans	-55.6	-35.3	178.7	180	60.3	68.3	177	13.4	113.1	T95 Y96 N97 E130 E135	R93-T95 VanDerWaalsContact C-N 3.32Å; R93-T95 PolarHBondContact O-N 3.29Å; R93-Y96 WeakPolarHBondContact O-CB 3.13Å; R93-Y96 PolarHBondContact O-N 2.93Å; R93-N97 VanDerWaalsContact O-CG 3.31Å; R93-N97 PolarHBondContact O-N 2.81Å; R93-E130 HydrophobicContact CB-CB 4.28Å; R93-E130 VanDerWaalsContact CB-OE2 3.25Å; R93-E130 WeakPolarHBondContact CB-OE2 3.13Å; R93-E130 PolarHBondContact N-OE2 3.32Å; R93-E130 PolarHBondContact NE-O 3.05Å; R93-E130 PolarHBondContact NH2-O 2.88Å; R93-E135 IonicContact CZ-OE1 3.24Å; R93-E135 IonicContact CZ-OE2 2.66Å; R93-E135 IonicContact NH1-OE1 3.32Å; R93-E135 PolarHBondContact NH1-OE1 2.96Å; R93-E135 IonicContact NH1-OE2 2.68Å; R93-E135 PolarHBondContact NH1-OE2 3.39Å; R93-E135 IonicContact NH2-OE1 3.48Å; R93-E135 PolarHBondContact NH2-OE1 3.29Å; R93-E135 IonicContact NH2-OE2 3.41Å; R93-E135 PolarHBondContact NH2-OE2 2.82Å
94	E	97.9	Very high	97.8	Very high	142 Å²	142	32.1 Å²	32.1	66%	0.664	18%	0.177	S	C	*	.	H	α-helix	trans	-59.6	-43.1	178.3	-171.9	-172.2	159.3	0	0	111.7	S92 Y96 N97 A98	S92-E94 PolarHBondContact O-N 3.22Å; E94-Y96 VanDerWaalsContact C-N 3.28Å; E94-Y96 PolarHBondContact O-N 3.23Å; E94-N97 PolarHBondContact O-N 2.77Å; E94-A98 PolarHBondContact O-N 2.89Å
95	T	98.4	Very high	97.6	Very high	12 Å²	12	33 Å²	33	7%	0.074	18%	0.182	C	C	.	.	H	α-helix	trans	-66.9	-32.1	-179.4	70.9	0	0	0	0	112.3	N16 T19 D89 S92 R93	N16-T95 HydrophobicContact CB-CG2 3.96Å; T19-T95 HydrophobicContact CG2-CG2 3.66Å; D89-T95 HydrophobicContact CB-CG2 4.39Å; D89-T95 PolarHBondContact N-OG1 3.19Å; D89-T95 PolarHBondContact O-OG1 3.26Å; S92-T95 PolarHBondContact O-N 3.27Å; S92-T95 VanDerWaalsContact O-N 3.1Å; S92-T95 PolarHBondContact O-OG1 2.9Å; R93-T95 VanDerWaalsContact C-N 3.32Å; R93-T95 PolarHBondContact O-N 3.29Å
96	Y	98.7	Very high	97.4	Very high	27 Å²	27	33 Å²	33	11%	0.106	18%	0.182	C	C	.	.	H	α-helix	trans	-69.5	-44.6	173.4	175.5	-97.7	0	0	0	111.9	Y88 R93 E94 A98 L99 V131 E135 A136 F139	Y88-Y96 HydrophobicContact CD1-CD2 4.48Å; Y88-Y96 HydrophobicContact CD2-CD2 4.03Å; Y88-Y96 HydrophobicContact CD2-CG 4.47Å; Y88-Y96 HydrophobicContact CE1-CD2 4.4Å; Y88-Y96 AromaticContact CE2-CD2 3.97Å; Y88-Y96 HydrophobicContact CE2-CD2 3.97Å; Y88-Y96 HydrophobicContact CG-CD2 4.3Å; R93-Y96 WeakPolarHBondContact O-CB 3.13Å; R93-Y96 PolarHBondContact O-N 2.93Å; E94-Y96 VanDerWaalsContact C-N 3.28Å; E94-Y96 PolarHBondContact O-N 3.23Å; Y96-A98 PolarHBondContact O-N 2.93Å; Y96-L99 HydrophobicContact CD2-CD1 3.38Å; Y96-L99 HydrophobicContact CE2-CD1 3.72Å; Y96-L99 HydrophobicContact CG-CD1 4.12Å; Y96-L99 WeakPolarHBondContact O-CB 3.37Å; Y96-L99 WeakPolarHBondContact O-CD1 3.43Å; Y96-L99 WeakPolarHBondContact O-CG 3.21Å; Y96-L99 PolarHBondContact O-N 2.96Å; Y96-V131 HydrophobicContact CD1-CG1 4.34Å; Y96-V131 HydrophobicContact CD2-CG1 3.66Å; Y96-V131 HydrophobicContact CE2-CG1 3.96Å; Y96-V131 HydrophobicContact CG-CG1 3.87Å; Y96-V131 HydrophobicContact CG-CG2 4.05Å; Y96-E135 PolarHBondContact OH-O 2.89Å; Y96-A136 HydrophobicContact CE2-CB 3.93Å; Y96-F139 HydrophobicContact CE2-CB 4.5Å; Y96-F139 WeakPolarHBondContact OH-CB 3.12Å
97	N	98.2	Very high	97.2	Very high	103 Å²	103	35.9 Å²	35.9	55%	0.551	19%	0.193	S	C	*	.	H	α-helix	trans	-61.6	-27.6	178.5	-67.7	-15.4	0	0	0	112.5	R93 E94 L99	R93-N97 VanDerWaalsContact O-CG 3.31Å; R93-N97 PolarHBondContact O-N 2.81Å; E94-N97 PolarHBondContact O-N 2.77Å; N97-L99 VanDerWaalsContact C-N 3.29Å; N97-L99 PolarHBondContact O-N 3.21Å
98	A	97.3	Very high	96.9	Very high	20 Å²	20	42.5 Å²	42.5	17%	0.165	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-10.6	176.9	0	0	0	0	0	114.5	N16 E94 Y96 T100 T101 W102	N16-A98 VanDerWaalsContact OD1-CB 3.26Å; N16-A98 WeakPolarHBondContact OD1-CB 3.44Å; E94-A98 PolarHBondContact O-N 2.89Å; Y96-A98 PolarHBondContact O-N 2.93Å; A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 2.69Å; A98-T101 PolarHBondContact O-N 3.23Å; A98-T101 VanDerWaalsContact O-N 3.15Å; A98-W102 VanDerWaalsContact O-CD1 3.26Å; A98-W102 PolarHBondContact O-N 3Å
99	L	98.1	Very high	96.6	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-56.3	-41.1	-175.9	-73.9	171.8	0	0	0	112.8	L86 Y88 Y96 N97 T101 W102 L103 L118 F139	L86-L99 HydrophobicContact CD1-CD2 3.8Å; L86-L99 HydrophobicContact CD2-CD2 3.78Å; L86-L99 HydrophobicContact CG-CD2 3.52Å; Y88-L99 HydrophobicContact CD1-CD1 3.9Å; Y88-L99 HydrophobicContact CD1-CD2 4.25Å; Y88-L99 HydrophobicContact CE1-CD1 4.47Å; Y88-L99 HydrophobicContact CG-CD1 4.2Å; Y96-L99 HydrophobicContact CD2-CD1 3.38Å; Y96-L99 HydrophobicContact CE2-CD1 3.72Å; Y96-L99 HydrophobicContact CG-CD1 4.12Å; Y96-L99 WeakPolarHBondContact O-CB 3.37Å; Y96-L99 WeakPolarHBondContact O-CD1 3.43Å; Y96-L99 WeakPolarHBondContact O-CG 3.21Å; Y96-L99 PolarHBondContact O-N 2.96Å; N97-L99 VanDerWaalsContact C-N 3.29Å; N97-L99 PolarHBondContact O-N 3.21Å; L99-T101 VanDerWaalsContact C-N 3.28Å; L99-T101 PolarHBondContact O-N 3.1Å; L99-W102 PolarHBondContact O-N 3.47Å; L99-L103 VanDerWaalsContact O-CB 3.27Å; L99-L103 WeakPolarHBondContact O-CB 3.24Å; L99-L103 PolarHBondContact O-N 3.05Å; L99-L118 HydrophobicContact CD1-CD1 3.76Å; L99-L118 HydrophobicContact CD2-CD1 3.56Å; L99-L118 HydrophobicContact CG-CD1 4.31Å; L99-F139 HydrophobicContact CB-CE1 3.94Å; L99-F139 HydrophobicContact CB-CE2 4.45Å; L99-F139 HydrophobicContact CB-CZ 3.72Å; L99-F139 HydrophobicContact CD1-CD1 4.26Å; L99-F139 HydrophobicContact CD1-CE1 4.06Å
100	T	97	Very high	96.3	Very high	86 Å²	86	45.4 Å²	45.4	53%	0.528	24%	0.243	S	C	.	.	H	α-helix	trans	-58	-41.7	-179.7	-49.7	0	0	0	0	111.6	A98 S104	A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 2.69Å; T100-S104 WeakPolarHBondContact O-CB 3.46Å; T100-S104 PolarHBondContact O-N 3.47Å
101	T	95.1	Very high	95.8	Very high	76 Å²	76	47.3 Å²	47.3	47%	0.466	26%	0.256	S	S	.	.	H	α-helix	trans	-69.2	-43.1	179.1	-46.5	0	0	0	0	111.4	R71 A98 L99 D105	R71-T101 PolarHBondContact NH2-O 2.82Å; A98-T101 PolarHBondContact O-N 3.23Å; A98-T101 VanDerWaalsContact O-N 3.15Å; L99-T101 VanDerWaalsContact C-N 3.28Å; L99-T101 PolarHBondContact O-N 3.1Å; T101-D105 PolarHBondContact O-N 3.34Å; T101-D105 VanDerWaalsContact O-N 3.09Å
102	W	95.8	Very high	95.3	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.011	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-40.6	176.7	-74.3	108.3	0	0	0	112.8	I14 G15 N16 Y78 L86 A98 L99 D105 A106	I14-W102 HydrophobicContact CB-CE3 4.09Å; I14-W102 HydrophobicContact CB-CZ3 4.44Å; I14-W102 HydrophobicContact CD1-CB 4.49Å; G15-W102 WeakPolarHBondContact O-CZ2 3.12Å; N16-W102 PolarHBondContact OD1-NE1 3.18Å; Y78-W102 WeakPolarHBondContact OH-CZ3 3.48Å; L86-W102 HydrophobicContact CD1-CB 3.48Å; L86-W102 VanDerWaalsContact CD1-CB 3.48Å; L86-W102 HydrophobicContact CD1-CG 4.27Å; A98-W102 VanDerWaalsContact O-CD1 3.26Å; A98-W102 PolarHBondContact O-N 3Å; L99-W102 PolarHBondContact O-N 3.47Å; W102-D105 PolarHBondContact O-N 2.93Å; W102-A106 WeakPolarHBondContact O-CB 3.49Å; W102-A106 PolarHBondContact O-N 2.85Å
103	L	96.4	Very high	94.7	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-44.1	176.8	178.6	60.6	0	0	0	111.6	L86 L99 A106 R107 I116 F139 N143 L145	L86-L103 HydrophobicContact CD2-CB 4.09Å; L99-L103 VanDerWaalsContact O-CB 3.27Å; L99-L103 WeakPolarHBondContact O-CB 3.24Å; L99-L103 PolarHBondContact O-N 3.05Å; L103-A106 PolarHBondContact O-N 3.2Å; L103-R107 HydrophobicContact CD1-CG 4.49Å; L103-R107 PolarHBondContact O-N 2.54Å; L103-R107 VanDerWaalsContact O-N 3.07Å; L103-I116 HydrophobicContact CD1-CD1 3.48Å; L103-I116 VanDerWaalsContact CD1-CD1 3.48Å; L103-F139 HydrophobicContact CD2-CZ 4.29Å; L103-N143 HydrophobicContact CD2-CB 3.76Å; L103-N143 WeakPolarHBondContact CD2-OD1 3.27Å; L103-L145 HydrophobicContact CD1-CD1 4.3Å; L103-L145 HydrophobicContact CD1-CD2 4.04Å; L103-L145 HydrophobicContact CD2-CD1 4.2Å
104	S	95.2	Very high	94.6	Very high	62 Å²	62	51.4 Å²	51.4	43%	0.434	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-47.7	175.3	179.7	0	0	0	0	111.4	T100 A106 R107 M108	T100-S104 WeakPolarHBondContact O-CB 3.46Å; T100-S104 PolarHBondContact O-N 3.47Å; S104-A106 VanDerWaalsContact C-N 3.35Å; S104-A106 PolarHBondContact O-N 3.36Å; S104-R107 PolarHBondContact O-N 3.06Å; S104-M108 VanDerWaalsContact O-CB 3.25Å; S104-M108 WeakPolarHBondContact O-CB 3.49Å; S104-M108 PolarHBondContact O-N 3.48Å
105	D	93.3	Very high	94.5	Very high	20 Å²	20	45.1 Å²	45.1	11%	0.107	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-40.6	177.7	-81.6	4	0	0	0	112.1	R71 Y78 T101 W102 M108 L109	R71-D105 IonicContact CZ-OD2 3.14Å; R71-D105 IonicContact NE-OD2 2.76Å; R71-D105 PolarHBondContact NE-OD2 3.05Å; R71-D105 IonicContact NH2-OD2 2.88Å; R71-D105 PolarHBondContact NH2-OD2 3.29Å; Y78-D105 HydrophobicContact CE1-CB 4.21Å; T101-D105 PolarHBondContact O-N 3.34Å; T101-D105 VanDerWaalsContact O-N 3.09Å; W102-D105 PolarHBondContact O-N 2.93Å; D105-M108 PolarHBondContact O-N 2.87Å; D105-L109 HydrophobicContact CB-CD1 4.24Å; D105-L109 VanDerWaalsContact O-CB 3.24Å; D105-L109 WeakPolarHBondContact O-CB 3.3Å; D105-L109 VanDerWaalsContact O-CG 3.29Å; D105-L109 WeakPolarHBondContact O-CG 3.42Å; D105-L109 PolarHBondContact O-N 3.23Å
106	A	94.4	Very high	94.5	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.5	-50.3	177.3	0	0	0	0	0	111.8	I14 Y78 W102 L103 S104 A110 I116	I14-A106 HydrophobicContact CD1-CB 3.8Å; Y78-A106 HydrophobicContact CE1-CB 4.24Å; W102-A106 WeakPolarHBondContact O-CB 3.49Å; W102-A106 PolarHBondContact O-N 2.85Å; L103-A106 PolarHBondContact O-N 3.2Å; S104-A106 VanDerWaalsContact C-N 3.35Å; S104-A106 PolarHBondContact O-N 3.36Å; A106-A110 WeakPolarHBondContact O-CB 3.4Å; A106-A110 PolarHBondContact O-N 3.45Å; A106-I116 HydrophobicContact CB-CD1 3.87Å
107	R	94.8	Very high	94.5	Very high	60 Å²	60	43.7 Å²	43.7	23%	0.226	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-40.6	179.7	-73.5	176.1	167.3	159.2	-0.9	112.5	L103 S104 S111 N143	L103-R107 HydrophobicContact CD1-CG 4.49Å; L103-R107 PolarHBondContact O-N 2.54Å; L103-R107 VanDerWaalsContact O-N 3.07Å; S104-R107 PolarHBondContact O-N 3.06Å; R107-S111 CarbonylContact O-C 3.55Å; R107-S111 VanDerWaalsContact O-C 3.25Å; R107-N143 PolarHBondContact NH2-O 3.33Å
108	M	93.4	Very high	94.6	Very high	141 Å²	141	38.8 Å²	38.8	70%	0.695	21%	0.214	S	C	*	.	H	α-helix	trans	-71.5	-42.5	-178.1	-174.8	-177.4	-65.6	0	0	112.8	S104 D105	S104-M108 VanDerWaalsContact O-CB 3.25Å; S104-M108 WeakPolarHBondContact O-CB 3.49Å; S104-M108 PolarHBondContact O-N 3.48Å; D105-M108 PolarHBondContact O-N 2.87Å
109	L	92.6	Very high	94.6	Very high	53 Å²	53	37.9 Å²	37.9	28%	0.277	21%	0.207	S	C	.	.	H	α-helix	trans	-96.1	-27.2	-169.5	-58.2	174.7	0	0	0	113.7	R75 Y78 D105	R75-L109 HydrophobicContact CB-CD1 4.16Å; R75-L109 HydrophobicContact CG-CD1 3.71Å; Y78-L109 HydrophobicContact CD1-CB 3.81Å; Y78-L109 HydrophobicContact CD1-CD1 4.12Å; Y78-L109 HydrophobicContact CG-CB 3.88Å; Y78-L109 HydrophobicContact CG-CD1 4.16Å; D105-L109 HydrophobicContact CB-CD1 4.24Å; D105-L109 VanDerWaalsContact O-CB 3.24Å; D105-L109 WeakPolarHBondContact O-CB 3.3Å; D105-L109 VanDerWaalsContact O-CG 3.29Å; D105-L109 WeakPolarHBondContact O-CG 3.42Å; D105-L109 PolarHBondContact O-N 3.23Å
110	A	92.4	Very high	94.7	Very high	17 Å²	17	37.8 Å²	37.8	14%	0.14	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-76.6	178.1	0	0	0	0	0	111.2	Y78 A81 A106 I114	Y78-A110 VanDerWaalsContact O-CA 3.28Å; Y78-A110 WeakPolarHBondContact O-CA 3.49Å; Y78-A110 WeakPolarHBondContact O-CB 3.38Å; A81-A110 HydrophobicContact CB-CB 4.13Å; A106-A110 WeakPolarHBondContact O-CB 3.4Å; A106-A110 PolarHBondContact O-N 3.45Å; A110-I114 HydrophobicContact CB-CD1 3.71Å
111	S	88.4	Confident	94.7	Very high	39 Å²	39	33.8 Å²	33.8	27%	0.273	18%	0.182	S	C	.	.			trans	-169	156.6	170.8	70.6	0	0	0	0	109.2	R107 N113 I114	R107-S111 CarbonylContact O-C 3.55Å; R107-S111 VanDerWaalsContact O-C 3.25Å; S111-N113 PolarHBondContact O-N 2.82Å; S111-N113 PolarHBondContact OG-N 3.01Å; S111-I114 WeakPolarHBondContact O-CG2 3.27Å; S111-I114 PolarHBondContact O-N 3.37Å; S111-I114 PolarHBondContact OG-N 2.85Å; S111-I114 VanDerWaalsContact OG-N 3.14Å
112	Q	86.6	Confident	94.9	Very high	137 Å²	137	32.9 Å²	32.9	64%	0.64	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.9	172.5	-166	62.4	23.3	0	0	112.6
113	N	87.1	Confident	95	Very high	64 Å²	64	35.5 Å²	35.5	34%	0.342	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	0.2	-175.9	-64.6	-14.1	0	0	0	113.6	S111 V115 L178	S111-N113 PolarHBondContact O-N 2.82Å; S111-N113 PolarHBondContact OG-N 3.01Å; N113-V115 PolarHBondContact O-N 3.36Å; N113-L178 HydrophobicContact CB-CD2 3.82Å
114	I	94.6	Very high	95.1	Very high	13 Å²	13	38.3 Å²	38.3	7%	0.067	20%	0.198	C	C	.	.			trans	-54.9	131.9	179.4	-171.6	173.2	0	0	0	110.4	A81 A84 A110 S111 I116	A81-I114 HydrophobicContact CB-CD1 3.9Å; A84-I114 HydrophobicContact CB-CD1 3.92Å; A110-I114 HydrophobicContact CB-CD1 3.71Å; S111-I114 WeakPolarHBondContact O-CG2 3.27Å; S111-I114 PolarHBondContact O-N 3.37Å; S111-I114 PolarHBondContact OG-N 2.85Å; S111-I114 VanDerWaalsContact OG-N 3.14Å; I114-I116 HydrophobicContact CG1-CG1 4.32Å; I114-I116 HydrophobicContact CG2-CD1 3.8Å; I114-I116 HydrophobicContact CG2-CG1 3.93Å
115	V	97.5	Very high	95.3	Very high	9 Å²	9	38.6 Å²	38.6	6%	0.055	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.6	176.5	174.6	0	0	0	0	109.1	A82 G83 A84 N113 K168 I169 K172	A82-V115 PolarHBondContact O-N 3.04Å; G83-V115 CarbonylContact C-O 3.56Å; G83-V115 WeakPolarHBondContact CA-O 3.37Å; A84-V115 PolarHBondContact N-O 2.89Å; N113-V115 PolarHBondContact O-N 3.36Å; V115-K168 HydrophobicContact CG1-CB 3.61Å; V115-K168 HydrophobicContact CG1-CD 3.94Å; V115-K168 HydrophobicContact CG1-CG 4.45Å; V115-K168 HydrophobicContact CG2-CB 4.42Å; V115-I169 HydrophobicContact CB-CD1 4.34Å; V115-I169 HydrophobicContact CB-CG1 3.77Å; V115-I169 HydrophobicContact CG1-CG1 4.34Å; V115-I169 HydrophobicContact CG2-CG1 3.61Å; V115-K172 HydrophobicContact CG2-CD 3.99Å
116	I	98.3	Very high	95.5	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.051	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.7	-176.9	-59.5	174.4	0	0	0	110.3	A84 L86 L103 A106 I114 L145	A84-I116 HydrophobicContact CB-CG1 4.36Å; A84-I116 VanDerWaalsContact O-CA 3.32Å; A84-I116 WeakPolarHBondContact O-CA 3.48Å; L86-I116 HydrophobicContact CB-CG2 3.76Å; L86-I116 HydrophobicContact CD2-CG2 4.49Å; L103-I116 HydrophobicContact CD1-CD1 3.48Å; L103-I116 VanDerWaalsContact CD1-CD1 3.48Å; A106-I116 HydrophobicContact CB-CD1 3.87Å; I114-I116 HydrophobicContact CG1-CG1 4.32Å; I114-I116 HydrophobicContact CG2-CD1 3.8Å; I114-I116 HydrophobicContact CG2-CG1 3.93Å; I116-L145 HydrophobicContact CB-CD2 3.9Å; I116-L145 HydrophobicContact CG2-CD2 4.08Å
117	I	98.6	Very high	95.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.4	168.5	-50.1	-59.2	0	0	0	108.3	A84 L85 L86 M146 L148 A161 C165 K168	A84-I117 PolarHBondContact O-N 3.49Å; L85-I117 WeakPolarHBondContact CA-O 3.11Å; L86-I117 PolarHBondContact N-O 2.89Å; I117-M146 CarbonylContact C-O 3.59Å; I117-M146 HydrophobicContact CD1-CB 3.74Å; I117-M146 HydrophobicContact CD1-CG 4.08Å; I117-M146 HydrophobicContact CD1-SD 3.83Å; I117-L148 HydrophobicContact CG2-CD1 4.31Å; I117-A161 HydrophobicContact CG2-CB 4.45Å; I117-C165 HydrophobicContact CD1-CB 4.24Å; I117-C165 HydrophobicContact CG1-CB 3.57Å; I117-K168 HydrophobicContact CD1-CD 4.18Å
118	L	98.8	Very high	95.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	127.1	170.1	-179.5	66.1	0	0	0	109.2	L86 Y88 L99 F139 A140 L145 M146 F147 L148	L86-L118 HydrophobicContact CD2-CD1 4.17Å; L86-L118 HydrophobicContact CG-CD1 4.09Å; L86-L118 CarbonylContact O-C 3.53Å; L86-L118 WeakPolarHBondContact O-CA 3.5Å; Y88-L118 HydrophobicContact CD1-CD1 3.86Å; Y88-L118 HydrophobicContact CD1-CG 4.4Å; Y88-L118 HydrophobicContact CE1-CD1 4.09Å; Y88-L118 HydrophobicContact CE1-CD2 4.37Å; Y88-L118 HydrophobicContact CE1-CG 4.13Å; L99-L118 HydrophobicContact CD1-CD1 3.76Å; L99-L118 HydrophobicContact CD2-CD1 3.56Å; L99-L118 HydrophobicContact CG-CD1 4.31Å; L118-F139 HydrophobicContact CD2-CD1 3.92Å; L118-F139 HydrophobicContact CD2-CE1 4.45Å; L118-A140 HydrophobicContact CD2-CB 3.95Å; L118-L145 HydrophobicContact CB-CB 4.47Å; L118-L145 HydrophobicContact CB-CD1 4.3Å; L118-M146 PolarHBondContact N-O 3.36Å; L118-F147 HydrophobicContact CB-CB 4.47Å; L118-F147 HydrophobicContact CB-CD2 4.11Å; L118-F147 HydrophobicContact CD2-CD2 3.74Å; L118-F147 HydrophobicContact CD2-CE2 4.3Å; L118-F147 HydrophobicContact CD2-CG 4.34Å; L118-F147 HydrophobicContact CG-CD2 3.78Å; L118-F147 HydrophobicContact CG-CE2 4.36Å; L118-F147 WeakPolarHBondContact O-CA 3.38Å; L118-L148 PolarHBondContact O-N 3.34Å
119	C	98.9	Very high	96.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	113.2	-179.7	-59.1	0	0	0	0	110	L86 V87 Y88 N121 L148 T150	L86-C119 PolarHBondContact O-N 3.44Å; V87-C119 WeakPolarHBondContact CA-O 3.21Å; V87-C119 HydrophobicContact CG1-CB 4.47Å; V87-C119 HydrophobicContact CG2-CB 4.25Å; Y88-C119 WeakPolarHBondContact CD1-O 3.37Å; Y88-C119 PolarHBondContact N-O 2.84Å; C119-N121 PolarHBondContact O-N 2.87Å; C119-L148 CarbonylContact C-O 3.59Å; C119-L148 VanDerWaalsContact CA-O 3.28Å; C119-L148 WeakPolarHBondContact CA-O 3.15Å; C119-T150 HydrophobicContact CB-CG2 4.46Å
120	G	98.8	Very high	96.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	95.9	166	0	0	0	0	0	109.5	Y88 L148 E149 T150	Y88-G120 VanDerWaalsContact CZ-CA 3.41Å; G120-L148 PolarHBondContact N-O 3.23Å; G120-E149 CarbonylContact O-C 3.59Å; G120-E149 WeakPolarHBondContact O-CA 3.29Å; G120-T150 PolarHBondContact O-N 2.82Å
121	N	98.8	Very high	96.7	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.011	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	168.1	-173.8	-168.6	32.5	0	0	0	112.1	T19 L24 V87 Y88 I90 C119 T150 A152	T19-N121 PolarHBondContact O-ND2 2.77Å; L24-N121 HydrophobicContact CD1-CB 4.3Å; V87-N121 HydrophobicContact CG1-CB 3.85Å; Y88-N121 PolarHBondContact O-N 2.92Å; I90-N121 PolarHBondContact N-O 3.03Å; I90-N121 VanDerWaalsContact N-O 3.08Å; C119-N121 PolarHBondContact O-N 2.87Å; N121-T150 CarbonylContact C-O 3.53Å; N121-T150 VanDerWaalsContact CA-O 3.29Å; N121-T150 WeakPolarHBondContact CA-O 3.39Å; N121-T150 PolarHBondContact OD1-O 2.87Å; N121-T150 PolarHBondContact OD1-OG1 3.46Å; N121-A152 PolarHBondContact OD1-N 3.38Å
122	K	98.4	Very high	97.1	Very high	56 Å²	56	48.3 Å²	48.3	24%	0.243	26%	0.257	C	S	.	.			trans	68.3	35.4	-176.7	-47	-166.8	-166.6	167.4	0	113.7	G18 D89 D124 L125 T150	G18-K122 VanDerWaalsContact O-CE 3.3Å; G18-K122 WeakPolarHBondContact O-CE 3.42Å; G18-K122 PolarHBondContact O-NZ 2.88Å; D89-K122 WeakPolarHBondContact OD1-CD 3.28Å; D89-K122 WeakPolarHBondContact OD2-CD 3.5Å; D89-K122 WeakPolarHBondContact OD2-CE 3.38Å; D89-K122 IonicContact OD2-NZ 2.81Å; D89-K122 PolarHBondContact OD2-NZ 2.88Å; K122-D124 PolarHBondContact O-N 2.8Å; K122-D124 VanDerWaalsContact O-N 3.11Å; K122-L125 HydrophobicContact CB-CD1 4.29Å; K122-L125 HydrophobicContact CD-CD1 4.2Å; K122-L125 PolarHBondContact O-N 3.3Å; K122-T150 PolarHBondContact N-O 3.4Å
123	K	98.6	Very high	97.7	Very high	59 Å²	59	47.1 Å²	47.1	26%	0.257	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-56.5	-24.7	175.3	-165.4	-175	179.6	-172.8	0	113.8	L125 D126 E149 T150 E156	K123-L125 PolarHBondContact O-N 2.9Å; K123-D126 PolarHBondContact O-N 3.16Å; K123-E149 HydrophobicContact CB-CB 4.43Å; K123-E149 HydrophobicContact CD-CB 3.75Å; K123-E149 HydrophobicContact CG-CB 4.22Å; K123-T150 WeakPolarHBondContact CB-O 3.46Å; K123-T150 PolarHBondContact N-O 2.67Å; K123-E156 IonicContact NZ-OE1 3.15Å; K123-E156 PolarHBondContact NZ-OE1 3.13Å; K123-E156 IonicContact NZ-OE2 3.1Å
124	D	98.4	Very high	98.2	Very high	62 Å²	62	50.5 Å²	50.5	33%	0.332	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-60.6	-20.1	171.7	48.9	-77.2	0	0	0	114	K122 S151 L153 T154	K122-D124 PolarHBondContact O-N 2.8Å; K122-D124 VanDerWaalsContact O-N 3.11Å; D124-S151 WeakPolarHBondContact OD1-CB 3.13Å; D124-S151 PolarHBondContact OD1-OG 3.43Å; D124-L153 HydrophobicContact CB-CD2 4.28Å; D124-L153 WeakPolarHBondContact OD2-CD2 3.36Å; D124-T154 HydrophobicContact CB-CG2 4.23Å
125	L	97.9	Very high	98.4	Very high	69 Å²	69	52.5 Å²	52.5	36%	0.361	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-100.5	35.1	176.6	-55.9	179.8	0	0	0	112.4	T91 K122 K123 A127 D128	T91-L125 HydrophobicContact CG2-CB 3.63Å; T91-L125 HydrophobicContact CG2-CD1 4.3Å; K122-L125 HydrophobicContact CB-CD1 4.29Å; K122-L125 HydrophobicContact CD-CD1 4.2Å; K122-L125 PolarHBondContact O-N 3.3Å; K123-L125 PolarHBondContact O-N 2.9Å; L125-A127 PolarHBondContact O-N 3.27Å; L125-D128 PolarHBondContact O-N 3.03Å
126	D	97.6	Very high	98.5	Very high	87 Å²	87	52.1 Å²	52.1	47%	0.465	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-56.2	-27.5	-176.1	-165.7	60.5	0	0	0	114	K123 D128 R129	K123-D126 PolarHBondContact O-N 3.16Å; D126-D128 PolarHBondContact O-N 3.22Å; D126-R129 WeakPolarHBondContact O-CB 3.39Å; D126-R129 PolarHBondContact O-N 3.11Å; D126-R129 IonicContact OD1-CZ 3.47Å; D126-R129 IonicContact OD1-NE 2.69Å; D126-R129 PolarHBondContact OD1-NE 2.84Å; D126-R129 IonicContact OD1-NH2 3.91Å; D126-R129 PolarHBondContact OD1-NH2 2.94Å
127	A	98.3	Very high	98.5	Very high	102 Å²	102	53.6 Å²	53.6	84%	0.843	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-63.6	-28.3	176.1	0	0	0	0	0	113.3	L125	L125-A127 PolarHBondContact O-N 3.27Å
128	D	98.3	Very high	98.5	Very high	108 Å²	108	61.2 Å²	61.2	58%	0.578	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-101.4	18.7	-179.6	-59.2	-46.3	0	0	0	111.7	T91 L125 D126 E130	T91-D128 WeakPolarHBondContact CA-O 3.29Å; T91-D128 WeakPolarHBondContact CB-O 3.43Å; T91-D128 HydrophobicContact CG2-CB 4.04Å; L125-D128 PolarHBondContact O-N 3.03Å; D126-D128 PolarHBondContact O-N 3.22Å; D128-E130 PolarHBondContact O-N 2.79Å
129	R	98.6	Very high	98.5	Very high	64 Å²	64	62.4 Å²	62.4	24%	0.242	32%	0.319	C	S	.	.			trans	-61.1	123.6	-176.4	176.2	-177.9	-70.7	-89.3	7.1	111.7	D126 V131 E149	D126-R129 WeakPolarHBondContact O-CB 3.39Å; D126-R129 PolarHBondContact O-N 3.11Å; D126-R129 IonicContact OD1-CZ 3.47Å; D126-R129 IonicContact OD1-NE 2.69Å; D126-R129 PolarHBondContact OD1-NE 2.84Å; D126-R129 IonicContact OD1-NH2 3.91Å; D126-R129 PolarHBondContact OD1-NH2 2.94Å; R129-V131 VanDerWaalsContact CD-O 3.29Å; R129-V131 WeakPolarHBondContact CD-O 3.32Å; R129-V131 WeakPolarHBondContact CG-O 3.46Å; R129-V131 PolarHBondContact NH1-O 3.29Å; R129-E149 IonicContact CZ-OE1 3.92Å; R129-E149 IonicContact CZ-OE2 2.75Å; R129-E149 IonicContact NH1-OE1 3.84Å; R129-E149 PolarHBondContact NH1-OE1 2.72Å; R129-E149 IonicContact NH1-OE2 2.72Å; R129-E149 IonicContact NH2-OE1 2.91Å; R129-E149 PolarHBondContact NH2-OE1 2.75Å; R129-E149 VanDerWaalsContact NH2-OE1 3.16Å; R129-E149 IonicContact NH2-OE2 2.65Å; R129-E149 PolarHBondContact NH2-OE2 3.35Å
130	E	98.7	Very high	98.4	Very high	103 Å²	103	62.5 Å²	62.5	48%	0.481	32%	0.32	S	S	.	.			trans	-100.7	-23.3	171.1	-65.3	-170.2	176.7	0	0	112.5	I90 T91 R93 D128	I90-E130 PolarHBondContact O-N 2.98Å; T91-E130 VanDerWaalsContact O-CD 3.32Å; R93-E130 HydrophobicContact CB-CB 4.28Å; R93-E130 VanDerWaalsContact CB-OE2 3.25Å; R93-E130 WeakPolarHBondContact CB-OE2 3.13Å; R93-E130 PolarHBondContact N-OE2 3.32Å; R93-E130 PolarHBondContact NE-O 3.05Å; R93-E130 PolarHBondContact NH2-O 2.88Å; D128-E130 PolarHBondContact O-N 2.79Å
131	V	98.7	Very high	98.4	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.354	C	S	.	.	S	Bend	trans	-117.2	120.2	-176.7	-174.4	0	0	0	0	110.3	Y88 I90 Y96 R129 E135 A136	Y88-V131 HydrophobicContact CE2-CB 3.97Å; Y88-V131 HydrophobicContact CE2-CG1 3.81Å; Y88-V131 HydrophobicContact CE2-CG2 4.21Å; I90-V131 PolarHBondContact O-N 3.38Å; I90-V131 VanDerWaalsContact O-N 3.09Å; Y96-V131 HydrophobicContact CD1-CG1 4.34Å; Y96-V131 HydrophobicContact CD2-CG1 3.66Å; Y96-V131 HydrophobicContact CE2-CG1 3.96Å; Y96-V131 HydrophobicContact CG-CG1 3.87Å; Y96-V131 HydrophobicContact CG-CG2 4.05Å; R129-V131 VanDerWaalsContact CD-O 3.29Å; R129-V131 WeakPolarHBondContact CD-O 3.32Å; R129-V131 WeakPolarHBondContact CG-O 3.46Å; R129-V131 PolarHBondContact NH1-O 3.29Å; V131-E135 HydrophobicContact CG1-CG 3.89Å; V131-A136 HydrophobicContact CG1-CB 4.33Å
132	T	98.6	Very high	98.4	Very high	70 Å²	70	75.5 Å²	75.5	43%	0.429	38%	0.381	S	S	.	.			trans	-72.2	151.6	-179.7	65.2	0	0	0	0	112.1	L134 E135 A136	T132-L134 VanDerWaalsContact C-N 3.25Å; T132-L134 PolarHBondContact O-N 3.45Å; T132-E135 PolarHBondContact N-OE1 3.14Å; T132-E135 WeakPolarHBondContact O-CG 3.41Å; T132-E135 VanDerWaalsContact OG1-CG 3.22Å; T132-E135 WeakPolarHBondContact OG1-CG 3.2Å; T132-E135 PolarHBondContact OG1-N 2.84Å; T132-E135 PolarHBondContact OG1-OE1 3.19Å; T132-A136 PolarHBondContact O-N 2.86Å
133	F	98.4	Very high	98.3	Very high	111 Å²	111	74.7 Å²	74.7	49%	0.487	38%	0.379	S	S	.	.	H	α-helix	trans	-57.9	-41.5	172.9	180	-89.2	0	0	0	111.6	A136 S137 F147 E149	F133-A136 PolarHBondContact O-N 3.46Å; F133-S137 VanDerWaalsContact O-CB 3.23Å; F133-S137 WeakPolarHBondContact O-CB 3.25Å; F133-S137 PolarHBondContact O-N 3.2Å; F133-F147 HydrophobicContact CD2-CD1 4.46Å; F133-F147 AromaticContact CD2-CE1 3.53Å; F133-F147 HydrophobicContact CD2-CE1 3.53Å; F133-F147 HydrophobicContact CD2-CZ 4.14Å; F133-F147 AromaticContact CE2-CD1 3.97Å; F133-F147 HydrophobicContact CE2-CD1 3.97Å; F133-F147 AromaticContact CE2-CE1 3.46Å; F133-F147 HydrophobicContact CE2-CE1 3.46Å; F133-F147 VanDerWaalsContact CE2-CE1 3.46Å; F133-F147 HydrophobicContact CE2-CZ 4.3Å; F133-F147 HydrophobicContact CG-CE1 4.13Å; F133-F147 HydrophobicContact CZ-CD1 4.17Å; F133-F147 HydrophobicContact CZ-CE1 4.01Å; F133-E149 HydrophobicContact CD2-CG 4.02Å; F133-E149 HydrophobicContact CE2-CG 4.43Å
134	L	98.4	Very high	98.2	Very high	136 Å²	136	80.6 Å²	80.6	71%	0.712	41%	0.407	S	S	*	.	H	α-helix	trans	-65.2	-44.1	-174.4	-177.9	61.6	0	0	0	112.3	T132 S137 R138	T132-L134 VanDerWaalsContact C-N 3.25Å; T132-L134 PolarHBondContact O-N 3.45Å; L134-S137 PolarHBondContact O-N 3.01Å; L134-R138 WeakPolarHBondContact O-CB 3.1Å; L134-R138 PolarHBondContact O-N 2.8Å
135	E	98.2	Very high	98.1	Very high	55 Å²	55	78.5 Å²	78.5	26%	0.257	40%	0.396	S	S	.	.	H	α-helix	trans	-69	-39.2	180	73.9	-171.4	120.6	0	0	112.2	R93 Y96 V131 T132 R138 F139	R93-E135 IonicContact CZ-OE1 3.24Å; R93-E135 IonicContact CZ-OE2 2.66Å; R93-E135 IonicContact NH1-OE1 3.32Å; R93-E135 PolarHBondContact NH1-OE1 2.96Å; R93-E135 IonicContact NH1-OE2 2.68Å; R93-E135 PolarHBondContact NH1-OE2 3.39Å; R93-E135 IonicContact NH2-OE1 3.48Å; R93-E135 PolarHBondContact NH2-OE1 3.29Å; R93-E135 IonicContact NH2-OE2 3.41Å; R93-E135 PolarHBondContact NH2-OE2 2.82Å; Y96-E135 PolarHBondContact OH-O 2.89Å; V131-E135 HydrophobicContact CG1-CG 3.89Å; T132-E135 PolarHBondContact N-OE1 3.14Å; T132-E135 WeakPolarHBondContact O-CG 3.41Å; T132-E135 VanDerWaalsContact OG1-CG 3.22Å; T132-E135 WeakPolarHBondContact OG1-CG 3.2Å; T132-E135 PolarHBondContact OG1-N 2.84Å; T132-E135 PolarHBondContact OG1-OE1 3.19Å; E135-R138 WeakPolarHBondContact O-CB 3.39Å; E135-R138 PolarHBondContact O-N 2.92Å; E135-F139 PolarHBondContact O-N 2.7Å
136	A	98.6	Very high	98.1	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-68.2	-38.1	176.3	0	0	0	0	0	111.9	Y88 Y96 V131 T132 F133 R138 F139 A140 F147	Y88-A136 HydrophobicContact CE1-CB 4.38Å; Y88-A136 WeakPolarHBondContact OH-CB 3.28Å; Y96-A136 HydrophobicContact CE2-CB 3.93Å; V131-A136 HydrophobicContact CG1-CB 4.33Å; T132-A136 PolarHBondContact O-N 2.86Å; F133-A136 PolarHBondContact O-N 3.46Å; A136-R138 VanDerWaalsContact C-N 3.31Å; A136-R138 PolarHBondContact O-N 3.03Å; A136-F139 PolarHBondContact O-N 3.19Å; A136-A140 WeakPolarHBondContact O-CB 3.36Å; A136-A140 PolarHBondContact O-N 2.78Å; A136-F147 HydrophobicContact CB-CE1 3.92Å; A136-F147 HydrophobicContact CB-CE2 3.95Å; A136-F147 HydrophobicContact CB-CZ 3.54Å
137	S	98.4	Very high	98.1	Very high	42 Å²	42	75 Å²	75	29%	0.294	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-39.6	172.2	-174.9	0	0	0	0	111.7	F133 L134 A140 Q141	F133-S137 VanDerWaalsContact O-CB 3.23Å; F133-S137 WeakPolarHBondContact O-CB 3.25Å; F133-S137 PolarHBondContact O-N 3.2Å; L134-S137 PolarHBondContact O-N 3.01Å; S137-A140 PolarHBondContact O-N 3.43Å; S137-Q141 WeakPolarHBondContact O-CB 3.25Å; S137-Q141 PolarHBondContact O-N 3.26Å
138	R	98.6	Very high	98.2	Very high	160 Å²	160	71.8 Å²	71.8	60%	0.604	34%	0.344	S	S	*	.	H	α-helix	trans	-65.6	-47.3	176.3	-175.4	178.9	-175.1	156.9	8.4	111.4	L134 E135 A136 A140 Q141 E142	L134-R138 WeakPolarHBondContact O-CB 3.1Å; L134-R138 PolarHBondContact O-N 2.8Å; E135-R138 WeakPolarHBondContact O-CB 3.39Å; E135-R138 PolarHBondContact O-N 2.92Å; A136-R138 VanDerWaalsContact C-N 3.31Å; A136-R138 PolarHBondContact O-N 3.03Å; R138-A140 VanDerWaalsContact C-N 3.27Å; R138-A140 PolarHBondContact O-N 3.22Å; R138-Q141 PolarHBondContact O-N 3.4Å; R138-E142 HydrophobicContact CG-CG 4.4Å; R138-E142 WeakPolarHBondContact CG-OE1 3.21Å; R138-E142 IonicContact CZ-OE1 3.89Å; R138-E142 IonicContact NE-OE1 3.82Å; R138-E142 PolarHBondContact NE-OE1 2.55Å; R138-E142 IonicContact NH2-OE1 3.9Å; R138-E142 WeakPolarHBondContact O-CG 3.43Å; R138-E142 PolarHBondContact O-N 2.95Å
139	F	98.6	Very high	98.2	Very high	24 Å²	24	67.1 Å²	67.1	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-56.3	-43.5	174.8	173.7	-89.3	0	0	0	111.6	Y96 L99 L103 L118 E135 A136 N143 L145	Y96-F139 HydrophobicContact CE2-CB 4.5Å; Y96-F139 WeakPolarHBondContact OH-CB 3.12Å; L99-F139 HydrophobicContact CB-CE1 3.94Å; L99-F139 HydrophobicContact CB-CE2 4.45Å; L99-F139 HydrophobicContact CB-CZ 3.72Å; L99-F139 HydrophobicContact CD1-CD1 4.26Å; L99-F139 HydrophobicContact CD1-CE1 4.06Å; L103-F139 HydrophobicContact CD2-CZ 4.29Å; L118-F139 HydrophobicContact CD2-CD1 3.92Å; L118-F139 HydrophobicContact CD2-CE1 4.45Å; E135-F139 PolarHBondContact O-N 2.7Å; A136-F139 PolarHBondContact O-N 3.19Å; F139-N143 WeakPolarHBondContact O-CB 3.49Å; F139-N143 PolarHBondContact O-N 3.16Å; F139-N143 VanDerWaalsContact O-N 3.14Å; F139-N143 PolarHBondContact O-ND2 2.92Å; F139-L145 HydrophobicContact CE1-CD1 4.16Å
140	A	98.4	Very high	98.2	Very high	2 Å²	2	64 Å²	64	2%	0.017	31%	0.307	C	S	.	.	H	α-helix	trans	-62.5	-45.7	176.9	0	0	0	0	0	112	L118 A136 S137 R138 N143 E144 L145 F147	L118-A140 HydrophobicContact CD2-CB 3.95Å; A136-A140 WeakPolarHBondContact O-CB 3.36Å; A136-A140 PolarHBondContact O-N 2.78Å; S137-A140 PolarHBondContact O-N 3.43Å; R138-A140 VanDerWaalsContact C-N 3.27Å; R138-A140 PolarHBondContact O-N 3.22Å; A140-N143 CarbonylContact O-C 3.4Å; A140-N143 PolarHBondContact O-N 3.29Å; A140-E144 PolarHBondContact O-N 3.04Å; A140-L145 HydrophobicContact CB-CB 4.06Å; A140-L145 PolarHBondContact O-N 3.47Å; A140-F147 HydrophobicContact CB-CB 3.63Å; A140-F147 HydrophobicContact CB-CG 4.42Å
141	Q	97.9	Very high	98.2	Very high	152 Å²	152	59.1 Å²	59.1	71%	0.71	28%	0.284	S	S	*	.	H	α-helix	trans	-61.4	-48	178	-174.7	-179.1	13.4	0	0	112.1	S137 R138 N143 E144	S137-Q141 WeakPolarHBondContact O-CB 3.25Å; S137-Q141 PolarHBondContact O-N 3.26Å; R138-Q141 PolarHBondContact O-N 3.4Å; Q141-N143 PolarHBondContact O-N 2.9Å; Q141-E144 PolarHBondContact O-N 3.18Å; Q141-E144 VanDerWaalsContact O-N 3.13Å
142	E	98.1	Very high	98.1	Very high	124 Å²	124	59.3 Å²	59.3	58%	0.579	29%	0.285	S	S	*	.	H	α-helix	trans	-61.7	-24.3	178.9	-71.6	172.1	-179.2	0	0	112.4	R138	R138-E142 HydrophobicContact CG-CG 4.4Å; R138-E142 WeakPolarHBondContact CG-OE1 3.21Å; R138-E142 IonicContact CZ-OE1 3.89Å; R138-E142 IonicContact NE-OE1 3.82Å; R138-E142 PolarHBondContact NE-OE1 2.55Å; R138-E142 IonicContact NH2-OE1 3.9Å; R138-E142 WeakPolarHBondContact O-CG 3.43Å; R138-E142 PolarHBondContact O-N 2.95Å
143	N	97.1	Very high	98.1	Very high	39 Å²	39	60 Å²	60	21%	0.209	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	10.2	178.9	-72.7	-81.9	0	0	0	113.9	L103 R107 F139 A140 Q141 L145	L103-N143 HydrophobicContact CD2-CB 3.76Å; L103-N143 WeakPolarHBondContact CD2-OD1 3.27Å; R107-N143 PolarHBondContact NH2-O 3.33Å; F139-N143 WeakPolarHBondContact O-CB 3.49Å; F139-N143 PolarHBondContact O-N 3.16Å; F139-N143 VanDerWaalsContact O-N 3.14Å; F139-N143 PolarHBondContact O-ND2 2.92Å; A140-N143 CarbonylContact O-C 3.4Å; A140-N143 PolarHBondContact O-N 3.29Å; Q141-N143 PolarHBondContact O-N 2.9Å; N143-L145 VanDerWaalsContact C-N 3.26Å; N143-L145 HydrophobicContact CB-CD1 4.07Å; N143-L145 HydrophobicContact CB-CD2 4.49Å; N143-L145 HydrophobicContact CB-CG 3.84Å; N143-L145 WeakPolarHBondContact O-CD2 3.23Å; N143-L145 PolarHBondContact O-N 2.95Å
144	E	96.1	Very high	98	Very high	182 Å²	182	59 Å²	59	85%	0.85	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	35	179.7	-54.7	176	175.3	0	0	114.1	A140 Q141	A140-E144 PolarHBondContact O-N 3.04Å; Q141-E144 PolarHBondContact O-N 3.18Å; Q141-E144 VanDerWaalsContact O-N 3.13Å
145	L	97.4	Very high	98	Very high	19 Å²	19	53.8 Å²	53.8	10%	0.099	27%	0.268	C	S	.	.			trans	-99.2	148.6	177.9	-47	-177.2	0	0	0	110.2	L86 L103 I116 L118 F139 A140 N143	L86-L145 HydrophobicContact CD2-CD1 4.47Å; L103-L145 HydrophobicContact CD1-CD1 4.3Å; L103-L145 HydrophobicContact CD1-CD2 4.04Å; L103-L145 HydrophobicContact CD2-CD1 4.2Å; I116-L145 HydrophobicContact CB-CD2 3.9Å; I116-L145 HydrophobicContact CG2-CD2 4.08Å; L118-L145 HydrophobicContact CB-CB 4.47Å; L118-L145 HydrophobicContact CB-CD1 4.3Å; F139-L145 HydrophobicContact CE1-CD1 4.16Å; A140-L145 HydrophobicContact CB-CB 4.06Å; A140-L145 PolarHBondContact O-N 3.47Å; N143-L145 VanDerWaalsContact C-N 3.26Å; N143-L145 HydrophobicContact CB-CD1 4.07Å; N143-L145 HydrophobicContact CB-CD2 4.49Å; N143-L145 HydrophobicContact CB-CG 3.84Å; N143-L145 WeakPolarHBondContact O-CD2 3.23Å; N143-L145 PolarHBondContact O-N 2.95Å
146	M	97.3	Very high	98	Very high	56 Å²	56	54.8 Å²	54.8	28%	0.276	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	142.6	160.5	171.6	177.7	-84.8	0	0	108.8	I117 L118 Q164	I117-M146 CarbonylContact C-O 3.59Å; I117-M146 HydrophobicContact CD1-CB 3.74Å; I117-M146 HydrophobicContact CD1-CG 4.08Å; I117-M146 HydrophobicContact CD1-SD 3.83Å; L118-M146 PolarHBondContact N-O 3.36Å; M146-Q164 HydrophobicContact SD-CB 3.63Å; M146-Q164 HydrophobicContact SD-CG 3.99Å
147	F	98.6	Very high	98	Very high	26 Å²	26	57.5 Å²	57.5	11%	0.114	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.4	-177.4	172.5	-128.4	0	0	0	111.2	Y88 L118 F133 A136 A140 E149	Y88-F147 HydrophobicContact CE1-CE2 4.03Å; Y88-F147 WeakPolarHBondContact OH-CE2 3.44Å; Y88-F147 WeakPolarHBondContact OH-CZ 3.5Å; L118-F147 HydrophobicContact CB-CB 4.47Å; L118-F147 HydrophobicContact CB-CD2 4.11Å; L118-F147 HydrophobicContact CD2-CD2 3.74Å; L118-F147 HydrophobicContact CD2-CE2 4.3Å; L118-F147 HydrophobicContact CD2-CG 4.34Å; L118-F147 HydrophobicContact CG-CD2 3.78Å; L118-F147 HydrophobicContact CG-CE2 4.36Å; L118-F147 WeakPolarHBondContact O-CA 3.38Å; F133-F147 HydrophobicContact CD2-CD1 4.46Å; F133-F147 AromaticContact CD2-CE1 3.53Å; F133-F147 HydrophobicContact CD2-CE1 3.53Å; F133-F147 HydrophobicContact CD2-CZ 4.14Å; F133-F147 AromaticContact CE2-CD1 3.97Å; F133-F147 HydrophobicContact CE2-CD1 3.97Å; F133-F147 AromaticContact CE2-CE1 3.46Å; F133-F147 HydrophobicContact CE2-CE1 3.46Å; F133-F147 VanDerWaalsContact CE2-CE1 3.46Å; F133-F147 HydrophobicContact CE2-CZ 4.3Å; F133-F147 HydrophobicContact CG-CE1 4.13Å; F133-F147 HydrophobicContact CZ-CD1 4.17Å; F133-F147 HydrophobicContact CZ-CE1 4.01Å; A136-F147 HydrophobicContact CB-CE1 3.92Å; A136-F147 HydrophobicContact CB-CE2 3.95Å; A136-F147 HydrophobicContact CB-CZ 3.54Å; A140-F147 HydrophobicContact CB-CB 3.63Å; A140-F147 HydrophobicContact CB-CG 4.42Å; F147-E149 HydrophobicContact CE1-CG 4.36Å; F147-E149 HydrophobicContact CE2-CG 4.17Å; F147-E149 HydrophobicContact CZ-CG 3.62Å
148	L	98.6	Very high	98	Very high	34 Å²	34	55.7 Å²	55.7	18%	0.178	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	143.6	171.3	-65.4	170.5	0	0	0	108.9	I117 L118 C119 G120 E160 A161	I117-L148 HydrophobicContact CG2-CD1 4.31Å; L118-L148 PolarHBondContact O-N 3.34Å; C119-L148 CarbonylContact C-O 3.59Å; C119-L148 VanDerWaalsContact CA-O 3.28Å; C119-L148 WeakPolarHBondContact CA-O 3.15Å; G120-L148 PolarHBondContact N-O 3.23Å; L148-E160 HydrophobicContact CD1-CB 4.47Å; L148-E160 HydrophobicContact CD1-CG 4.2Å; L148-A161 HydrophobicContact CD1-CB 4.03Å
149	E	98.8	Very high	98	Very high	10 Å²	10	52.2 Å²	52.2	5%	0.047	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136	162	-66.8	-170.6	158.8	0	0	109.4	G120 K123 R129 F133 F147 N157	G120-E149 CarbonylContact O-C 3.59Å; G120-E149 WeakPolarHBondContact O-CA 3.29Å; K123-E149 HydrophobicContact CB-CB 4.43Å; K123-E149 HydrophobicContact CD-CB 3.75Å; K123-E149 HydrophobicContact CG-CB 4.22Å; R129-E149 IonicContact CZ-OE1 3.92Å; R129-E149 IonicContact CZ-OE2 2.75Å; R129-E149 IonicContact NH1-OE1 3.84Å; R129-E149 PolarHBondContact NH1-OE1 2.72Å; R129-E149 IonicContact NH1-OE2 2.72Å; R129-E149 IonicContact NH2-OE1 2.91Å; R129-E149 PolarHBondContact NH2-OE1 2.75Å; R129-E149 VanDerWaalsContact NH2-OE1 3.16Å; R129-E149 IonicContact NH2-OE2 2.65Å; R129-E149 PolarHBondContact NH2-OE2 3.35Å; F133-E149 HydrophobicContact CD2-CG 4.02Å; F133-E149 HydrophobicContact CE2-CG 4.43Å; F147-E149 HydrophobicContact CE1-CG 4.36Å; F147-E149 HydrophobicContact CE2-CG 4.17Å; F147-E149 HydrophobicContact CZ-CG 3.62Å; E149-N157 VanDerWaalsContact O-CB 3.31Å; E149-N157 WeakPolarHBondContact O-CB 3.38Å; E149-N157 PolarHBondContact O-ND2 3.19Å
150	T	98.8	Very high	98	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.			trans	-127.3	157.5	-173.5	58.4	0	0	0	0	111.1	C119 G120 N121 K122 K123 E156 N157 A161	C119-T150 HydrophobicContact CB-CG2 4.46Å; G120-T150 PolarHBondContact O-N 2.82Å; N121-T150 CarbonylContact C-O 3.53Å; N121-T150 VanDerWaalsContact CA-O 3.29Å; N121-T150 WeakPolarHBondContact CA-O 3.39Å; N121-T150 PolarHBondContact OD1-O 2.87Å; N121-T150 PolarHBondContact OD1-OG1 3.46Å; K122-T150 PolarHBondContact N-O 3.4Å; K123-T150 WeakPolarHBondContact CB-O 3.46Å; K123-T150 PolarHBondContact N-O 2.67Å; T150-E156 WeakPolarHBondContact CA-O 3.12Å; T150-N157 HydrophobicContact CG2-CB 3.96Å; T150-A161 HydrophobicContact CG2-CB 4.43Å
151	S	98.6	Very high	98	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.			trans	-132.5	108.9	168.5	167.3	0	0	0	0	108.5	D124 L153 T154 G155 E156 V158	D124-S151 WeakPolarHBondContact OD1-CB 3.13Å; D124-S151 PolarHBondContact OD1-OG 3.43Å; S151-L153 PolarHBondContact O-N 3.35Å; S151-L153 PolarHBondContact OG-N 2.94Å; S151-T154 WeakPolarHBondContact CB-OG1 3.4Å; S151-T154 PolarHBondContact OG-N 2.94Å; S151-T154 PolarHBondContact OG-OG1 2.92Å; S151-G155 CarbonylContact O-C 3.59Å; S151-G155 VanDerWaalsContact O-CA 3.26Å; S151-G155 WeakPolarHBondContact O-CA 3.33Å; S151-G155 PolarHBondContact O-N 3.17Å; S151-E156 PolarHBondContact N-O 2.98Å; S151-E156 PolarHBondContact O-N 3.47Å; S151-V158 WeakPolarHBondContact O-CG2 3.44Å
152	A	97.8	Very high	98	Very high	3 Å²	3	47.2 Å²	47.2	3%	0.025	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.9	172.3	0	0	0	0	0	112.1	C23 L24 Q27 F33 N121	C23-A152 HydrophobicContact CB-CB 3.67Å; L24-A152 HydrophobicContact CD2-CB 3.93Å; L24-A152 HydrophobicContact CG-CB 4.16Å; Q27-A152 VanDerWaalsContact CD-O 3.26Å; Q27-A152 VanDerWaalsContact CG-O 3.29Å; Q27-A152 WeakPolarHBondContact CG-O 3.34Å; Q27-A152 PolarHBondContact NE2-O 3.12Å; F33-A152 HydrophobicContact CD2-CB 4.3Å; F33-A152 WeakPolarHBondContact CD2-O 3.39Å; F33-A152 HydrophobicContact CE2-CB 4.29Å; N121-A152 PolarHBondContact OD1-N 3.38Å
153	L	97.2	Very high	98	Very high	86 Å²	86	42.1 Å²	42.1	45%	0.45	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-53	179.1	178.9	61.8	0	0	0	111.7	F33 D124 S151	F33-L153 HydrophobicContact CB-CD1 4.24Å; F33-L153 HydrophobicContact CD1-CD1 3.52Å; F33-L153 HydrophobicContact CD2-CB 4.3Å; F33-L153 HydrophobicContact CD2-CD1 4.32Å; F33-L153 HydrophobicContact CE1-CD1 3.86Å; F33-L153 HydrophobicContact CE2-CB 4.42Å; F33-L153 HydrophobicContact CG-CD1 3.77Å; F33-L153 HydrophobicContact CZ-CD1 4.4Å; D124-L153 HydrophobicContact CB-CD2 4.28Å; D124-L153 WeakPolarHBondContact OD2-CD2 3.36Å; S151-L153 PolarHBondContact O-N 3.35Å; S151-L153 PolarHBondContact OG-N 2.94Å
154	T	97.7	Very high	98.1	Very high	89 Å²	89	41.8 Å²	41.8	55%	0.546	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-22	-176.2	64.8	0	0	0	0	112.9	D124 S151 E156	D124-T154 HydrophobicContact CB-CG2 4.23Å; S151-T154 WeakPolarHBondContact CB-OG1 3.4Å; S151-T154 PolarHBondContact OG-N 2.94Å; S151-T154 PolarHBondContact OG-OG1 2.92Å; T154-E156 WeakPolarHBondContact OG1-CB 3.39Å; T154-E156 PolarHBondContact OG1-N 3.25Å
155	G	97.9	Very high	98.2	Very high	26 Å²	26	33.1 Å²	33.1	27%	0.268	18%	0.176	S	C	.	.			trans	87.8	-0.1	-171.7	0	0	0	0	0	114.3	Q27 S151 N157 V158	Q27-G155 VanDerWaalsContact NE2-N 3.13Å; S151-G155 CarbonylContact O-C 3.59Å; S151-G155 VanDerWaalsContact O-CA 3.26Å; S151-G155 WeakPolarHBondContact O-CA 3.33Å; S151-G155 PolarHBondContact O-N 3.17Å; G155-N157 PolarHBondContact O-N 2.97Å; G155-V158 PolarHBondContact O-N 3.23Å
156	E	98.6	Very high	98.2	Very high	77 Å²	77	32.2 Å²	32.2	36%	0.36	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	126.8	178.9	-168.7	-173.3	163	0	0	111.1	K123 T150 S151 T154 V158	K123-E156 IonicContact NZ-OE1 3.15Å; K123-E156 PolarHBondContact NZ-OE1 3.13Å; K123-E156 IonicContact NZ-OE2 3.1Å; T150-E156 WeakPolarHBondContact CA-O 3.12Å; S151-E156 PolarHBondContact N-O 2.98Å; S151-E156 PolarHBondContact O-N 3.47Å; T154-E156 WeakPolarHBondContact OG1-CB 3.39Å; T154-E156 PolarHBondContact OG1-N 3.25Å; E156-V158 PolarHBondContact O-N 3.14Å
157	N	98.4	Very high	98.2	Very high	57 Å²	57	33.5 Å²	33.5	31%	0.305	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	6.8	179	-60.5	-33.1	0	0	0	116.2	E149 T150 G155 E160 A161	E149-N157 VanDerWaalsContact O-CB 3.31Å; E149-N157 WeakPolarHBondContact O-CB 3.38Å; E149-N157 PolarHBondContact O-ND2 3.19Å; T150-N157 HydrophobicContact CG2-CB 3.96Å; G155-N157 PolarHBondContact O-N 2.97Å; N157-E160 PolarHBondContact O-N 2.7Å; N157-A161 PolarHBondContact O-N 2.65Å
158	V	98.5	Very high	98.1	Very high	4 Å²	4	36 Å²	36	2%	0.024	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-52.7	-179.3	177.5	0	0	0	0	110.4	L24 Q27 F28 S151 G155 E156 E160 A161 F162	L24-V158 HydrophobicContact CD2-CB 4.45Å; L24-V158 HydrophobicContact CD2-CG1 4.2Å; L24-V158 HydrophobicContact CD2-CG2 3.66Å; Q27-V158 HydrophobicContact CB-CG1 4.23Å; Q27-V158 HydrophobicContact CG-CB 4.33Å; Q27-V158 HydrophobicContact CG-CG1 4.13Å; Q27-V158 HydrophobicContact CG-CG2 4.06Å; F28-V158 HydrophobicContact CB-CG1 3.95Å; S151-V158 WeakPolarHBondContact O-CG2 3.44Å; G155-V158 PolarHBondContact O-N 3.23Å; E156-V158 PolarHBondContact O-N 3.14Å; V158-E160 VanDerWaalsContact C-N 3.33Å; V158-E160 PolarHBondContact O-N 3.44Å; V158-A161 PolarHBondContact O-N 3.08Å; V158-F162 HydrophobicContact CG1-CE2 4.33Å; V158-F162 VanDerWaalsContact O-CD2 3.22Å; V158-F162 WeakPolarHBondContact O-CD2 3.13Å
159	E	97.9	Very high	98	Very high	87 Å²	87	34.4 Å²	34.4	41%	0.407	18%	0.175	S	C	.	.	H	α-helix	trans	-64	-40.3	177.4	178.5	159.8	-150.8	0	0	112.2	F28 K31 A161 F162 V163	F28-E159 HydrophobicContact CE2-CG 4.37Å; K31-E159 IonicContact NZ-OE1 2.61Å; K31-E159 IonicContact NZ-OE2 2.67Å; K31-E159 PolarHBondContact NZ-OE2 3.07Å; E159-A161 VanDerWaalsContact C-N 3.3Å; E159-A161 PolarHBondContact O-N 3.34Å; E159-F162 PolarHBondContact O-N 2.87Å; E159-V163 HydrophobicContact CG-CG2 3.99Å; E159-V163 WeakPolarHBondContact O-CB 3.17Å; E159-V163 WeakPolarHBondContact O-CG2 3.36Å; E159-V163 PolarHBondContact O-N 2.95Å
160	E	98.3	Very high	97.9	Very high	71 Å²	71	34.1 Å²	34.1	33%	0.332	17%	0.174	S	C	.	.	H	α-helix	trans	-59.5	-40.3	179.8	-169	60.9	-157.8	0	0	111.7	L148 N157 V158 F162 V163 Q164	L148-E160 HydrophobicContact CD1-CB 4.47Å; L148-E160 HydrophobicContact CD1-CG 4.2Å; N157-E160 PolarHBondContact O-N 2.7Å; V158-E160 VanDerWaalsContact C-N 3.33Å; V158-E160 PolarHBondContact O-N 3.44Å; E160-F162 PolarHBondContact O-N 3.1Å; E160-V163 PolarHBondContact O-N 2.99Å; E160-Q164 HydrophobicContact CG-CG 4.03Å; E160-Q164 VanDerWaalsContact O-CB 3.25Å; E160-Q164 WeakPolarHBondContact O-CB 3.27Å; E160-Q164 VanDerWaalsContact O-CG 3.23Å; E160-Q164 WeakPolarHBondContact O-CG 3.3Å; E160-Q164 PolarHBondContact O-N 3.22Å; E160-Q164 WeakPolarHBondContact OE1-CG 3.48Å; E160-Q164 PolarHBondContact OE1-NE2 2.83Å
161	A	98.5	Very high	97.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-44.8	177.6	0	0	0	0	0	112.8	L85 I117 L148 T150 N157 V158 E159 C165	L85-A161 HydrophobicContact CD2-CB 3.98Å; I117-A161 HydrophobicContact CG2-CB 4.45Å; L148-A161 HydrophobicContact CD1-CB 4.03Å; T150-A161 HydrophobicContact CG2-CB 4.43Å; N157-A161 PolarHBondContact O-N 2.65Å; V158-A161 PolarHBondContact O-N 3.08Å; E159-A161 VanDerWaalsContact C-N 3.3Å; E159-A161 PolarHBondContact O-N 3.34Å; A161-C165 WeakPolarHBondContact O-CB 3.48Å; A161-C165 PolarHBondContact O-N 2.99Å
162	F	98.4	Very high	97.5	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-71	-42.2	177.7	-70.6	-82.3	0	0	0	112.1	F11 V13 F28 L59 I61 L85 V158 E159 E160 C165 A166	F11-F162 HydrophobicContact CD2-CD1 4.06Å; F11-F162 HydrophobicContact CE2-CD1 4.38Å; V13-F162 HydrophobicContact CG2-CE1 4.41Å; V13-F162 HydrophobicContact CG2-CZ 4.42Å; F28-F162 HydrophobicContact CB-CD2 3.8Å; F28-F162 HydrophobicContact CB-CE2 3.54Å; F28-F162 HydrophobicContact CB-CZ 4.26Å; F28-F162 HydrophobicContact CD1-CD1 4.21Å; F28-F162 AromaticContact CD1-CD2 3.85Å; F28-F162 HydrophobicContact CD1-CD2 3.85Å; F28-F162 HydrophobicContact CD1-CE1 4.36Å; F28-F162 HydrophobicContact CD1-CE2 4.04Å; F28-F162 AromaticContact CD1-CG 3.96Å; F28-F162 HydrophobicContact CD1-CG 3.96Å; F28-F162 HydrophobicContact CD1-CZ 4.28Å; F28-F162 HydrophobicContact CD2-CB 4.13Å; F28-F162 AromaticContact CD2-CD2 3.51Å; F28-F162 HydrophobicContact CD2-CD2 3.51Å; F28-F162 HydrophobicContact CD2-CE2 4.18Å; F28-F162 AromaticContact CD2-CG 3.98Å; F28-F162 HydrophobicContact CD2-CG 3.98Å; F28-F162 HydrophobicContact CE1-CB 4.18Å; F28-F162 HydrophobicContact CE1-CD1 4.19Å; F28-F162 HydrophobicContact CE1-CD2 4.29Å; F28-F162 AromaticContact CE1-CG 3.96Å; F28-F162 HydrophobicContact CE1-CG 3.96Å; F28-F162 HydrophobicContact CE2-CB 3.69Å; F28-F162 AromaticContact CE2-CD2 3.99Å; F28-F162 HydrophobicContact CE2-CD2 3.99Å; F28-F162 AromaticContact CE2-CG 4Å; F28-F162 HydrophobicContact CE2-CG 4Å; F28-F162 AromaticContact CG-CD2 3.43Å; F28-F162 HydrophobicContact CG-CD2 3.43Å; F28-F162 VanDerWaalsContact CG-CD2 3.43Å; F28-F162 AromaticContact CG-CE2 3.66Å; F28-F162 HydrophobicContact CG-CE2 3.66Å; F28-F162 AromaticContact CG-CG 3.96Å; F28-F162 HydrophobicContact CG-CG 3.96Å; F28-F162 HydrophobicContact CG-CZ 4.33Å; F28-F162 HydrophobicContact CZ-CB 3.71Å; F28-F162 HydrophobicContact CZ-CD2 4.34Å; F28-F162 AromaticContact CZ-CG 3.98Å; F28-F162 HydrophobicContact CZ-CG 3.98Å; L59-F162 HydrophobicContact CD1-CB 4.17Å; L59-F162 HydrophobicContact CD1-CD1 4.45Å; I61-F162 HydrophobicContact CD1-CD1 3.97Å; I61-F162 HydrophobicContact CD1-CE1 3.76Å; I61-F162 HydrophobicContact CG1-CE1 4.39Å; I61-F162 HydrophobicContact CG2-CE1 4.17Å; L85-F162 HydrophobicContact CD1-CD1 3.99Å; L85-F162 HydrophobicContact CD1-CE1 4.03Å; L85-F162 HydrophobicContact CD2-CD1 4.19Å; L85-F162 HydrophobicContact CD2-CD2 4.14Å; L85-F162 HydrophobicContact CD2-CE1 3.81Å; L85-F162 HydrophobicContact CD2-CE2 3.74Å; L85-F162 HydrophobicContact CD2-CG 4.35Å; L85-F162 HydrophobicContact CD2-CZ 3.57Å; V158-F162 HydrophobicContact CG1-CE2 4.33Å; V158-F162 VanDerWaalsContact O-CD2 3.22Å; V158-F162 WeakPolarHBondContact O-CD2 3.13Å; E159-F162 PolarHBondContact O-N 2.87Å; E160-F162 PolarHBondContact O-N 3.1Å; F162-C165 PolarHBondContact O-N 3.28Å; F162-A166 PolarHBondContact O-N 3.1Å
163	V	98.1	Very high	97.2	Very high	17 Å²	17	41.8 Å²	41.8	10%	0.103	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-42.7	-180	169.5	0	0	0	0	111.3	I50 V52 E159 E160 A166 R167	I50-V163 HydrophobicContact CD1-CG2 4.14Å; V52-V163 HydrophobicContact CG2-CG1 4.41Å; E159-V163 HydrophobicContact CG-CG2 3.99Å; E159-V163 WeakPolarHBondContact O-CB 3.17Å; E159-V163 WeakPolarHBondContact O-CG2 3.36Å; E159-V163 PolarHBondContact O-N 2.95Å; E160-V163 PolarHBondContact O-N 2.99Å; V163-A166 PolarHBondContact O-N 2.96Å; V163-R167 WeakPolarHBondContact O-CB 3.46Å; V163-R167 PolarHBondContact O-N 3.3Å
164	Q	98.1	Very high	96.9	Very high	32 Å²	32	43.7 Å²	43.7	15%	0.15	22%	0.218	C	C	.	.	H	α-helix	trans	-66.7	-38.3	178.4	-74.5	-70.7	-7.9	0	0	112.3	M146 E160 R167 K168	M146-Q164 HydrophobicContact SD-CB 3.63Å; M146-Q164 HydrophobicContact SD-CG 3.99Å; E160-Q164 HydrophobicContact CG-CG 4.03Å; E160-Q164 VanDerWaalsContact O-CB 3.25Å; E160-Q164 WeakPolarHBondContact O-CB 3.27Å; E160-Q164 VanDerWaalsContact O-CG 3.23Å; E160-Q164 WeakPolarHBondContact O-CG 3.3Å; E160-Q164 PolarHBondContact O-N 3.22Å; E160-Q164 WeakPolarHBondContact OE1-CG 3.48Å; E160-Q164 PolarHBondContact OE1-NE2 2.83Å; Q164-R167 PolarHBondContact O-N 3.07Å; Q164-K168 WeakPolarHBondContact O-CB 3.29Å; Q164-K168 WeakPolarHBondContact O-CG 3.24Å; Q164-K168 PolarHBondContact O-N 3.42Å
165	C	98.3	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-49.4	172.4	-166.3	0	0	0	0	110.7	F11 L85 I117 A161 F162 R167 K168 I169	F11-C165 HydrophobicContact CE2-CB 3.59Å; F11-C165 HydrophobicContact CZ-CB 3.76Å; F11-C165 VanDerWaalsContact CZ-SG 3.56Å; L85-C165 HydrophobicContact CD1-CB 4.49Å; I117-C165 HydrophobicContact CD1-CB 4.24Å; I117-C165 HydrophobicContact CG1-CB 3.57Å; A161-C165 WeakPolarHBondContact O-CB 3.48Å; A161-C165 PolarHBondContact O-N 2.99Å; F162-C165 PolarHBondContact O-N 3.28Å; C165-R167 PolarHBondContact O-N 2.86Å; C165-K168 PolarHBondContact O-N 2.95Å; C165-I169 WeakPolarHBondContact O-CG1 3.45Å; C165-I169 PolarHBondContact O-N 2.98Å; C165-I169 VanDerWaalsContact O-N 3.1Å
166	A	97.9	Very high	96.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-41.3	179.2	0	0	0	0	0	112.4	F9 F11 I50 V52 L59 F162 V163 I169 L170	F9-A166 HydrophobicContact CD2-CB 4.25Å; F9-A166 HydrophobicContact CE2-CB 4.29Å; F11-A166 HydrophobicContact CZ-CB 4.12Å; I50-A166 HydrophobicContact CD1-CB 3.96Å; V52-A166 HydrophobicContact CG2-CB 4.13Å; L59-A166 HydrophobicContact CD2-CB 4.22Å; F162-A166 PolarHBondContact O-N 3.1Å; V163-A166 PolarHBondContact O-N 2.96Å; A166-I169 PolarHBondContact O-N 2.77Å; A166-L170 PolarHBondContact O-N 3.41Å
167	R	97.7	Very high	95.8	Very high	83 Å²	83	47 Å²	47	31%	0.313	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-45.3	176.5	-172.9	-177.7	-63.8	159.7	3.5	111.6	V52 V53 V163 Q164 C165 I169 L170 N171	V52-R167 HydrophobicContact CG1-CB 3.72Å; V52-R167 HydrophobicContact CG1-CG 4.19Å; V53-R167 HydrophobicContact CG2-CG 4.09Å; V163-R167 WeakPolarHBondContact O-CB 3.46Å; V163-R167 PolarHBondContact O-N 3.3Å; Q164-R167 PolarHBondContact O-N 3.07Å; C165-R167 PolarHBondContact O-N 2.86Å; R167-I169 VanDerWaalsContact C-N 3.32Å; R167-I169 PolarHBondContact O-N 2.94Å; R167-L170 PolarHBondContact O-N 3.46Å; R167-N171 VanDerWaalsContact O-CG 3.25Å; R167-N171 PolarHBondContact O-N 3.39Å; R167-N171 PolarHBondContact O-OD1 2.89Å
168	K	96.8	Very high	95.3	Very high	79 Å²	79	45.2 Å²	45.2	34%	0.343	24%	0.236	S	C	.	.	H	α-helix	trans	-61.3	-40.1	176.5	-83	178.3	175.2	-80.9	0	112.2	V115 I117 Q164 C165 N171 K172	V115-K168 HydrophobicContact CG1-CB 3.61Å; V115-K168 HydrophobicContact CG1-CD 3.94Å; V115-K168 HydrophobicContact CG1-CG 4.45Å; V115-K168 HydrophobicContact CG2-CB 4.42Å; I117-K168 HydrophobicContact CD1-CD 4.18Å; Q164-K168 WeakPolarHBondContact O-CB 3.29Å; Q164-K168 WeakPolarHBondContact O-CG 3.24Å; Q164-K168 PolarHBondContact O-N 3.42Å; C165-K168 PolarHBondContact O-N 2.95Å; K168-N171 PolarHBondContact O-N 3.48Å; K168-K172 WeakPolarHBondContact O-CG 3.24Å; K168-K172 PolarHBondContact O-N 2.77Å; K168-K172 VanDerWaalsContact O-N 3.09Å
169	I	96.4	Very high	94.7	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-46.3	175.6	-66	163.6	0	0	0	110.4	F9 F11 A82 V115 C165 A166 R167 N171 K172 I173 L178 I187	F9-I169 HydrophobicContact CD1-CG2 4.21Å; F9-I169 HydrophobicContact CD2-CB 4.4Å; F9-I169 HydrophobicContact CD2-CD1 4.27Å; F9-I169 HydrophobicContact CD2-CG2 4.19Å; F9-I169 HydrophobicContact CE1-CG2 3.86Å; F9-I169 HydrophobicContact CE2-CB 4.03Å; F9-I169 HydrophobicContact CE2-CG2 3.84Å; F9-I169 HydrophobicContact CG-CG2 4.39Å; F9-I169 HydrophobicContact CZ-CB 4.31Å; F9-I169 HydrophobicContact CZ-CG2 3.67Å; F11-I169 HydrophobicContact CD1-CD1 4.44Å; F11-I169 HydrophobicContact CE1-CD1 3.41Å; F11-I169 VanDerWaalsContact CE1-CD1 3.41Å; F11-I169 HydrophobicContact CZ-CD1 3.85Å; A82-I169 HydrophobicContact CB-CD1 3.99Å; V115-I169 HydrophobicContact CB-CD1 4.34Å; V115-I169 HydrophobicContact CB-CG1 3.77Å; V115-I169 HydrophobicContact CG1-CG1 4.34Å; V115-I169 HydrophobicContact CG2-CG1 3.61Å; C165-I169 WeakPolarHBondContact O-CG1 3.45Å; C165-I169 PolarHBondContact O-N 2.98Å; C165-I169 VanDerWaalsContact O-N 3.1Å; A166-I169 PolarHBondContact O-N 2.77Å; R167-I169 VanDerWaalsContact C-N 3.32Å; R167-I169 PolarHBondContact O-N 2.94Å; I169-N171 PolarHBondContact O-N 3.32Å; I169-K172 WeakPolarHBondContact O-CB 3.23Å; I169-K172 PolarHBondContact O-N 3.23Å; I169-I173 HydrophobicContact CG2-CD1 4.09Å; I169-I173 WeakPolarHBondContact O-CG1 3.47Å; I169-I173 PolarHBondContact O-N 3.32Å; I169-L178 HydrophobicContact CG2-CD1 4.36Å; I169-I187 HydrophobicContact CG2-CD1 3.9Å; I169-I187 HydrophobicContact CG2-CG1 4.27Å
170	L	95.6	Very high	94.1	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-57.8	-46.4	175.9	-75.7	170	0	0	0	112.2	F7 F9 V52 K55 V57 A166 R167 K172 I173 E174	F7-L170 HydrophobicContact CD2-CD2 3.67Å; F7-L170 HydrophobicContact CE2-CD2 3.72Å; F7-L170 HydrophobicContact CG-CD2 4.26Å; F7-L170 HydrophobicContact CZ-CD2 4.34Å; F9-L170 HydrophobicContact CE2-CD2 4.38Å; F9-L170 HydrophobicContact CE2-CG 4.06Å; F9-L170 HydrophobicContact CZ-CD2 3.76Å; F9-L170 HydrophobicContact CZ-CG 3.89Å; V52-L170 HydrophobicContact CB-CD1 3.85Å; V52-L170 HydrophobicContact CG1-CD1 3.74Å; K55-L170 HydrophobicContact CB-CD1 4.36Å; V57-L170 HydrophobicContact CG2-CD1 4.01Å; A166-L170 PolarHBondContact O-N 3.41Å; R167-L170 PolarHBondContact O-N 3.46Å; L170-K172 VanDerWaalsContact C-N 3.27Å; L170-K172 PolarHBondContact O-N 3.26Å; L170-I173 WeakPolarHBondContact O-CA 2.89Å; L170-I173 WeakPolarHBondContact O-CB 3.33Å; L170-I173 PolarHBondContact O-N 3.32Å; L170-E174 WeakPolarHBondContact O-CG 3.34Å; L170-E174 PolarHBondContact O-N 2.92Å
171	N	94.9	Very high	93.4	Very high	79 Å²	79	49.2 Å²	49.2	42%	0.422	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-37.1	177.9	-67.1	0.5	0	0	0	112.3	R167 K168 I169 I173 E174 S175	R167-N171 VanDerWaalsContact O-CG 3.25Å; R167-N171 PolarHBondContact O-N 3.39Å; R167-N171 PolarHBondContact O-OD1 2.89Å; K168-N171 PolarHBondContact O-N 3.48Å; I169-N171 PolarHBondContact O-N 3.32Å; N171-I173 VanDerWaalsContact C-N 3.34Å; N171-E174 PolarHBondContact O-N 2.98Å; N171-S175 WeakPolarHBondContact O-CB 3.39Å; N171-S175 PolarHBondContact O-N 2.77Å; N171-S175 PolarHBondContact O-OG 3.24Å
172	K	93.6	Very high	92.7	Very high	58 Å²	58	57 Å²	57	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-68.2	-32.5	174.3	-74.8	-167.4	172.4	-166.5	0	112.8	V115 K168 I169 L170 S175 G176 E177 L178	V115-K172 HydrophobicContact CG2-CD 3.99Å; K168-K172 WeakPolarHBondContact O-CG 3.24Å; K168-K172 PolarHBondContact O-N 2.77Å; K168-K172 VanDerWaalsContact O-N 3.09Å; I169-K172 WeakPolarHBondContact O-CB 3.23Å; I169-K172 PolarHBondContact O-N 3.23Å; L170-K172 VanDerWaalsContact C-N 3.27Å; L170-K172 PolarHBondContact O-N 3.26Å; K172-S175 WeakPolarHBondContact CA-OG 3.22Å; K172-S175 PolarHBondContact O-OG 3.32Å; K172-G176 PolarHBondContact O-N 3.23Å; K172-E177 HydrophobicContact CB-CB 4.21Å; K172-E177 HydrophobicContact CG-CB 4.39Å; K172-E177 PolarHBondContact O-N 3.17Å; K172-L178 HydrophobicContact CB-CB 4.03Å; K172-L178 HydrophobicContact CB-CD1 3.67Å; K172-L178 HydrophobicContact CB-CG 3.77Å; K172-L178 HydrophobicContact CD-CD1 3.79Å; K172-L178 HydrophobicContact CD-CG 4.05Å; K172-L178 HydrophobicContact CG-CD1 4.39Å; K172-L178 PolarHBondContact O-N 3.37Å
173	I	92.4	Very high	91.7	Very high	26 Å²	26	65.9 Å²	65.9	13%	0.133	33%	0.331	C	S	.	.	H	α-helix	trans	-68.1	-47.1	172.6	-64.3	164.7	0	0	0	110.1	F7 F9 I169 L170 N171 S175 G176 L178 P180 I187	F7-I173 HydrophobicContact CD1-CD1 4.45Å; F7-I173 HydrophobicContact CE1-CD1 4.32Å; F9-I173 HydrophobicContact CE1-CD1 3.92Å; F9-I173 HydrophobicContact CZ-CD1 4.01Å; I169-I173 HydrophobicContact CG2-CD1 4.09Å; I169-I173 WeakPolarHBondContact O-CG1 3.47Å; I169-I173 PolarHBondContact O-N 3.32Å; L170-I173 WeakPolarHBondContact O-CA 2.89Å; L170-I173 WeakPolarHBondContact O-CB 3.33Å; L170-I173 PolarHBondContact O-N 3.32Å; N171-I173 VanDerWaalsContact C-N 3.34Å; I173-S175 VanDerWaalsContact C-N 3.31Å; I173-S175 PolarHBondContact O-N 2.81Å; I173-G176 PolarHBondContact O-N 2.91Å; I173-G176 VanDerWaalsContact O-N 3.08Å; I173-L178 WeakPolarHBondContact CA-O 3.35Å; I173-L178 HydrophobicContact CG1-CB 4.2Å; I173-P180 HydrophobicContact CD1-CG 4.19Å; I173-P180 HydrophobicContact CG1-CG 4.11Å; I173-P180 HydrophobicContact CG2-CG 3.71Å; I173-I187 HydrophobicContact CD1-CD1 3.97Å; I173-I187 HydrophobicContact CD1-CG2 4.14Å; I173-I187 HydrophobicContact CG1-CD1 4.17Å
174	E	91.4	Very high	90.8	Very high	127 Å²	127	67.2 Å²	67.2	59%	0.593	35%	0.347	S	S	*	.	H	α-helix	trans	-65.2	-33.4	-177.9	-71.2	177.4	173.7	0	0	113.1	L170 N171 G176	L170-E174 WeakPolarHBondContact O-CG 3.34Å; L170-E174 PolarHBondContact O-N 2.92Å; N171-E174 PolarHBondContact O-N 2.98Å; E174-G176 VanDerWaalsContact C-N 3.33Å
175	S	92.8	Very high	90	Very high	74 Å²	74	66.7 Å²	66.7	52%	0.517	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-9.8	174.4	53.2	0	0	0	0	114.1	N171 K172 I173 E177	N171-S175 WeakPolarHBondContact O-CB 3.39Å; N171-S175 PolarHBondContact O-N 2.77Å; N171-S175 PolarHBondContact O-OG 3.24Å; K172-S175 WeakPolarHBondContact CA-OG 3.22Å; K172-S175 PolarHBondContact O-OG 3.32Å; I173-S175 VanDerWaalsContact C-N 3.31Å; I173-S175 PolarHBondContact O-N 2.81Å; S175-E177 VanDerWaalsContact C-N 3.34Å
176	G	89	Confident	89.3	Confident	61 Å²	61	67.4 Å²	67.4	63%	0.629	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	6.6	-177.4	0	0	0	0	0	115.2	K172 I173 E174 L178	K172-G176 PolarHBondContact O-N 3.23Å; I173-G176 PolarHBondContact O-N 2.91Å; I173-G176 VanDerWaalsContact O-N 3.08Å; E174-G176 VanDerWaalsContact C-N 3.33Å; G176-L178 VanDerWaalsContact C-N 3.31Å
177	E	88.6	Confident	88.9	Confident	125 Å²	125	67.8 Å²	67.8	58%	0.584	36%	0.357	S	S	*	.	S	Bend	trans	-68.4	-31.2	173.5	-68.2	-179.2	-164.5	0	0	112.7	K172 S175	K172-E177 HydrophobicContact CB-CB 4.21Å; K172-E177 HydrophobicContact CG-CB 4.39Å; K172-E177 PolarHBondContact O-N 3.17Å; S175-E177 VanDerWaalsContact C-N 3.34Å
178	L	87.6	Confident	88.5	Confident	21 Å²	21	69.3 Å²	69.3	11%	0.11	37%	0.367	C	S	.	.	S	Bend	trans	-119.3	117.8	174.8	-75.4	179.9	0	0	0	110.3	N113 I169 K172 I173 G176 P180 I187	N113-L178 HydrophobicContact CB-CD2 3.82Å; I169-L178 HydrophobicContact CG2-CD1 4.36Å; K172-L178 HydrophobicContact CB-CB 4.03Å; K172-L178 HydrophobicContact CB-CD1 3.67Å; K172-L178 HydrophobicContact CB-CG 3.77Å; K172-L178 HydrophobicContact CD-CD1 3.79Å; K172-L178 HydrophobicContact CD-CG 4.05Å; K172-L178 HydrophobicContact CG-CD1 4.39Å; K172-L178 PolarHBondContact O-N 3.37Å; I173-L178 WeakPolarHBondContact CA-O 3.35Å; I173-L178 HydrophobicContact CG1-CB 4.2Å; G176-L178 VanDerWaalsContact C-N 3.31Å; L178-P180 WeakPolarHBondContact O-CD 3.35Å; L178-I187 HydrophobicContact CB-CD1 4.48Å; L178-I187 HydrophobicContact CD1-CD1 4.35Å
179	D	86.3	Confident	88.1	Confident	83 Å²	83	68.9 Å²	68.9	44%	0.444	36%	0.364	S	S	.	.			trans	-89.1	116.5	170.2	177.4	8.4	0	0	0	110.1	E181 R182	D179-E181 PolarHBondContact O-N 2.66Å; D179-E181 PolarHBondContact OD1-N 3.2Å; D179-R182 HydrophobicContact CB-CB 4.15Å; D179-R182 WeakPolarHBondContact O-CB 3.39Å; D179-R182 PolarHBondContact O-N 3.26Å
180	P	85.4	Confident	87.4	Confident	12 Å²	12	69 Å²	69	8%	0.078	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-33.7	174	-28.5	38.9	0	0	0	114.1	I173 L178 R182 S185 I187 Y189	I173-P180 HydrophobicContact CD1-CG 4.19Å; I173-P180 HydrophobicContact CG1-CG 4.11Å; I173-P180 HydrophobicContact CG2-CG 3.71Å; L178-P180 WeakPolarHBondContact O-CD 3.35Å; P180-R182 VanDerWaalsContact C-N 3.32Å; P180-S185 PolarHBondContact O-OG 3.21Å; P180-I187 HydrophobicContact CB-CB 4.39Å; P180-I187 HydrophobicContact CB-CG2 3.77Å; P180-I187 HydrophobicContact CG-CG2 4.2Å; P180-Y189 HydrophobicContact CB-CE2 3.89Å; P180-Y189 HydrophobicContact CG-CE2 4.5Å
181	E	83.8	Confident	86.6	Confident	151 Å²	151	72.5 Å²	72.5	71%	0.706	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.4	-175.2	-58.7	-166.9	150.1	0	0	113	D179 M183 Y189	D179-E181 PolarHBondContact O-N 2.66Å; D179-E181 PolarHBondContact OD1-N 3.2Å; E181-M183 PolarHBondContact O-N 3.36Å; E181-Y189 HydrophobicContact CG-CE2 4.12Å
182	R	83.6	Confident	85.5	Confident	164 Å²	164	69.7 Å²	69.7	62%	0.619	37%	0.372	S	S	*	.	S	Bend	trans	-60.8	124.2	176.7	-177.4	176.6	175.7	175.4	-0.2	110.3	D179 P180 G184 S185	D179-R182 HydrophobicContact CB-CB 4.15Å; D179-R182 WeakPolarHBondContact O-CB 3.39Å; D179-R182 PolarHBondContact O-N 3.26Å; P180-R182 VanDerWaalsContact C-N 3.32Å; R182-G184 PolarHBondContact O-N 2.88Å; R182-S185 VanDerWaalsContact O-CB 3.23Å; R182-S185 WeakPolarHBondContact O-CB 3.46Å; R182-S185 PolarHBondContact O-N 3.09Å; R182-S185 PolarHBondContact O-OG 3.1Å
183	M	78	Confident	84.3	Confident	188 Å²	188	67.4 Å²	67.4	93%	0.926	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	126.9	175.6	-86.6	-137.5	-88.4	0	0	111.6	E181	E181-M183 PolarHBondContact O-N 3.36Å
184	G	78.1	Confident	83.1	Confident	44 Å²	44	69.2 Å²	69.2	45%	0.454	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	14.2	-178.6	0	0	0	0	0	115	G80 R182 G186	G80-G184 WeakPolarHBondContact CA-O 3.46Å; R182-G184 PolarHBondContact O-N 2.88Å; G184-G186 PolarHBondContact O-N 3.25Å
185	S	82.5	Confident	82	Confident	21 Å²	21	71.8 Å²	71.8	15%	0.147	38%	0.377	C	S	.	.			trans	-63.9	-26.8	173.1	63.4	0	0	0	0	113.5	P180 R182 I187	P180-S185 PolarHBondContact O-OG 3.21Å; R182-S185 VanDerWaalsContact O-CB 3.23Å; R182-S185 WeakPolarHBondContact O-CB 3.46Å; R182-S185 PolarHBondContact O-N 3.09Å; R182-S185 PolarHBondContact O-OG 3.1Å; S185-I187 PolarHBondContact O-N 2.78Å; S185-I187 PolarHBondContact OG-N 3.17Å; S185-I187 VanDerWaalsContact OG-N 3.16Å; S185-I187 PolarHBondContact OG-O 3.18Å
186	G	83.1	Confident	80.7	Confident	15 Å²	15	74.1 Å²	74.1	16%	0.155	38%	0.38	C	S	.	.	S	Bend	trans	75.2	12.4	-171.3	0	0	0	0	0	114.5	K10 G80 G184	K10-G186 PolarHBondContact N-O 2.87Å; G80-G186 WeakPolarHBondContact O-CA 3.47Å; G184-G186 PolarHBondContact O-N 3.25Å
187	I	89.4	Confident	79.4	Confident	8 Å²	8	76.5 Å²	76.5	4%	0.041	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.2	-178.1	-59.8	160	0	0	0	108.1	F7 L8 F9 A82 I169 I173 L178 P180 S185	F7-I187 HydrophobicContact CD1-CG2 4.31Å; L8-I187 CarbonylContact O-C 3.34Å; L8-I187 WeakPolarHBondContact O-CA 3.14Å; F9-I187 HydrophobicContact CD1-CB 4.26Å; F9-I187 HydrophobicContact CD1-CG1 3.86Å; F9-I187 HydrophobicContact CD1-CG2 3.9Å; F9-I187 HydrophobicContact CE1-CB 4.41Å; F9-I187 HydrophobicContact CE1-CG1 4.06Å; F9-I187 HydrophobicContact CE1-CG2 3.67Å; A82-I187 HydrophobicContact CB-CD1 4.4Å; A82-I187 HydrophobicContact CB-CG1 3.79Å; I169-I187 HydrophobicContact CG2-CD1 3.9Å; I169-I187 HydrophobicContact CG2-CG1 4.27Å; I173-I187 HydrophobicContact CD1-CD1 3.97Å; I173-I187 HydrophobicContact CD1-CG2 4.14Å; I173-I187 HydrophobicContact CG1-CD1 4.17Å; L178-I187 HydrophobicContact CB-CD1 4.48Å; L178-I187 HydrophobicContact CD1-CD1 4.35Å; P180-I187 HydrophobicContact CB-CB 4.39Å; P180-I187 HydrophobicContact CB-CG2 3.77Å; P180-I187 HydrophobicContact CG-CG2 4.2Å; S185-I187 PolarHBondContact O-N 2.78Å; S185-I187 PolarHBondContact OG-N 3.17Å; S185-I187 VanDerWaalsContact OG-N 3.16Å; S185-I187 PolarHBondContact OG-O 3.18Å
188	Q	88.9	Confident	77.9	Confident	116 Å²	116	80.1 Å²	80.1	54%	0.542	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.9	171.8	-59.4	176	1.1	0	0	109.8	F7 L8	F7-Q188 CarbonylContact C-O 3.59Å; F7-Q188 WeakPolarHBondContact CA-O 3.25Å; L8-Q188 HydrophobicContact CB-CB 4.26Å; L8-Q188 HydrophobicContact CD2-CB 4.44Å; L8-Q188 HydrophobicContact CD2-CG 4.41Å; L8-Q188 PolarHBondContact N-O 3.02Å; L8-Q188 PolarHBondContact O-N 3.01Å
189	Y	88.3	Confident	76	Confident	70 Å²	70	82.9 Å²	82.9	28%	0.275	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	135.1	166.7	-68.7	-68.8	0	0	0	109.9	F7 P180 E181 A193 L197	F7-Y189 HydrophobicContact CD1-CD1 4.15Å; F7-Y189 HydrophobicContact CD1-CE1 4.31Å; F7-Y189 AromaticContact CE1-CD1 3.77Å; F7-Y189 HydrophobicContact CE1-CD1 3.77Å; F7-Y189 AromaticContact CE1-CE1 3.52Å; F7-Y189 HydrophobicContact CE1-CE1 3.52Å; F7-Y189 HydrophobicContact CZ-CD1 4.49Å; F7-Y189 HydrophobicContact CZ-CE1 4.15Å; P180-Y189 HydrophobicContact CB-CE2 3.89Å; P180-Y189 HydrophobicContact CG-CE2 4.5Å; E181-Y189 HydrophobicContact CG-CE2 4.12Å; Y189-A193 HydrophobicContact CD1-CB 3.73Å; Y189-A193 HydrophobicContact CG-CB 4.39Å; Y189-L197 HydrophobicContact CD1-CD1 4.42Å; Y189-L197 HydrophobicContact CD2-CD1 4.35Å; Y189-L197 HydrophobicContact CE1-CD1 4.4Å; Y189-L197 HydrophobicContact CE2-CD1 4.35Å; Y189-L197 HydrophobicContact CG-CD1 4.38Å
190	G	81.8	Confident	74.1	Confident	1 Å²	1	84.5 Å²	84.5	1%	0.01	42%	0.422	C	S	.	.			trans	-85	173.9	170.3	0	0	0	0	0	112.7	Y5 D6 A192 A193 L194	Y5-G190 CarbonylContact O-C 3.59Å; Y5-G190 VanDerWaalsContact O-CA 3.25Å; Y5-G190 WeakPolarHBondContact O-CA 3.21Å; D6-G190 PolarHBondContact O-N 3.33Å; G190-A192 PolarHBondContact O-N 3.27Å; G190-A192 VanDerWaalsContact O-N 3.15Å; G190-A193 PolarHBondContact O-N 3.45Å; G190-L194 WeakPolarHBondContact O-CG 3.35Å; G190-L194 PolarHBondContact O-N 2.99Å
191	D	78.4	Confident	72.3	Confident	78 Å²	78	95.6 Å²	95.6	42%	0.417	46%	0.463	S	S	.	.	H	α-helix	trans	-56.8	-32.8	-176.8	-65.5	-33.4	0	0	0	113	Y5 R195	Y5-D191 PolarHBondContact O-N 3.38Å; D191-R195 VanDerWaalsContact O-CG 3.25Å; D191-R195 WeakPolarHBondContact O-CG 3.14Å; D191-R195 PolarHBondContact O-N 3.26Å; D191-R195 VanDerWaalsContact O-N 3.17Å
192	A	71.8	Confident	70.3	Confident	21 Å²	21	99.8 Å²	99.8	17%	0.174	47%	0.472	C	S	.	.	H	α-helix	trans	-71.1	-45	179.4	0	0	0	0	0	112	Y5 G190 R195 Q196	Y5-A192 WeakPolarHBondContact O-CB 3.26Å; Y5-A192 PolarHBondContact O-N 3.43Å; G190-A192 PolarHBondContact O-N 3.27Å; G190-A192 VanDerWaalsContact O-N 3.15Å; A192-R195 PolarHBondContact O-N 3.22Å; A192-Q196 PolarHBondContact O-N 3.32Å
193	A	68.9	Low	68.6	Low	9 Å²	9	96 Å²	96	7%	0.074	48%	0.476	C	S	.	.	H	α-helix	trans	-66.6	-39.8	177.4	0	0	0	0	0	111.7	D6 Y189 G190 R195 Q196 L197	D6-A193 HydrophobicContact CB-CB 4.36Å; D6-A193 WeakPolarHBondContact O-CB 3.23Å; Y189-A193 HydrophobicContact CD1-CB 3.73Å; Y189-A193 HydrophobicContact CG-CB 4.39Å; G190-A193 PolarHBondContact O-N 3.45Å; A193-R195 VanDerWaalsContact C-N 3.29Å; A193-R195 PolarHBondContact O-N 3.26Å; A193-Q196 PolarHBondContact O-N 3.09Å; A193-Q196 VanDerWaalsContact O-N 3.13Å; A193-L197 PolarHBondContact O-N 3.15Å
194	L	68.4	Low	67	Low	65 Å²	65	94.9 Å²	94.9	34%	0.34	47%	0.468	S	S	.	.	H	α-helix	trans	-61.7	-35.7	175	-70.4	174.7	0	0	0	112.3	G190 R198	G190-L194 WeakPolarHBondContact O-CG 3.35Å; G190-L194 PolarHBondContact O-N 2.99Å; L194-R198 WeakPolarHBondContact O-CB 3.34Å; L194-R198 VanDerWaalsContact O-CG 3.25Å; L194-R198 WeakPolarHBondContact O-CG 3.25Å; L194-R198 PolarHBondContact O-N 2.77Å
195	R	66.8	Low	65.2	Low	180 Å²	180	98.5 Å²	98.5	68%	0.679	48%	0.484	S	S	*	.	H	α-helix	trans	-66.1	-38.1	173.6	-74	171.7	-170.7	-174.2	4.1	112.5	D191 A192 A193 S199	D191-R195 VanDerWaalsContact O-CG 3.25Å; D191-R195 WeakPolarHBondContact O-CG 3.14Å; D191-R195 PolarHBondContact O-N 3.26Å; D191-R195 VanDerWaalsContact O-N 3.17Å; A192-R195 PolarHBondContact O-N 3.22Å; A193-R195 VanDerWaalsContact C-N 3.29Å; A193-R195 PolarHBondContact O-N 3.26Å; R195-S199 PolarHBondContact O-N 3.41Å; R195-S199 PolarHBondContact O-OG 2.95Å
196	Q	65.3	Low	63.6	Low	123 Å²	123	106.7 Å²	106.7	58%	0.575	52%	0.52	S	S	*	.	H	α-helix	trans	-68.1	-41.2	176	-70	179.7	10.1	0	0	111.8	A192 A193 S199	A192-Q196 PolarHBondContact O-N 3.32Å; A193-Q196 PolarHBondContact O-N 3.09Å; A193-Q196 VanDerWaalsContact O-N 3.13Å; Q196-S199 PolarHBondContact O-N 2.68Å
197	L	62	Low	61.6	Low	111 Å²	111	108.8 Å²	108.8	58%	0.581	54%	0.542	S	S	*	.	H	α-helix	trans	-66.8	-36.8	176.4	-73.9	165.6	0	0	0	112.8	Y189 A193 S199	Y189-L197 HydrophobicContact CD1-CD1 4.42Å; Y189-L197 HydrophobicContact CD2-CD1 4.35Å; Y189-L197 HydrophobicContact CE1-CD1 4.4Å; Y189-L197 HydrophobicContact CE2-CD1 4.35Å; Y189-L197 HydrophobicContact CG-CD1 4.38Å; A193-L197 PolarHBondContact O-N 3.15Å; L197-S199 VanDerWaalsContact C-N 3.29Å; L197-S199 PolarHBondContact O-N 3.05Å
198	R	57.8	Low	59.9	Low	202 Å²	202	113.9 Å²	113.9	76%	0.762	58%	0.578	S	S	*	*	H	α-helix	trans	-78.4	-9.8	178.3	-72.4	178.1	179.9	-168.3	1.3	114.1	L194 P200	L194-R198 WeakPolarHBondContact O-CB 3.34Å; L194-R198 VanDerWaalsContact O-CG 3.25Å; L194-R198 WeakPolarHBondContact O-CG 3.25Å; L194-R198 PolarHBondContact O-N 2.77Å; R198-P200 VanDerWaalsContact O-CD 3.23Å; R198-P200 WeakPolarHBondContact O-CD 3.41Å
199	S	47.8	Very low	57.9	Low	79 Å²	79	118 Å²	118	55%	0.552	60%	0.597	S	S	*	*	S	Bend	trans	-77.3	108.8	173.9	-63.4	0	0	0	0	108	R195 Q196 L197 R201	R195-S199 PolarHBondContact O-N 3.41Å; R195-S199 PolarHBondContact O-OG 2.95Å; Q196-S199 PolarHBondContact O-N 2.68Å; L197-S199 VanDerWaalsContact C-N 3.29Å; L197-S199 PolarHBondContact O-N 3.05Å; S199-R201 PolarHBondContact O-N 2.76Å
200	P	45.3	Very low	56	Low	117 Å²	117	121.8 Å²	121.8	76%	0.76	62%	0.622	S	S	*	*			trans	-62.1	127.8	178	-8.8	23.5	0	0	0	107.2	R198 R202	R198-P200 VanDerWaalsContact O-CD 3.23Å; R198-P200 WeakPolarHBondContact O-CD 3.41Å; P200-R202 VanDerWaalsContact C-N 3.31Å; P200-R202 PolarHBondContact O-N 2.98Å
201	R	47.9	Very low	54.4	Low	245 Å²	245	128.1 Å²	128.1	93%	0.925	67%	0.665	S	S	*	*			trans	-54	106	159.3	-81.9	-176.1	174.8	-171.5	-0.7	105.9	S199 A203	S199-R201 PolarHBondContact O-N 2.76Å; R201-A203 PolarHBondContact O-N 3.22Å
202	R	43.1	Very low	53.2	Low	238 Å²	238	127.8 Å²	127.8	90%	0.898	68%	0.68	S	S	*	*			trans	-65.4	78.2	163.3	-121.2	-178.2	177.2	-174.9	-0.9	106	P200 Q204	P200-R202 VanDerWaalsContact C-N 3.31Å; P200-R202 PolarHBondContact O-N 2.98Å; R202-Q204 VanDerWaalsContact C-N 3.28Å; R202-Q204 PolarHBondContact O-N 3.12Å
203	A	46.9	Very low	51.9	Low	85 Å²	85	137 Å²	137	70%	0.702	74%	0.74	S	S	*	*			trans	-64.8	100.5	156.3	0	0	0	0	0	104.9	R201 P205	R201-A203 PolarHBondContact O-N 3.22Å; A203-P205 VanDerWaalsContact O-CD 3.31Å; A203-P205 WeakPolarHBondContact O-CD 3.25Å
204	Q	44	Very low	51	Low	165 Å²	165	143.4 Å²	143.4	77%	0.771	77%	0.774	S	S	*	*			trans	-61.8	122	164.2	-77.9	179.2	-22.4	0	0	106.8	R202 Q206	R202-Q204 VanDerWaalsContact C-N 3.28Å; R202-Q204 PolarHBondContact O-N 3.12Å; Q204-Q206 PolarHBondContact O-N 2.97Å
205	P	41.7	Very low	50.1	Low	120 Å²	120	147.5 Å²	147.5	78%	0.779	80%	0.797	S	S	*	*			trans	-71.7	116	159.5	28.2	-23.2	0	0	0	105.9	A203 G207	A203-P205 VanDerWaalsContact O-CD 3.31Å; A203-P205 WeakPolarHBondContact O-CD 3.25Å; P205-G207 PolarHBondContact O-N 3.13Å
206	Q	47.5	Very low	49.2	Very low	192 Å²	192	145.7 Å²	145.7	90%	0.897	80%	0.803	S	S	*	*			trans	-66.1	90.4	157	-82.3	-178	-8.5	0	0	106.1	Q204 S208	Q204-Q206 PolarHBondContact O-N 2.97Å; Q206-S208 PolarHBondContact O-N 2.66Å
207	G	41.5	Very low	48.3	Very low	60 Å²	60	147.1 Å²	147.1	62%	0.619	82%	0.816	S	S	*	*			trans	-61.9	124.9	170.9	0	0	0	0	0	109	P205 Q209	P205-G207 PolarHBondContact O-N 3.13Å; G207-Q209 PolarHBondContact O-N 3.42Å
208	S	53.3	Low	47.4	Very low	114 Å²	114	149.3 Å²	149.3	80%	0.797	83%	0.831	S	S	*	*			trans	-41.6	116.1	161.9	46.2	0	0	0	0	111.2	Q206 D210	Q206-S208 PolarHBondContact O-N 2.66Å; S208-D210 PolarHBondContact O-N 2.77Å
209	Q	47.1	Very low	46.7	Very low	202 Å²	202	145.8 Å²	145.8	94%	0.944	84%	0.836	S	S	*	*			trans	-79.2	101.7	158.3	-87.1	-178.7	-22.9	0	0	107.6	G207	G207-Q209 PolarHBondContact O-N 3.42Å
210	D	48.3	Very low	46.6	Very low	150 Å²	150	150.6 Å²	150.6	80%	0.802	86%	0.856	S	S	*	*			trans	-112.7	118.9	158.9	-153.5	11.2	0	0	0	106.2	S208	S208-D210 PolarHBondContact O-N 2.77Å
211	C	49.4	Very low	46.7	Very low	135 Å²	135	153.2 Å²	153.2	91%	0.912	86%	0.863	S	S	*	*			trans	-157	110.2	166.6	-109.3	0	0	0	0	106.8
212	G	51.9	Low	46.6	Very low	71 Å²	71	145.5 Å²	145.5	73%	0.732	86%	0.858	S	S	*	*			trans	-87.9	176.3	-170.2	0	0	0	0	0	115.6
213	C	45.2	Very low	47	Very low	214 Å²	214	137.1 Å²	137.1	100%	1.446	86%	0.855	S	S	*	*			trans	-159.6	0	138.9	-90.8	0	0	0	0	106.5

Retrieved 213 of 213 residues in 332.2 ms (Link to these results)

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