A0A2K5VXL7_MACFA Loading...

PRELI domain containing 3A

AlphaFold DB , UniProt , Accession A0A2K5VXL7, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene PRELID3A, Length 172 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61.3	Low	84.9	Confident	152 Å²	152	73.8 Å²	73.8	75%	0.749	41%	0.405	S	S	*	.				0	118.2	0	179.1	-176.1	-83.1	0	0	107.2	I129 I130 E142	M1-I129 HydrophobicContact CE-CG2 4.46Å; M1-I129 HydrophobicContact CG-CG2 4.2Å; M1-I129 HydrophobicContact SD-CG2 4.49Å; M1-I130 VanDerWaalsContact CA-O 3.3Å; M1-I130 WeakPolarHBondContact CA-O 3.45Å; M1-E142 PolarHBondContact N-OE1 3.46Å
2	K	71.8	Confident	85.5	Confident	84 Å²	84	71.6 Å²	71.6	37%	0.365	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	128.6	179.5	-164.2	168	-177.9	177.5	0	108.6	I130 A146	K2-I130 PolarHBondContact N-O 2.65Å; K2-I130 PolarHBondContact O-N 2.89Å; K2-A146 HydrophobicContact CD-CB 4.07Å
3	I	80.6	Confident	86.1	Confident	119 Å²	119	68.8 Å²	68.8	61%	0.61	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	128.3	176.9	-55.5	173.9	0	0	0	106.6	A128	I3-A128 WeakPolarHBondContact CA-O 3.2Å
4	W	83.6	Confident	86.6	Confident	52 Å²	52	64.8 Å²	64.8	20%	0.197	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.8	170.3	178.9	81.5	0	0	0	107.5	Q126 E127 A128 I149 A153	W4-Q126 HydrophobicContact CZ3-CB 3.94Å; W4-E127 CarbonylContact O-C 3.5Å; W4-E127 WeakPolarHBondContact O-CA 3.19Å; W4-A128 HydrophobicContact CB-CB 4.43Å; W4-A128 HydrophobicContact CE3-CB 4.17Å; W4-A128 PolarHBondContact N-O 2.74Å; W4-A128 PolarHBondContact O-N 2.88Å; W4-I149 HydrophobicContact CE3-CG2 4.21Å; W4-A153 HydrophobicContact CH2-CB 3.42Å; W4-A153 VanDerWaalsContact CH2-CB 3.42Å; W4-A153 HydrophobicContact CZ2-CB 4.22Å; W4-A153 HydrophobicContact CZ3-CB 4.03Å
5	S	87.4	Confident	86.9	Confident	82 Å²	82	65.3 Å²	65.3	57%	0.573	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.5	167.2	79.1	0	0	0	0	110.1	Q126	S5-Q126 CarbonylContact C-O 3.56Å; S5-Q126 WeakPolarHBondContact CA-O 3.34Å
6	S	90	Very high	87.1	Confident	31 Å²	31	64.4 Å²	64.4	22%	0.217	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	146.1	174.1	-170.4	0	0	0	0	109.3	Q126 W157	S6-Q126 PolarHBondContact N-O 3.23Å; S6-Q126 PolarHBondContact O-N 3.41Å; S6-W157 WeakPolarHBondContact OG-CH2 3.2Å
7	E	91.8	Very high	87.4	Confident	127 Å²	127	60.6 Å²	60.6	59%	0.593	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	143.8	170	-170.7	171.7	83.1	0	0	108.9	V123 L124	E7-V123 HydrophobicContact CG-CG1 3.8Å; E7-L124 CarbonylContact C-O 3.51Å; E7-L124 WeakPolarHBondContact CA-O 3.43Å
8	H	91.9	Very high	87.6	Confident	51 Å²	51	58 Å²	58	24%	0.236	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	140.5	174.6	-174.8	67.1	0	0	0	109.4	F10 L124 W157	H8-F10 AromaticContact CD2-CD1 3.89Å; H8-F10 AromaticContact CD2-CE1 3.63Å; H8-F10 AromaticContact CD2-CE2 3.89Å; H8-F10 AromaticContact CD2-CZ 3.63Å; H8-F10 AromaticContact NE2-CD1 3.88Å; H8-F10 AromaticContact NE2-CE1 3.78Å; H8-L124 PolarHBondContact N-O 3.49Å; H8-L124 PolarHBondContact O-N 3.01Å; H8-W157 HydrophobicContact CB-CD2 3.99Å; H8-W157 HydrophobicContact CB-CE3 4.36Å; H8-W157 HydrophobicContact CB-CG 4.48Å; H8-W157 HydrophobicContact CB-CH2 4.28Å; H8-W157 HydrophobicContact CB-CZ2 3.88Å; H8-W157 HydrophobicContact CB-CZ3 4.5Å; H8-W157 AromaticContact CD2-CG 3.83Å; H8-W157 AromaticContact CG-CD2 3.74Å; H8-W157 AromaticContact CG-CE3 3.95Å; H8-W157 AromaticContact ND1-CE3 3.78Å
9	V	92.9	Very high	87.7	Confident	62 Å²	62	60.9 Å²	60.9	38%	0.376	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119	178.1	-175	0	0	0	0	108.2	M121 T122 V123	V9-M121 HydrophobicContact CG1-CB 4.2Å; V9-M121 HydrophobicContact CG1-SD 4.45Å; V9-T122 CarbonylContact C-O 3.49Å; V9-T122 WeakPolarHBondContact CA-O 3.27Å; V9-V123 HydrophobicContact CG2-CG2 4.35Å
10	F	91.1	Very high	87.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.2	171	-63.9	-78.9	0	0	0	109.4	H8 H12 V17 Y112 M121 T122 L124 W157 I160 E161	H8-F10 AromaticContact CD2-CD1 3.89Å; H8-F10 AromaticContact CD2-CE1 3.63Å; H8-F10 AromaticContact CD2-CE2 3.89Å; H8-F10 AromaticContact CD2-CZ 3.63Å; H8-F10 AromaticContact NE2-CD1 3.88Å; H8-F10 AromaticContact NE2-CE1 3.78Å; F10-H12 PolarHBondContact O-N 3.44Å; F10-V17 HydrophobicContact CB-CG2 3.91Å; F10-V17 HydrophobicContact CD2-CG1 3.98Å; F10-V17 HydrophobicContact CD2-CG2 4.5Å; F10-V17 HydrophobicContact CE2-CG1 4.25Å; F10-V17 HydrophobicContact CG-CG1 4.4Å; F10-V17 HydrophobicContact CG-CG2 4.24Å; F10-Y112 HydrophobicContact CE2-CD1 4.47Å; F10-Y112 HydrophobicContact CE2-CE1 4.07Å; F10-M121 WeakPolarHBondContact O-CA 3.35Å; F10-T122 PolarHBondContact N-O 2.95Å; F10-T122 PolarHBondContact O-N 3.33Å; F10-L124 HydrophobicContact CD2-CB 4.19Å; F10-L124 HydrophobicContact CE2-CB 3.64Å; F10-L124 HydrophobicContact CE2-CD2 3.63Å; F10-L124 HydrophobicContact CE2-CG 4.26Å; F10-L124 HydrophobicContact CZ-CD2 3.92Å; F10-W157 HydrophobicContact CE1-CB 4.18Å; F10-W157 HydrophobicContact CZ-CB 4.25Å; F10-W157 HydrophobicContact CZ-CG 4.37Å; F10-I160 HydrophobicContact CD1-CG2 4.36Å; F10-I160 HydrophobicContact CE1-CB 4.12Å; F10-I160 HydrophobicContact CE1-CG2 3.94Å; F10-I160 HydrophobicContact CZ-CB 4.36Å; F10-I160 HydrophobicContact CZ-CD1 3.99Å; F10-I160 HydrophobicContact CZ-CG2 4.26Å; F10-E161 HydrophobicContact CD1-CG 4.34Å; F10-E161 WeakPolarHBondContact CD1-OE1 3.35Å; F10-E161 HydrophobicContact CE1-CG 4.44Å
11	G	92.3	Very high	87.8	Confident	52 Å²	52	55.5 Å²	55.5	54%	0.536	30%	0.301	S	S	.	.	S	Bend	trans	-76	29.1	175.7	0	0	0	0	0	114
12	H	91.6	Very high	89	Confident	47 Å²	47	50.4 Å²	50.4	22%	0.218	28%	0.276	C	S	.	.	S	Bend	trans	-134.9	149.9	-172.3	-59.9	-77.8	0	0	0	111.6	F10 V17 E120 M121 T122 E161 I164	F10-H12 PolarHBondContact O-N 3.44Å; H12-V17 HydrophobicContact CB-CG2 3.79Å; H12-E120 CarbonylContact C-O 3.57Å; H12-E120 WeakPolarHBondContact CA-O 3.35Å; H12-E120 PolarHBondContact N-O 2.94Å; H12-M121 CarbonylContact O-C 3.51Å; H12-T122 PolarHBondContact O-N 3.01Å; H12-T122 PolarHBondContact O-OG1 3.4Å; H12-E161 IonicContact CD2-OE1 2.75Å; H12-E161 IonicContact CD2-OE2 3.2Å; H12-E161 PolarHBondContact CD2-OE2 2.92Å; H12-E161 IonicContact CE1-OE2 3.77Å; H12-E161 IonicContact NE2-OE1 2.89Å; H12-E161 IonicContact NE2-OE2 3.9Å; H12-E161 PolarHBondContact NE2-OE2 3.13Å; H12-I164 HydrophobicContact CB-CD1 4.18Å
13	P	93.1	Very high	89.6	Confident	36 Å²	36	54.1 Å²	54.1	23%	0.234	29%	0.287	C	S	.	.			trans	-59.9	149.6	176.6	-24	33.6	0	0	0	112.3	D15 T16 V17 E120	P13-D15 VanDerWaalsContact C-N 3.28Å; P13-D15 PolarHBondContact O-N 2.91Å; P13-T16 WeakPolarHBondContact O-CB 3.46Å; P13-T16 PolarHBondContact O-N 2.88Å; P13-T16 VanDerWaalsContact O-N 3.08Å; P13-V17 PolarHBondContact O-N 3.31Å; P13-V17 VanDerWaalsContact O-N 3.09Å; P13-E120 WeakPolarHBondContact CG-OE2 3.49Å; P13-E120 VanDerWaalsContact N-O 3.12Å
14	W	93.2	Very high	89.6	Confident	12 Å²	12	50.1 Å²	50.1	5%	0.045	27%	0.266	C	S	.	.	H	α-helix	trans	-53.8	-44.4	-177.3	179.4	88.7	0	0	0	112.8	T16 V17 I18 V84 K89 M91 Y112 P114 T122	W14-T16 VanDerWaalsContact C-N 3.29Å; W14-T16 PolarHBondContact O-N 3.22Å; W14-V17 PolarHBondContact O-N 3.08Å; W14-I18 HydrophobicContact CD2-CD1 4.47Å; W14-I18 HydrophobicContact CD2-CG1 3.68Å; W14-I18 HydrophobicContact CE3-CG1 4.15Å; W14-I18 HydrophobicContact CG-CG1 4.18Å; W14-I18 HydrophobicContact CH2-CG1 4.03Å; W14-I18 HydrophobicContact CZ2-CD1 4.27Å; W14-I18 HydrophobicContact CZ2-CG1 3.53Å; W14-I18 HydrophobicContact CZ3-CG1 4.31Å; W14-I18 VanDerWaalsContact O-CG1 3.31Å; W14-I18 WeakPolarHBondContact O-CG1 3.13Å; W14-I18 PolarHBondContact O-N 3.18Å; W14-V84 HydrophobicContact CH2-CG1 3.73Å; W14-V84 HydrophobicContact CZ2-CG1 4.04Å; W14-K89 HydrophobicContact CD2-CB 3.97Å; W14-K89 VanDerWaalsContact CE2-O 3.32Å; W14-K89 HydrophobicContact CE3-CB 4.05Å; W14-K89 HydrophobicContact CE3-CD 4.39Å; W14-K89 HydrophobicContact CE3-CG 4.19Å; W14-K89 HydrophobicContact CG-CB 4.42Å; W14-K89 HydrophobicContact CZ2-CB 4.48Å; W14-K89 HydrophobicContact CZ3-CB 4.35Å; W14-K89 HydrophobicContact CZ3-CG 4.36Å; W14-K89 PolarHBondContact NE1-O 3.28Å; W14-K89 VanDerWaalsContact NE1-O 3.08Å; W14-M91 HydrophobicContact CZ2-CB 4.3Å; W14-Y112 PolarHBondContact NE1-O 2.79Å; W14-P114 HydrophobicContact CB-CG 4Å; W14-P114 HydrophobicContact CG-CG 4.16Å; W14-T122 WeakPolarHBondContact CA-OG1 3.49Å; W14-T122 PolarHBondContact N-OG1 2.93Å; W14-T122 VanDerWaalsContact N-OG1 3.09Å
15	D	90.8	Very high	89.4	Confident	72 Å²	72	50.4 Å²	50.4	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-58.7	-41	-178.8	-63.8	-72.6	0	0	0	112	P13 Q19 K89	P13-D15 VanDerWaalsContact C-N 3.28Å; P13-D15 PolarHBondContact O-N 2.91Å; D15-Q19 VanDerWaalsContact O-CG 3.26Å; D15-Q19 WeakPolarHBondContact O-CG 3.49Å; D15-Q19 PolarHBondContact O-N 2.96Å; D15-K89 IonicContact OD2-NZ 3.22Å; D15-K89 PolarHBondContact OD2-NZ 3.43Å
16	T	90.9	Very high	88.9	Confident	51 Å²	51	52.6 Å²	52.6	31%	0.313	28%	0.279	S	S	.	.	H	α-helix	trans	-67.6	-46.4	176.7	-55.5	0	0	0	0	111.4	P13 W14 I18 Q19 A20 I164	P13-T16 WeakPolarHBondContact O-CB 3.46Å; P13-T16 PolarHBondContact O-N 2.88Å; P13-T16 VanDerWaalsContact O-N 3.08Å; W14-T16 VanDerWaalsContact C-N 3.29Å; W14-T16 PolarHBondContact O-N 3.22Å; T16-I18 PolarHBondContact O-N 3.28Å; T16-Q19 PolarHBondContact O-N 2.77Å; T16-A20 PolarHBondContact O-N 2.78Å; T16-I164 HydrophobicContact CG2-CD1 4.28Å; T16-I164 HydrophobicContact CG2-CG1 4.05Å; T16-I164 HydrophobicContact CG2-CG2 3.82Å
17	V	91.6	Very high	88.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-41.9	-179.8	175.3	0	0	0	0	111.4	F10 H12 P13 W14 A20 A21 Y112 T122 I160 I164	F10-V17 HydrophobicContact CB-CG2 3.91Å; F10-V17 HydrophobicContact CD2-CG1 3.98Å; F10-V17 HydrophobicContact CD2-CG2 4.5Å; F10-V17 HydrophobicContact CE2-CG1 4.25Å; F10-V17 HydrophobicContact CG-CG1 4.4Å; F10-V17 HydrophobicContact CG-CG2 4.24Å; H12-V17 HydrophobicContact CB-CG2 3.79Å; P13-V17 PolarHBondContact O-N 3.31Å; P13-V17 VanDerWaalsContact O-N 3.09Å; W14-V17 PolarHBondContact O-N 3.08Å; V17-A20 PolarHBondContact O-N 3.35Å; V17-A21 VanDerWaalsContact O-CB 3.29Å; V17-A21 WeakPolarHBondContact O-CB 3.26Å; V17-A21 PolarHBondContact O-N 3.18Å; V17-Y112 HydrophobicContact CG1-CD1 3.85Å; V17-Y112 HydrophobicContact CG1-CE1 4.05Å; V17-T122 HydrophobicContact CB-CG2 4.25Å; V17-T122 HydrophobicContact CG1-CG2 4.11Å; V17-T122 HydrophobicContact CG2-CG2 4.4Å; V17-I160 HydrophobicContact CG1-CG2 4.29Å; V17-I164 HydrophobicContact CG2-CD1 4.19Å
18	I	90.9	Very high	87.2	Confident	14 Å²	14	49.5 Å²	49.5	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-41.9	178.4	-64.5	-30.9	0	0	0	111.3	W14 T16 A20 A21 M22 V84 M91 Y112	W14-I18 HydrophobicContact CD2-CD1 4.47Å; W14-I18 HydrophobicContact CD2-CG1 3.68Å; W14-I18 HydrophobicContact CE3-CG1 4.15Å; W14-I18 HydrophobicContact CG-CG1 4.18Å; W14-I18 HydrophobicContact CH2-CG1 4.03Å; W14-I18 HydrophobicContact CZ2-CD1 4.27Å; W14-I18 HydrophobicContact CZ2-CG1 3.53Å; W14-I18 HydrophobicContact CZ3-CG1 4.31Å; W14-I18 VanDerWaalsContact O-CG1 3.31Å; W14-I18 WeakPolarHBondContact O-CG1 3.13Å; W14-I18 PolarHBondContact O-N 3.18Å; T16-I18 PolarHBondContact O-N 3.28Å; I18-A20 VanDerWaalsContact C-N 3.34Å; I18-A20 PolarHBondContact O-N 2.93Å; I18-A21 PolarHBondContact O-N 3.28Å; I18-M22 HydrophobicContact CG2-CG 4.49Å; I18-M22 WeakPolarHBondContact O-CG 3.4Å; I18-M22 PolarHBondContact O-N 3Å; I18-V84 HydrophobicContact CG2-CG1 4.35Å; I18-M91 HydrophobicContact CB-SD 4.43Å; I18-M91 HydrophobicContact CD1-CB 3.59Å; I18-M91 HydrophobicContact CD1-CG 4.19Å; I18-M91 HydrophobicContact CD1-SD 3.69Å; I18-M91 HydrophobicContact CG1-CB 4.18Å; I18-M91 HydrophobicContact CG1-SD 4.27Å; I18-M91 HydrophobicContact CG2-SD 3.78Å; I18-Y112 HydrophobicContact CD1-CD1 4.29Å; I18-Y112 HydrophobicContact CD1-CD2 4.41Å; I18-Y112 HydrophobicContact CD1-CG 3.89Å
19	Q	90.1	Very high	86.4	Confident	114 Å²	114	50.7 Å²	50.7	53%	0.533	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-44.5	176.2	-73.6	-180	35.9	0	0	111.6	D15 T16 M22 R23	D15-Q19 VanDerWaalsContact O-CG 3.26Å; D15-Q19 WeakPolarHBondContact O-CG 3.49Å; D15-Q19 PolarHBondContact O-N 2.96Å; T16-Q19 PolarHBondContact O-N 2.77Å; Q19-M22 PolarHBondContact O-N 2.79Å; Q19-R23 WeakPolarHBondContact O-CG 3.45Å; Q19-R23 PolarHBondContact O-N 2.75Å
20	A	89.4	Confident	85.6	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.033	26%	0.262	C	S	.	.	H	α-helix	trans	-63.8	-43.3	175.1	0	0	0	0	0	112.1	T16 V17 I18 M22 R23 K24 I160 I163 I164	T16-A20 PolarHBondContact O-N 2.78Å; V17-A20 PolarHBondContact O-N 3.35Å; I18-A20 VanDerWaalsContact C-N 3.34Å; I18-A20 PolarHBondContact O-N 2.93Å; A20-M22 VanDerWaalsContact C-N 3.31Å; A20-M22 PolarHBondContact O-N 2.89Å; A20-R23 CarbonylContact O-C 3.51Å; A20-R23 PolarHBondContact O-N 2.89Å; A20-R23 VanDerWaalsContact O-N 3.09Å; A20-K24 PolarHBondContact O-N 3.26Å; A20-I160 HydrophobicContact CB-CG2 4.04Å; A20-I163 HydrophobicContact CB-CB 4.2Å; A20-I163 HydrophobicContact CB-CG2 3.78Å; A20-I164 HydrophobicContact CB-CD1 4.2Å; A20-I164 HydrophobicContact CB-CG1 3.54Å
21	A	88.1	Confident	84.7	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.033	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-35.6	177.5	0	0	0	0	0	112.6	V17 I18 R23 K24 I160	V17-A21 VanDerWaalsContact O-CB 3.29Å; V17-A21 WeakPolarHBondContact O-CB 3.26Å; V17-A21 PolarHBondContact O-N 3.18Å; I18-A21 PolarHBondContact O-N 3.28Å; A21-R23 VanDerWaalsContact C-N 3.32Å; A21-K24 VanDerWaalsContact O-CB 3.3Å; A21-K24 WeakPolarHBondContact O-CB 3.44Å; A21-K24 PolarHBondContact O-N 2.84Å; A21-I160 HydrophobicContact CB-CD1 4.25Å
22	M	85.8	Confident	83.9	Confident	44 Å²	44	53.2 Å²	53.2	22%	0.217	28%	0.284	C	S	.	.	H	α-helix	trans	-68.6	-32.3	174.7	-72.8	-64.3	177.4	0	0	112.5	I18 Q19 A20 R53 V84 M91	I18-M22 HydrophobicContact CG2-CG 4.49Å; I18-M22 WeakPolarHBondContact O-CG 3.4Å; I18-M22 PolarHBondContact O-N 3Å; Q19-M22 PolarHBondContact O-N 2.79Å; A20-M22 VanDerWaalsContact C-N 3.31Å; A20-M22 PolarHBondContact O-N 2.89Å; M22-R53 PolarHBondContact O-NH1 3.09Å; M22-R53 VanDerWaalsContact O-NH1 3.09Å; M22-V84 HydrophobicContact CE-CG2 3.35Å; M22-M91 HydrophobicContact CE-CE 3.65Å; M22-M91 HydrophobicContact CE-SD 3.8Å; M22-M91 HydrophobicContact SD-CE 4.38Å
23	R	83.7	Confident	83.5	Confident	163 Å²	163	52.2 Å²	52.2	62%	0.615	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	13.6	178.2	-63.9	178.2	-176.6	170.5	3.3	113.5	Q19 A20 A21 Y25 I163	Q19-R23 WeakPolarHBondContact O-CG 3.45Å; Q19-R23 PolarHBondContact O-N 2.75Å; A20-R23 CarbonylContact O-C 3.51Å; A20-R23 PolarHBondContact O-N 2.89Å; A20-R23 VanDerWaalsContact O-N 3.09Å; A21-R23 VanDerWaalsContact C-N 3.32Å; R23-Y25 PolarHBondContact O-N 2.81Å; R23-I163 WeakPolarHBondContact O-CD1 3.4Å
24	K	81.2	Confident	83	Confident	35 Å²	35	55.5 Å²	55.5	15%	0.152	30%	0.296	C	S	.	.			trans	-49.8	-29.3	-173.6	-173.4	173.6	176.4	-177.4	0	114	A20 A21 N27 A159 I163	A20-K24 PolarHBondContact O-N 3.26Å; A21-K24 VanDerWaalsContact O-CB 3.3Å; A21-K24 WeakPolarHBondContact O-CB 3.44Å; A21-K24 PolarHBondContact O-N 2.84Å; K24-N27 WeakPolarHBondContact O-CB 3.34Å; K24-N27 PolarHBondContact O-ND2 3.49Å; K24-A159 HydrophobicContact CG-CB 4.47Å; K24-I163 HydrophobicContact CB-CD1 4.47Å
25	Y	80.4	Confident	82.7	Confident	57 Å²	57	56.1 Å²	56.1	22%	0.224	31%	0.306	C	S	.	.			trans	-121.9	144.7	-177.4	-59.1	-73	0	0	0	112.2	R23 N27 N30 V33 V36 L55	R23-Y25 PolarHBondContact O-N 2.81Å; Y25-N27 WeakPolarHBondContact CD1-ND2 3.32Å; Y25-N27 VanDerWaalsContact CE1-ND2 3.32Å; Y25-N27 WeakPolarHBondContact CE1-ND2 3.46Å; Y25-N30 HydrophobicContact CE1-CB 4.05Å; Y25-V33 HydrophobicContact CD1-CB 3.92Å; Y25-V33 HydrophobicContact CD1-CG1 3.91Å; Y25-V33 HydrophobicContact CD1-CG2 4.09Å; Y25-V33 HydrophobicContact CE1-CB 3.86Å; Y25-V33 HydrophobicContact CE1-CG1 4.06Å; Y25-V33 HydrophobicContact CE1-CG2 3.48Å; Y25-V33 VanDerWaalsContact CE1-CG2 3.48Å; Y25-V33 HydrophobicContact CG-CG1 4.22Å; Y25-V36 HydrophobicContact CD2-CG2 3.75Å; Y25-V36 HydrophobicContact CG-CG2 3.87Å; Y25-L55 HydrophobicContact CD2-CD2 4.41Å; Y25-L55 HydrophobicContact CE2-CD2 3.77Å
26	P	76.2	Confident	82.6	Confident	128 Å²	128	54.9 Å²	54.9	83%	0.831	30%	0.301	S	S	*	.	S	Bend	cis	-74.5	149.6	-4.4	31.2	-34.7	0	0	0	112.8
27	N	75.3	Confident	82.6	Confident	13 Å²	13	57.3 Å²	57.3	7%	0.07	31%	0.312	C	S	.	.			trans	-140.3	149.5	173	68.7	84	0	0	0	111.5	K24 Y25 M29 N30 A159	K24-N27 WeakPolarHBondContact O-CB 3.34Å; K24-N27 PolarHBondContact O-ND2 3.49Å; Y25-N27 WeakPolarHBondContact CD1-ND2 3.32Å; Y25-N27 VanDerWaalsContact CE1-ND2 3.32Å; Y25-N27 WeakPolarHBondContact CE1-ND2 3.46Å; N27-M29 PolarHBondContact O-N 2.84Å; N27-M29 WeakPolarHBondContact OD1-CA 3.26Å; N27-M29 WeakPolarHBondContact OD1-CB 3.14Å; N27-M29 PolarHBondContact OD1-N 3.37Å; N27-M29 VanDerWaalsContact OD1-N 3.11Å; N27-N30 PolarHBondContact O-N 2.87Å; N27-N30 PolarHBondContact OD1-N 2.87Å; N27-N30 PolarHBondContact OD1-ND2 2.81Å; N27-A159 HydrophobicContact CB-CB 4.13Å
28	P	70.1	Confident	82.7	Confident	80 Å²	80	60.7 Å²	60.7	52%	0.519	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-20.2	-179.1	26.2	-34.4	0	0	0	113.8	W162	P28-W162 HydrophobicContact CG-CD2 4.26Å; P28-W162 HydrophobicContact CG-CZ2 4.26Å
29	M	76	Confident	82.8	Confident	77 Å²	77	64.9 Å²	64.9	38%	0.379	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.9	-177.7	-55.8	-61.2	179.2	0	0	113	N27 P31 K155 A158 A159	N27-M29 PolarHBondContact O-N 2.84Å; N27-M29 WeakPolarHBondContact OD1-CA 3.26Å; N27-M29 WeakPolarHBondContact OD1-CB 3.14Å; N27-M29 PolarHBondContact OD1-N 3.37Å; N27-M29 VanDerWaalsContact OD1-N 3.11Å; M29-P31 VanDerWaalsContact C-CD 3.49Å; M29-K155 HydrophobicContact CB-CB 4.43Å; M29-A158 HydrophobicContact CG-CB 4.43Å; M29-A159 HydrophobicContact CB-CB 4.26Å; M29-A159 HydrophobicContact CG-CB 4.39Å
30	N	74.9	Confident	83	Confident	16 Å²	16	64.6 Å²	64.6	9%	0.086	35%	0.354	C	S	.	.			trans	-128	67	-178.9	-66	-67.1	0	0	0	111.5	Y25 N27 S32 V33 K155	Y25-N30 HydrophobicContact CE1-CB 4.05Å; N27-N30 PolarHBondContact O-N 2.87Å; N27-N30 PolarHBondContact OD1-N 2.87Å; N27-N30 PolarHBondContact OD1-ND2 2.81Å; N30-S32 PolarHBondContact O-N 2.9Å; N30-S32 VanDerWaalsContact O-N 3.17Å; N30-V33 HydrophobicContact CB-CG2 4.32Å; N30-V33 PolarHBondContact O-N 2.8Å; N30-K155 WeakPolarHBondContact OD1-CB 3.44Å
31	P	72.8	Confident	83.3	Confident	96 Å²	96	70.9 Å²	70.9	62%	0.623	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.7	-179.4	29.6	-36.5	0	0	0	113	M29 V33	M29-P31 VanDerWaalsContact C-CD 3.49Å; P31-V33 PolarHBondContact O-N 3.01Å
32	S	76.8	Confident	83.7	Confident	54 Å²	54	76.8 Å²	76.8	38%	0.378	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-15	177.1	-58.9	0	0	0	0	113.7	N30 L34 T57 E58	N30-S32 PolarHBondContact O-N 2.9Å; N30-S32 VanDerWaalsContact O-N 3.17Å; S32-L34 PolarHBondContact O-N 3.42Å; S32-T57 CarbonylContact O-C 3.53Å; S32-T57 VanDerWaalsContact O-CA 3.22Å; S32-T57 WeakPolarHBondContact O-CA 3.28Å; S32-E58 WeakPolarHBondContact CB-O 3.2Å; S32-E58 PolarHBondContact O-N 3.49Å
33	V	81.9	Confident	84.1	Confident	27 Å²	27	79.2 Å²	79.2	16%	0.164	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	106.4	174.9	-175.1	0	0	0	0	108.4	Y25 N30 P31 V36 T57	Y25-V33 HydrophobicContact CD1-CB 3.92Å; Y25-V33 HydrophobicContact CD1-CG1 3.91Å; Y25-V33 HydrophobicContact CD1-CG2 4.09Å; Y25-V33 HydrophobicContact CE1-CB 3.86Å; Y25-V33 HydrophobicContact CE1-CG1 4.06Å; Y25-V33 HydrophobicContact CE1-CG2 3.48Å; Y25-V33 VanDerWaalsContact CE1-CG2 3.48Å; Y25-V33 HydrophobicContact CG-CG1 4.22Å; N30-V33 HydrophobicContact CB-CG2 4.32Å; N30-V33 PolarHBondContact O-N 2.8Å; P31-V33 PolarHBondContact O-N 3.01Å; V33-V36 HydrophobicContact CG1-CG2 3.76Å; V33-T57 HydrophobicContact CB-CG2 4.36Å; V33-T57 HydrophobicContact CG1-CG2 4.36Å; V33-T57 HydrophobicContact CG2-CG2 3.86Å
34	L	83.6	Confident	84.6	Confident	104 Å²	104	72.7 Å²	72.7	55%	0.545	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-29.7	-176.1	-62	-177.7	0	0	0	112.7	S32 S56 E58 L75	S32-L34 PolarHBondContact O-N 3.42Å; L34-S56 PolarHBondContact N-O 3.09Å; L34-E58 HydrophobicContact CD1-CB 3.82Å; L34-E58 HydrophobicContact CG-CB 4.13Å; L34-L75 HydrophobicContact CD1-CD1 3.77Å
35	G	85.5	Confident	85	Confident	25 Å²	25	75.5 Å²	75.5	26%	0.258	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	149.8	-172.3	0	0	0	0	0	112.1	S56	G35-S56 WeakPolarHBondContact CA-OG 3.42Å; G35-S56 PolarHBondContact N-O 3.1Å; G35-S56 PolarHBondContact N-OG 3.14Å; G35-S56 PolarHBondContact O-N 2.95Å; G35-S56 PolarHBondContact O-OG 3.3Å
36	V	89.2	Confident	85.5	Confident	46 Å²	46	82.2 Å²	82.2	28%	0.279	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	118.3	177.3	-176.8	0	0	0	0	108.5	Y25 V33 R53 L54 L55	Y25-V36 HydrophobicContact CD2-CG2 3.75Å; Y25-V36 HydrophobicContact CG-CG2 3.87Å; V33-V36 HydrophobicContact CG1-CG2 3.76Å; V36-R53 HydrophobicContact CG1-CB 4.4Å; V36-L54 WeakPolarHBondContact CA-O 3.31Å; V36-L55 HydrophobicContact CG1-CD1 4.48Å; V36-L55 HydrophobicContact CG1-CG 4.17Å; V36-L55 HydrophobicContact CG2-CD2 4.34Å; V36-L55 HydrophobicContact CG2-CG 4Å
37	D	92	Very high	86.3	Confident	102 Å²	102	78 Å²	78	55%	0.545	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.8	178	-68.9	-43	0	0	0	110.6	L39 R53 L54	D37-L39 PolarHBondContact O-N 3.09Å; D37-R53 CarbonylContact O-C 3.56Å; D37-R53 WeakPolarHBondContact O-CA 3.5Å; D37-L54 PolarHBondContact N-O 3.41Å; D37-L54 PolarHBondContact O-N 3.02Å
38	V	92.6	Very high	87.1	Confident	72 Å²	72	80.9 Å²	80.9	44%	0.436	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	104.6	171.6	179.7	0	0	0	0	107.8	R41 L52 R53	V38-R41 HydrophobicContact CG1-CB 4.19Å; V38-L52 CarbonylContact C-O 3.59Å; V38-R53 HydrophobicContact CG2-CG 4.04Å
39	L	93.8	Very high	88.3	Confident	102 Å²	102	79.6 Å²	79.6	53%	0.534	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-38.1	179.9	-59.8	-175.4	0	0	0	111.8	D37 L52 L54	D37-L39 PolarHBondContact O-N 3.09Å; L39-L52 HydrophobicContact CB-CD2 4.16Å; L39-L52 HydrophobicContact CB-CG 4.26Å; L39-L52 HydrophobicContact CD1-CD2 4.21Å; L39-L52 HydrophobicContact CD1-CG 4.37Å; L39-L52 PolarHBondContact N-O 3.19Å; L39-L54 HydrophobicContact CD1-CB 3.94Å; L39-L54 HydrophobicContact CD2-CB 4.09Å; L39-L54 HydrophobicContact CD2-CD2 4.48Å; L39-L54 HydrophobicContact CG-CB 3.94Å
40	Q	94.2	Very high	89.2	Confident	108 Å²	108	76.9 Å²	76.9	51%	0.505	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	142.5	-179.1	-167.5	179.1	26.8	0	0	110.2	S51 L52	Q40-S51 WeakPolarHBondContact O-CA 3.46Å; Q40-L52 HydrophobicContact CB-CB 4.02Å; Q40-L52 PolarHBondContact N-O 3.09Å; Q40-L52 PolarHBondContact O-N 2.89Å
41	R	95.3	Very high	90.2	Very high	135 Å²	135	76.1 Å²	76.1	51%	0.509	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	129.2	168.6	-177	167.9	-75.9	164.2	-0.8	109.2	V38 L49 H50 S51	V38-R41 HydrophobicContact CG1-CB 4.19Å; R41-L49 HydrophobicContact CG-CD1 3.65Å; R41-H50 WeakPolarHBondContact CA-O 3.31Å; R41-S51 PolarHBondContact NE-OG 3.08Å
42	R	95.6	Very high	91.2	Very high	128 Å²	128	73.1 Å²	73.1	48%	0.483	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	150.9	-179.8	66	-178.1	-175.4	121.4	3.5	110.7	H50	R42-H50 HydrophobicContact CG-CB 3.85Å; R42-H50 PolarHBondContact N-O 3.2Å; R42-H50 PolarHBondContact O-N 2.9Å
43	V	95.8	Very high	92	Very high	96 Å²	96	71.2 Å²	71.2	58%	0.582	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.7	167.8	-178.1	0	0	0	0	107.4	R48 L49	V43-R48 WeakPolarHBondContact CA-O 3.35Å; V43-L49 HydrophobicContact CG2-CD1 3.97Å
44	D	92.6	Very high	92.6	Very high	26 Å²	26	71.8 Å²	71.8	14%	0.139	38%	0.381	C	S	.	.			trans	-80.7	171.1	176.7	73.5	15.2	0	0	0	112.2	R46 G47 R48 H50	D44-R46 PolarHBondContact O-N 2.99Å; D44-R46 WeakPolarHBondContact OD1-CA 3.04Å; D44-R46 WeakPolarHBondContact OD1-CB 3.31Å; D44-R46 PolarHBondContact OD1-N 3.29Å; D44-G47 PolarHBondContact O-N 3.09Å; D44-G47 PolarHBondContact OD1-N 2.83Å; D44-G47 VanDerWaalsContact OD1-N 3.13Å; D44-R48 PolarHBondContact N-O 3.42Å; D44-R48 PolarHBondContact OD1-N 3.2Å; D44-R48 IonicContact OD1-NE 3.97Å; D44-R48 IonicContact OD2-CZ 3.36Å; D44-R48 IonicContact OD2-NE 3.63Å; D44-R48 PolarHBondContact OD2-NE 3.37Å; D44-R48 IonicContact OD2-NH2 3.02Å; D44-R48 PolarHBondContact OD2-NH2 3.39Å; D44-H50 IonicContact OD2-CD2 3.98Å; D44-H50 IonicContact OD2-CE1 2.79Å; D44-H50 IonicContact OD2-NE2 3.76Å; D44-H50 PolarHBondContact OD2-NE2 2.93Å
45	G	91	Very high	92.9	Very high	93 Å²	93	67.2 Å²	67.2	96%	0.959	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-7.2	179.7	0	0	0	0	0	114.8
46	R	90.8	Very high	93	Very high	199 Å²	199	67.2 Å²	67.2	75%	0.751	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	2.3	174.2	-60.6	-175.6	-179.7	-152.2	-0.6	112.5	D44 R48	D44-R46 PolarHBondContact O-N 2.99Å; D44-R46 WeakPolarHBondContact OD1-CA 3.04Å; D44-R46 WeakPolarHBondContact OD1-CB 3.31Å; D44-R46 PolarHBondContact OD1-N 3.29Å; R46-R48 HydrophobicContact CB-CG 4.47Å
47	G	91.6	Very high	92.8	Very high	39 Å²	39	65.3 Å²	65.3	40%	0.402	34%	0.342	S	S	.	.	S	Bend	trans	83.9	10.7	-179.4	0	0	0	0	0	114.7	D44	D44-G47 PolarHBondContact O-N 3.09Å; D44-G47 PolarHBondContact OD1-N 2.83Å; D44-G47 VanDerWaalsContact OD1-N 3.13Å
48	R	94.1	Very high	92.1	Very high	74 Å²	74	64.8 Å²	64.8	28%	0.279	34%	0.336	S	S	.	.			trans	-86.3	137.5	179.3	-54.4	177.4	-63.2	-179.3	2.3	110.5	V43 D44 R46 H50 V83 V84 D85	V43-R48 WeakPolarHBondContact CA-O 3.35Å; D44-R48 PolarHBondContact N-O 3.42Å; D44-R48 PolarHBondContact OD1-N 3.2Å; D44-R48 IonicContact OD1-NE 3.97Å; D44-R48 IonicContact OD2-CZ 3.36Å; D44-R48 IonicContact OD2-NE 3.63Å; D44-R48 PolarHBondContact OD2-NE 3.37Å; D44-R48 IonicContact OD2-NH2 3.02Å; D44-R48 PolarHBondContact OD2-NH2 3.39Å; R46-R48 HydrophobicContact CB-CG 4.47Å; R48-H50 PolarHBondContact O-CD2 3Å; R48-V83 HydrophobicContact CB-CG1 4.25Å; R48-V84 CarbonylContact C-O 3.55Å; R48-V84 VanDerWaalsContact CA-O 3.26Å; R48-V84 WeakPolarHBondContact CA-O 3.41Å; R48-V84 WeakPolarHBondContact CB-O 3.3Å; R48-D85 WeakPolarHBondContact CD-OD2 3.36Å; R48-D85 HydrophobicContact CG-CB 4.04Å; R48-D85 WeakPolarHBondContact CG-OD2 3.23Å
49	L	94.3	Very high	90.9	Very high	53 Å²	53	64.6 Å²	64.6	28%	0.277	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	114.8	179.3	-178.5	67.7	0	0	0	110.1	R41 V43 V83 V84	R41-L49 HydrophobicContact CG-CD1 3.65Å; V43-L49 HydrophobicContact CG2-CD1 3.97Å; L49-V83 CarbonylContact O-C 3.55Å; L49-V83 VanDerWaalsContact O-CA 3.32Å; L49-V83 WeakPolarHBondContact O-CA 3.29Å; L49-V84 HydrophobicContact CB-CB 4.27Å; L49-V84 PolarHBondContact N-O 3.47Å; L49-V84 PolarHBondContact O-N 3.39Å
50	H	95.5	Very high	89.3	Confident	19 Å²	19	63.1 Å²	63.1	9%	0.088	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.4	171.8	-63.3	-111.5	0	0	0	108.9	R41 R42 D44 R48 H81 S82	R41-H50 WeakPolarHBondContact CA-O 3.31Å; R42-H50 HydrophobicContact CG-CB 3.85Å; R42-H50 PolarHBondContact N-O 3.2Å; R42-H50 PolarHBondContact O-N 2.9Å; D44-H50 IonicContact OD2-CD2 3.98Å; D44-H50 IonicContact OD2-CE1 2.79Å; D44-H50 IonicContact OD2-NE2 3.76Å; D44-H50 PolarHBondContact OD2-NE2 2.93Å; R48-H50 PolarHBondContact O-CD2 3Å; H50-H81 AromaticContact ND1-CE1 3.83Å; H50-H81 AromaticContact ND1-NE2 3.75Å; H50-S82 CarbonylContact C-O 3.59Å; H50-S82 WeakPolarHBondContact CA-O 3.13Å
51	S	94.8	Very high	87.8	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.4	173	-61.1	0	0	0	0	110.4	Q40 R41 H81 S82	Q40-S51 WeakPolarHBondContact O-CA 3.46Å; R41-S51 PolarHBondContact NE-OG 3.08Å; S51-H81 WeakPolarHBondContact O-CA 3.49Å; S51-S82 WeakPolarHBondContact CB-OG 3.41Å; S51-S82 PolarHBondContact N-O 3.32Å; S51-S82 PolarHBondContact O-N 3.45Å
52	L	94.6	Very high	86.2	Confident	34 Å²	34	57.3 Å²	57.3	18%	0.178	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.7	170.7	-176.3	67.9	0	0	0	108.4	V38 L39 Q40 Q79 E80 H81	V38-L52 CarbonylContact C-O 3.59Å; L39-L52 HydrophobicContact CB-CD2 4.16Å; L39-L52 HydrophobicContact CB-CG 4.26Å; L39-L52 HydrophobicContact CD1-CD2 4.21Å; L39-L52 HydrophobicContact CD1-CG 4.37Å; L39-L52 PolarHBondContact N-O 3.19Å; Q40-L52 HydrophobicContact CB-CB 4.02Å; Q40-L52 PolarHBondContact N-O 3.09Å; Q40-L52 PolarHBondContact O-N 2.89Å; L52-Q79 HydrophobicContact CD1-CG 3.7Å; L52-E80 CarbonylContact C-O 3.51Å; L52-E80 WeakPolarHBondContact CA-O 3.21Å; L52-H81 HydrophobicContact CD1-CB 4.32Å
53	R	94	Very high	84.5	Confident	13 Å²	13	53.9 Å²	53.9	5%	0.049	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	147.4	179.4	-61.2	-166.4	-74.4	-164.6	-0.9	110.9	M22 V36 D37 V38 L55 E80	M22-R53 PolarHBondContact O-NH1 3.09Å; M22-R53 VanDerWaalsContact O-NH1 3.09Å; V36-R53 HydrophobicContact CG1-CB 4.4Å; D37-R53 CarbonylContact O-C 3.56Å; D37-R53 WeakPolarHBondContact O-CA 3.5Å; V38-R53 HydrophobicContact CG2-CG 4.04Å; R53-L55 HydrophobicContact CB-CD1 4.14Å; R53-E80 HydrophobicContact CB-CB 4.35Å; R53-E80 IonicContact CZ-OE1 2.79Å; R53-E80 PolarHBondContact N-O 3.43Å; R53-E80 IonicContact NE-OE1 3.94Å; R53-E80 PolarHBondContact NE-OE1 2.71Å; R53-E80 IonicContact NH2-OE1 2.68Å; R53-E80 PolarHBondContact NH2-OE1 2.77Å; R53-E80 IonicContact NH2-OE2 2.63Å; R53-E80 PolarHBondContact O-N 3.22Å
54	L	93.1	Very high	82.9	Confident	40 Å²	40	54.9 Å²	54.9	21%	0.209	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	123.3	170.6	-177.1	66.6	0	0	0	108.1	V36 D37 L39 Y77 I98	V36-L54 WeakPolarHBondContact CA-O 3.31Å; D37-L54 PolarHBondContact N-O 3.41Å; D37-L54 PolarHBondContact O-N 3.02Å; L39-L54 HydrophobicContact CD1-CB 3.94Å; L39-L54 HydrophobicContact CD2-CB 4.09Å; L39-L54 HydrophobicContact CD2-CD2 4.48Å; L39-L54 HydrophobicContact CG-CB 3.94Å; L54-Y77 HydrophobicContact CD1-CD1 4.43Å; L54-Y77 HydrophobicContact CD2-CD1 4.5Å; L54-Y77 HydrophobicContact CG-CD1 4.5Å; L54-I98 HydrophobicContact CD1-CD1 3.55Å
55	L	90.4	Very high	81.6	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.7	176.4	-65.4	77.9	0	0	0	108.5	Y25 V36 R53 T57 Y77 I78 E80	Y25-L55 HydrophobicContact CD2-CD2 4.41Å; Y25-L55 HydrophobicContact CE2-CD2 3.77Å; V36-L55 HydrophobicContact CG1-CD1 4.48Å; V36-L55 HydrophobicContact CG1-CG 4.17Å; V36-L55 HydrophobicContact CG2-CD2 4.34Å; V36-L55 HydrophobicContact CG2-CG 4Å; R53-L55 HydrophobicContact CB-CD1 4.14Å; L55-T57 HydrophobicContact CB-CG2 4.49Å; L55-Y77 WeakPolarHBondContact O-CA 3.47Å; L55-I78 HydrophobicContact CB-CB 4.3Å; L55-I78 PolarHBondContact N-O 3.41Å; L55-I78 PolarHBondContact O-N 2.81Å; L55-E80 HydrophobicContact CD1-CB 3.59Å
56	S	88.8	Confident	80.4	Confident	24 Å²	24	55.1 Å²	55.1	17%	0.168	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.1	170.6	60.8	0	0	0	0	109.1	L34 G35	L34-S56 PolarHBondContact N-O 3.09Å; G35-S56 WeakPolarHBondContact CA-OG 3.42Å; G35-S56 PolarHBondContact N-O 3.1Å; G35-S56 PolarHBondContact N-OG 3.14Å; G35-S56 PolarHBondContact O-N 2.95Å; G35-S56 PolarHBondContact O-OG 3.3Å
57	T	83.3	Confident	79.3	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.043	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.1	-176.9	63.5	0	0	0	0	111.2	S32 V33 L55 W59 T76 I78	S32-T57 CarbonylContact O-C 3.53Å; S32-T57 VanDerWaalsContact O-CA 3.22Å; S32-T57 WeakPolarHBondContact O-CA 3.28Å; V33-T57 HydrophobicContact CB-CG2 4.36Å; V33-T57 HydrophobicContact CG1-CG2 4.36Å; V33-T57 HydrophobicContact CG2-CG2 3.86Å; L55-T57 HydrophobicContact CB-CG2 4.49Å; T57-W59 PolarHBondContact OG1-NE1 3.26Å; T57-T76 PolarHBondContact N-O 3.46Å; T57-T76 PolarHBondContact O-N 3.02Å; T57-T76 PolarHBondContact O-OG1 3.41Å; T57-T76 PolarHBondContact OG1-OG1 2.98Å; T57-I78 HydrophobicContact CG2-CD1 4.09Å
58	E	78.7	Confident	78.1	Confident	90 Å²	90	50.7 Å²	50.7	42%	0.421	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.8	175.2	-173.1	171.8	-147.2	0	0	110.3	S32 L34 T74	S32-E58 WeakPolarHBondContact CB-O 3.2Å; S32-E58 PolarHBondContact O-N 3.49Å; L34-E58 HydrophobicContact CD1-CB 3.82Å; L34-E58 HydrophobicContact CG-CB 4.13Å; E58-T74 PolarHBondContact OE1-OG1 2.96Å
59	W	67.5	Low	76.6	Confident	68 Å²	68	48.4 Å²	48.4	26%	0.258	29%	0.288	S	S	.	.			trans	-95.1	128.6	179	-63.6	87.1	0	0	0	111.2	T57 L61 T74 T76 T148 N152	T57-W59 PolarHBondContact OG1-NE1 3.26Å; W59-L61 HydrophobicContact CB-CD2 4.2Å; W59-L61 HydrophobicContact CB-CG 3.84Å; W59-L61 PolarHBondContact O-N 2.97Å; W59-T74 PolarHBondContact N-O 3.21Å; W59-T74 VanDerWaalsContact N-O 3.1Å; W59-T76 PolarHBondContact NE1-OG1 2.63Å; W59-T148 HydrophobicContact CE3-CG2 4.24Å; W59-T148 HydrophobicContact CH2-CG2 3.72Å; W59-T148 HydrophobicContact CZ3-CG2 3.24Å; W59-N152 WeakPolarHBondContact CH2-ND2 3.3Å
60	G	59.4	Low	75.1	Confident	72 Å²	72	49.3 Å²	49.3	74%	0.742	31%	0.309	S	S	*	.			trans	-71.4	63.1	162.6	0	0	0	0	0	111.3
61	L	63.1	Low	73.4	Confident	36 Å²	36	50.6 Å²	50.6	19%	0.188	32%	0.319	C	S	.	.			trans	-65.1	132.4	177.8	-68.5	173.2	0	0	0	110	W59 V65 R66 L69	W59-L61 HydrophobicContact CB-CD2 4.2Å; W59-L61 HydrophobicContact CB-CG 3.84Å; W59-L61 PolarHBondContact O-N 2.97Å; L61-V65 HydrophobicContact CB-CB 4.42Å; L61-V65 HydrophobicContact CB-CG1 4.41Å; L61-V65 HydrophobicContact CD1-CG1 4.34Å; L61-V65 HydrophobicContact CD2-CG1 4.06Å; L61-R66 HydrophobicContact CB-CG 3.9Å; L61-R66 PolarHBondContact O-NE 3.36Å; L61-L69 HydrophobicContact CD1-CD1 3.67Å
62	P	62	Low	71.6	Confident	84 Å²	84	56 Å²	56	55%	0.545	36%	0.357	S	S	.	.			trans	-54.4	147.2	172.9	-24.3	32.8	0	0	0	111.2	L64 V65 R66	P62-L64 PolarHBondContact O-N 3.41Å; P62-L64 VanDerWaalsContact O-N 3.08Å; P62-V65 HydrophobicContact CB-CG2 4.46Å; P62-V65 HydrophobicContact CG-CG2 4.5Å; P62-V65 WeakPolarHBondContact O-CA 3.48Å; P62-V65 WeakPolarHBondContact O-CB 3.39Å; P62-V65 PolarHBondContact O-N 2.79Å; P62-R66 PolarHBondContact O-N 2.99Å; P62-R66 VanDerWaalsContact O-N 3.11Å
63	G	60	Low	70	Confident	56 Å²	56	64.2 Å²	64.2	58%	0.577	39%	0.385	S	S	*	.	H	α-helix	trans	-53.7	-35.1	-174.4	0	0	0	0	0	114.3	V65 R66 A67	G63-V65 PolarHBondContact O-N 3.02Å; G63-R66 PolarHBondContact O-N 3.25Å; G63-A67 WeakPolarHBondContact O-CB 3.45Å; G63-A67 PolarHBondContact O-N 2.86Å
64	L	62.4	Low	68.8	Low	118 Å²	118	64.5 Å²	64.5	62%	0.618	39%	0.389	S	S	*	.	H	α-helix	trans	-62.9	-40.6	175.5	-175.1	64.8	0	0	0	112.4	P62 A67 I68	P62-L64 PolarHBondContact O-N 3.41Å; P62-L64 VanDerWaalsContact O-N 3.08Å; L64-A67 PolarHBondContact O-N 2.86Å; L64-I68 HydrophobicContact CD1-CD1 4.39Å; L64-I68 HydrophobicContact CG-CD1 4.05Å; L64-I68 VanDerWaalsContact O-CG1 3.26Å; L64-I68 WeakPolarHBondContact O-CG1 3.39Å; L64-I68 PolarHBondContact O-N 2.77Å
65	V	63.8	Low	68.1	Low	20 Å²	20	65.6 Å²	65.6	12%	0.121	39%	0.394	C	S	.	.	H	α-helix	trans	-70.4	-39.1	178.4	-178.9	0	0	0	0	110.1	L61 P62 G63 A67 I68 L69 L141	L61-V65 HydrophobicContact CB-CB 4.42Å; L61-V65 HydrophobicContact CB-CG1 4.41Å; L61-V65 HydrophobicContact CD1-CG1 4.34Å; L61-V65 HydrophobicContact CD2-CG1 4.06Å; P62-V65 HydrophobicContact CB-CG2 4.46Å; P62-V65 HydrophobicContact CG-CG2 4.5Å; P62-V65 WeakPolarHBondContact O-CA 3.48Å; P62-V65 WeakPolarHBondContact O-CB 3.39Å; P62-V65 PolarHBondContact O-N 2.79Å; G63-V65 PolarHBondContact O-N 3.02Å; V65-A67 VanDerWaalsContact C-N 3.32Å; V65-A67 PolarHBondContact O-N 2.82Å; V65-I68 PolarHBondContact O-N 3.36Å; V65-L69 HydrophobicContact CG1-CD1 3.61Å; V65-L69 HydrophobicContact CG1-CG 4.07Å; V65-L69 WeakPolarHBondContact O-CB 3.43Å; V65-L69 WeakPolarHBondContact O-CG 3.45Å; V65-L69 PolarHBondContact O-N 2.84Å; V65-L141 HydrophobicContact CG2-CD2 4.36Å
66	R	67.4	Low	67.7	Low	103 Å²	103	66 Å²	66	39%	0.389	40%	0.397	S	S	.	.	H	α-helix	trans	-60.9	-41.8	173	-63.2	-176.5	-173.4	-162.5	-4.5	112	L61 P62 G63 L69 G70 T74	L61-R66 HydrophobicContact CB-CG 3.9Å; L61-R66 PolarHBondContact O-NE 3.36Å; P62-R66 PolarHBondContact O-N 2.99Å; P62-R66 VanDerWaalsContact O-N 3.11Å; G63-R66 PolarHBondContact O-N 3.25Å; R66-L69 PolarHBondContact O-N 2.99Å; R66-G70 PolarHBondContact O-N 2.79Å; R66-T74 VanDerWaalsContact CZ-CG2 3.42Å; R66-T74 VanDerWaalsContact NH2-CG2 3.28Å
67	A	67.4	Low	67.7	Low	77 Å²	77	69.2 Å²	69.2	64%	0.636	41%	0.406	S	S	*	.	H	α-helix	trans	-65.3	-41.3	177.5	0	0	0	0	0	112.3	G63 L64 V65 G70	G63-A67 WeakPolarHBondContact O-CB 3.45Å; G63-A67 PolarHBondContact O-N 2.86Å; L64-A67 PolarHBondContact O-N 2.86Å; V65-A67 VanDerWaalsContact C-N 3.32Å; V65-A67 PolarHBondContact O-N 2.82Å; A67-G70 PolarHBondContact O-N 2.82Å
68	I	65.2	Low	68	Low	69 Å²	69	70.6 Å²	70.6	35%	0.354	41%	0.413	S	S	.	.	H	α-helix	trans	-68.7	-40.8	176.9	-68.4	165.9	0	0	0	111.6	L64 V65 G70 I135 L137	L64-I68 HydrophobicContact CD1-CD1 4.39Å; L64-I68 HydrophobicContact CG-CD1 4.05Å; L64-I68 VanDerWaalsContact O-CG1 3.26Å; L64-I68 WeakPolarHBondContact O-CG1 3.39Å; L64-I68 PolarHBondContact O-N 2.77Å; V65-I68 PolarHBondContact O-N 3.36Å; I68-G70 VanDerWaalsContact C-N 3.26Å; I68-G70 PolarHBondContact O-N 2.88Å; I68-I135 HydrophobicContact CG2-CD1 4.43Å; I68-L137 HydrophobicContact CD1-CD1 4.5Å
69	L	63.8	Low	68.7	Low	26 Å²	26	70.6 Å²	70.6	14%	0.136	41%	0.413	C	S	.	.	H	α-helix	trans	-75.2	-16.3	-179.8	-65.7	173.6	0	0	0	112.6	L61 V65 R66 T71 L100 L103	L61-L69 HydrophobicContact CD1-CD1 3.67Å; V65-L69 HydrophobicContact CG1-CD1 3.61Å; V65-L69 HydrophobicContact CG1-CG 4.07Å; V65-L69 WeakPolarHBondContact O-CB 3.43Å; V65-L69 WeakPolarHBondContact O-CG 3.45Å; V65-L69 PolarHBondContact O-N 2.84Å; R66-L69 PolarHBondContact O-N 2.99Å; L69-T71 WeakPolarHBondContact O-CG2 3.23Å; L69-T71 PolarHBondContact O-N 2.81Å; L69-T71 VanDerWaalsContact O-N 3.13Å; L69-L100 HydrophobicContact CD1-CD1 4.05Å; L69-L103 HydrophobicContact CD2-CB 4.31Å; L69-L103 HydrophobicContact CD2-CD1 3.39Å; L69-L103 HydrophobicContact CD2-CG 4.44Å
70	G	61.5	Low	70	Confident	71 Å²	71	68 Å²	68	73%	0.732	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	13.4	179.8	0	0	0	0	0	114.1	R66 A67 I68	R66-G70 PolarHBondContact O-N 2.79Å; A67-G70 PolarHBondContact O-N 2.82Å; I68-G70 VanDerWaalsContact C-N 3.26Å; I68-G70 PolarHBondContact O-N 2.88Å
71	T	61.2	Low	71.7	Confident	46 Å²	46	67.8 Å²	67.8	28%	0.282	38%	0.383	S	S	.	.			trans	-108.3	119.5	-177	59.9	0	0	0	0	110.9	L69 R73 L100	L69-T71 WeakPolarHBondContact O-CG2 3.23Å; L69-T71 PolarHBondContact O-N 2.81Å; L69-T71 VanDerWaalsContact O-N 3.13Å; T71-R73 PolarHBondContact O-N 3.25Å; T71-L100 HydrophobicContact CG2-CD2 4.04Å
72	S	56.4	Low	73.2	Confident	115 Å²	115	66.1 Å²	66.1	80%	0.804	37%	0.374	S	S	*	.	S	Bend	trans	-72	-18.7	167.7	55.4	0	0	0	0	112.7
73	R	60.5	Low	74.8	Confident	206 Å²	206	63.3 Å²	63.3	78%	0.777	36%	0.356	S	S	*	.			trans	-85	119.8	179.1	-64.6	-175.9	176.4	-179.1	-1.5	110.2	T71 L75	T71-R73 PolarHBondContact O-N 3.25Å; R73-L75 VanDerWaalsContact C-N 3.35Å
74	T	68.8	Low	76.5	Confident	19 Å²	19	61.4 Å²	61.4	12%	0.117	33%	0.333	C	S	.	.			trans	-85.5	-10.4	174.6	40.2	0	0	0	0	112.9	E58 W59 R66	E58-T74 PolarHBondContact OE1-OG1 2.96Å; W59-T74 PolarHBondContact N-O 3.21Å; W59-T74 VanDerWaalsContact N-O 3.1Å; R66-T74 VanDerWaalsContact CZ-CG2 3.42Å; R66-T74 VanDerWaalsContact NH2-CG2 3.28Å
75	L	78.3	Confident	78	Confident	63 Å²	63	56.8 Å²	56.8	33%	0.33	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	121.5	-179.7	-168	68.2	0	0	0	111	L34 R73 Y77	L34-L75 HydrophobicContact CD1-CD1 3.77Å; R73-L75 VanDerWaalsContact C-N 3.35Å; L75-Y77 HydrophobicContact CD2-CE1 4.28Å; L75-Y77 HydrophobicContact CD2-CE2 4.38Å; L75-Y77 VanDerWaalsContact CD2-OH 3.27Å; L75-Y77 WeakPolarHBondContact CD2-OH 3.39Å
76	T	81.9	Confident	79.2	Confident	15 Å²	15	59.5 Å²	59.5	9%	0.092	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	151.4	175.8	62.5	0	0	0	0	110.6	T57 W59 T99 L100	T57-T76 PolarHBondContact N-O 3.46Å; T57-T76 PolarHBondContact O-N 3.02Å; T57-T76 PolarHBondContact O-OG1 3.41Å; T57-T76 PolarHBondContact OG1-OG1 2.98Å; W59-T76 PolarHBondContact NE1-OG1 2.63Å; T76-T99 VanDerWaalsContact CA-OG1 3.27Å; T76-T99 WeakPolarHBondContact CA-OG1 3.5Å; T76-T99 WeakPolarHBondContact CB-OG1 3.22Å; T76-L100 HydrophobicContact CG2-CD1 4.35Å
77	Y	88.1	Confident	80.3	Confident	93 Å²	93	60.6 Å²	60.6	37%	0.365	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.4	178.4	-62.3	-73.9	0	0	0	110.2	L54 L55 L75 I98 T99	L54-Y77 HydrophobicContact CD1-CD1 4.43Å; L54-Y77 HydrophobicContact CD2-CD1 4.5Å; L54-Y77 HydrophobicContact CG-CD1 4.5Å; L55-Y77 WeakPolarHBondContact O-CA 3.47Å; L75-Y77 HydrophobicContact CD2-CE1 4.28Å; L75-Y77 HydrophobicContact CD2-CE2 4.38Å; L75-Y77 VanDerWaalsContact CD2-OH 3.27Å; L75-Y77 WeakPolarHBondContact CD2-OH 3.39Å; Y77-I98 PolarHBondContact O-N 2.68Å; Y77-T99 HydrophobicContact CD2-CG2 3.57Å; Y77-T99 HydrophobicContact CG-CG2 4.28Å; Y77-T99 PolarHBondContact N-OG1 2.91Å; Y77-T99 PolarHBondContact O-N 2.94Å
78	I	90.2	Very high	81.3	Confident	36 Å²	36	63.4 Å²	63.4	19%	0.185	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.8	178.1	-58	168.2	0	0	0	107.4	L55 T57	L55-I78 HydrophobicContact CB-CB 4.3Å; L55-I78 PolarHBondContact N-O 3.41Å; L55-I78 PolarHBondContact O-N 2.81Å; T57-I78 HydrophobicContact CG2-CD1 4.09Å
79	Q	93.5	Very high	82.6	Confident	89 Å²	89	64.4 Å²	64.4	42%	0.416	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.2	169.5	-172.4	174.2	-29.5	0	0	108.4	L52 S95 T96 I98	L52-Q79 HydrophobicContact CD1-CG 3.7Å; Q79-S95 CarbonylContact O-C 2.94Å; Q79-S95 WeakPolarHBondContact O-CA 3.37Å; Q79-T96 PolarHBondContact N-O 3.01Å; Q79-T96 PolarHBondContact O-N 2.94Å; Q79-I98 HydrophobicContact CB-CD1 3.79Å; Q79-I98 HydrophobicContact CB-CG1 3.86Å
80	E	94.5	Very high	84	Confident	13 Å²	13	66.9 Å²	66.9	6%	0.061	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.1	176.4	-176	-170.5	87.1	0	0	109.4	L52 R53 L55 L93 C94 S95	L52-E80 CarbonylContact C-O 3.51Å; L52-E80 WeakPolarHBondContact CA-O 3.21Å; R53-E80 HydrophobicContact CB-CB 4.35Å; R53-E80 IonicContact CZ-OE1 2.79Å; R53-E80 PolarHBondContact N-O 3.43Å; R53-E80 IonicContact NE-OE1 3.94Å; R53-E80 PolarHBondContact NE-OE1 2.71Å; R53-E80 IonicContact NH2-OE1 2.68Å; R53-E80 PolarHBondContact NH2-OE1 2.77Å; R53-E80 IonicContact NH2-OE2 2.63Å; R53-E80 PolarHBondContact O-N 3.22Å; L55-E80 HydrophobicContact CD1-CB 3.59Å; E80-L93 HydrophobicContact CG-CD1 4.12Å; E80-L93 HydrophobicContact CG-CD2 3.64Å; E80-L93 HydrophobicContact CG-CG 3.72Å; E80-C94 CarbonylContact C-O 3.56Å; E80-C94 WeakPolarHBondContact CA-O 3.41Å; E80-S95 WeakPolarHBondContact CG-OG 3.37Å
81	H	95.2	Very high	85.6	Confident	69 Å²	69	63.5 Å²	63.5	32%	0.319	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.9	175.4	-179.8	-106.2	0	0	0	109.2	H50 S51 L52 V83 L93 C94	H50-H81 AromaticContact ND1-CE1 3.83Å; H50-H81 AromaticContact ND1-NE2 3.75Å; S51-H81 WeakPolarHBondContact O-CA 3.49Å; L52-H81 HydrophobicContact CD1-CB 4.32Å; H81-V83 WeakPolarHBondContact CE1-CG2 3.41Å; H81-L93 WeakPolarHBondContact O-CA 3.45Å; H81-C94 PolarHBondContact N-O 2.79Å; H81-C94 PolarHBondContact O-N 2.85Å
82	S	94.9	Very high	87.2	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.5	176.4	63.6	0	0	0	0	112.1	H50 S51 E92	H50-S82 CarbonylContact C-O 3.59Å; H50-S82 WeakPolarHBondContact CA-O 3.13Å; S51-S82 WeakPolarHBondContact CB-OG 3.41Å; S51-S82 PolarHBondContact N-O 3.32Å; S51-S82 PolarHBondContact O-N 3.45Å; S82-E92 CarbonylContact C-O 3.58Å; S82-E92 VanDerWaalsContact CA-O 3.23Å; S82-E92 WeakPolarHBondContact CA-O 3.4Å
83	V	95.5	Very high	89	Confident	26 Å²	26	59.2 Å²	59.2	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.9	175.5	-174.4	0	0	0	0	107.8	R48 L49 H81 M91 E92	R48-V83 HydrophobicContact CB-CG1 4.25Å; L49-V83 CarbonylContact O-C 3.55Å; L49-V83 VanDerWaalsContact O-CA 3.32Å; L49-V83 WeakPolarHBondContact O-CA 3.29Å; H81-V83 WeakPolarHBondContact CE1-CG2 3.41Å; V83-M91 WeakPolarHBondContact O-CA 3.45Å; V83-E92 PolarHBondContact N-O 3.26Å; V83-E92 PolarHBondContact O-N 3.48Å
84	V	95.1	Very high	90.6	Very high	16 Å²	16	51.2 Å²	51.2	10%	0.097	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	121.2	176.2	-172.2	0	0	0	0	109.2	W14 I18 M22 R48 L49 M91	W14-V84 HydrophobicContact CH2-CG1 3.73Å; W14-V84 HydrophobicContact CZ2-CG1 4.04Å; I18-V84 HydrophobicContact CG2-CG1 4.35Å; M22-V84 HydrophobicContact CE-CG2 3.35Å; R48-V84 CarbonylContact C-O 3.55Å; R48-V84 VanDerWaalsContact CA-O 3.26Å; R48-V84 WeakPolarHBondContact CA-O 3.41Å; R48-V84 WeakPolarHBondContact CB-O 3.3Å; L49-V84 HydrophobicContact CB-CB 4.27Å; L49-V84 PolarHBondContact N-O 3.47Å; L49-V84 PolarHBondContact O-N 3.39Å; V84-M91 HydrophobicContact CG2-CB 4.24Å; V84-M91 HydrophobicContact CG2-CG 3.93Å; V84-M91 HydrophobicContact CG2-SD 3.96Å
85	D	94	Very high	91.7	Very high	21 Å²	21	50.9 Å²	50.9	11%	0.112	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	108.9	171.7	-164.8	-40.8	0	0	0	109.4	R48 V87 E88 K89 K90	R48-D85 WeakPolarHBondContact CD-OD2 3.36Å; R48-D85 HydrophobicContact CG-CB 4.04Å; R48-D85 WeakPolarHBondContact CG-OD2 3.23Å; D85-V87 VanDerWaalsContact C-N 3.31Å; D85-V87 WeakPolarHBondContact OD1-CA 3.35Å; D85-V87 WeakPolarHBondContact OD1-CB 3.44Å; D85-V87 PolarHBondContact OD1-N 3.17Å; D85-E88 HydrophobicContact CB-CB 4.31Å; D85-E88 PolarHBondContact OD1-N 3.22Å; D85-K89 VanDerWaalsContact O-CA 3.31Å; D85-K89 WeakPolarHBondContact O-CA 3.32Å; D85-K89 PolarHBondContact O-N 2.85Å; D85-K89 VanDerWaalsContact O-N 3.1Å; D85-K90 PolarHBondContact N-O 3.2Å; D85-K90 PolarHBondContact O-N 3.28Å
86	P	90	Very high	92.3	Very high	77 Å²	77	50 Å²	50	50%	0.5	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-19.9	179.4	31	-34.5	0	0	0	113.2
87	V	89.9	Confident	92.6	Very high	125 Å²	125	50.4 Å²	50.4	76%	0.758	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-49.2	-178.8	177.5	0	0	0	0	109.7	D85 K89	D85-V87 VanDerWaalsContact C-N 3.31Å; D85-V87 WeakPolarHBondContact OD1-CA 3.35Å; D85-V87 WeakPolarHBondContact OD1-CB 3.44Å; D85-V87 PolarHBondContact OD1-N 3.17Å; V87-K89 PolarHBondContact O-N 3.11Å
88	E	89.8	Confident	92.6	Very high	137 Å²	137	49.8 Å²	49.8	64%	0.64	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-5.5	176.1	-66	-171	171.2	0	0	113	D85 K90	D85-E88 HydrophobicContact CB-CB 4.31Å; D85-E88 PolarHBondContact OD1-N 3.22Å; E88-K90 VanDerWaalsContact C-N 3.32Å; E88-K90 HydrophobicContact CB-CB 4.31Å; E88-K90 PolarHBondContact O-N 2.93Å
89	K	91.6	Very high	92.1	Very high	90 Å²	90	49.8 Å²	49.8	39%	0.391	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	55.2	-170.3	-65.7	-166.2	173.8	-154.2	0	111.1	W14 D15 D85 V87 P114	W14-K89 HydrophobicContact CD2-CB 3.97Å; W14-K89 VanDerWaalsContact CE2-O 3.32Å; W14-K89 HydrophobicContact CE3-CB 4.05Å; W14-K89 HydrophobicContact CE3-CD 4.39Å; W14-K89 HydrophobicContact CE3-CG 4.19Å; W14-K89 HydrophobicContact CG-CB 4.42Å; W14-K89 HydrophobicContact CZ2-CB 4.48Å; W14-K89 HydrophobicContact CZ3-CB 4.35Å; W14-K89 HydrophobicContact CZ3-CG 4.36Å; W14-K89 PolarHBondContact NE1-O 3.28Å; W14-K89 VanDerWaalsContact NE1-O 3.08Å; D15-K89 IonicContact OD2-NZ 3.22Å; D15-K89 PolarHBondContact OD2-NZ 3.43Å; D85-K89 VanDerWaalsContact O-CA 3.31Å; D85-K89 WeakPolarHBondContact O-CA 3.32Å; D85-K89 PolarHBondContact O-N 2.85Å; D85-K89 VanDerWaalsContact O-N 3.1Å; V87-K89 PolarHBondContact O-N 3.11Å; K89-P114 HydrophobicContact CB-CG 3.73Å; K89-P114 HydrophobicContact CD-CG 4.17Å; K89-P114 WeakPolarHBondContact O-CD 3.37Å
90	K	93.9	Very high	91.2	Very high	77 Å²	77	48 Å²	48	34%	0.335	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	129.2	-177.7	-176.2	176	176.3	-176.6	0	110.3	D85 E88 V111 Y112 T113	D85-K90 PolarHBondContact N-O 3.2Å; D85-K90 PolarHBondContact O-N 3.28Å; E88-K90 VanDerWaalsContact C-N 3.32Å; E88-K90 HydrophobicContact CB-CB 4.31Å; E88-K90 PolarHBondContact O-N 2.93Å; K90-V111 HydrophobicContact CG-CG1 4.36Å; K90-Y112 WeakPolarHBondContact CA-O 3.27Å; K90-T113 HydrophobicContact CB-CG2 4.4Å; K90-T113 HydrophobicContact CD-CG2 4.36Å; K90-T113 HydrophobicContact CG-CG2 3.95Å
91	M	94.5	Very high	90.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.7	169.2	171.4	171.9	169.6	0	0	109.4	W14 I18 M22 V83 V84 L93 V111 Y112	W14-M91 HydrophobicContact CZ2-CB 4.3Å; I18-M91 HydrophobicContact CB-SD 4.43Å; I18-M91 HydrophobicContact CD1-CB 3.59Å; I18-M91 HydrophobicContact CD1-CG 4.19Å; I18-M91 HydrophobicContact CD1-SD 3.69Å; I18-M91 HydrophobicContact CG1-CB 4.18Å; I18-M91 HydrophobicContact CG1-SD 4.27Å; I18-M91 HydrophobicContact CG2-SD 3.78Å; M22-M91 HydrophobicContact CE-CE 3.65Å; M22-M91 HydrophobicContact CE-SD 3.8Å; M22-M91 HydrophobicContact SD-CE 4.38Å; V83-M91 WeakPolarHBondContact O-CA 3.45Å; V84-M91 HydrophobicContact CG2-CB 4.24Å; V84-M91 HydrophobicContact CG2-CG 3.93Å; V84-M91 HydrophobicContact CG2-SD 3.96Å; M91-L93 HydrophobicContact CE-CB 4.3Å; M91-L93 HydrophobicContact CE-CD1 3.71Å; M91-V111 CarbonylContact O-C 3.49Å; M91-V111 WeakPolarHBondContact O-CA 3.45Å; M91-Y112 HydrophobicContact CB-CD2 4.28Å; M91-Y112 HydrophobicContact CG-CD2 4.12Å; M91-Y112 PolarHBondContact N-O 3.27Å; M91-Y112 PolarHBondContact O-N 2.84Å; M91-Y112 HydrophobicContact SD-CD2 4.45Å
92	E	95	Very high	89.4	Confident	61 Å²	61	53 Å²	53	29%	0.285	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.9	171.7	-176	168.5	-171.6	0	0	109	S82 V83 R109 L110 V111	S82-E92 CarbonylContact C-O 3.58Å; S82-E92 VanDerWaalsContact CA-O 3.23Å; S82-E92 WeakPolarHBondContact CA-O 3.4Å; V83-E92 PolarHBondContact N-O 3.26Å; V83-E92 PolarHBondContact O-N 3.48Å; E92-R109 WeakPolarHBondContact OE1-CD 3.44Å; E92-R109 IonicContact OE1-NH1 3.99Å; E92-L110 CarbonylContact C-O 3.58Å; E92-L110 WeakPolarHBondContact CA-O 3.43Å; E92-V111 HydrophobicContact CG-CG2 4.31Å
93	L	94.1	Very high	88.5	Confident	10 Å²	10	55.4 Å²	55.4	5%	0.052	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	121.9	179.8	-175.9	155.7	0	0	0	108.8	E80 H81 M91 S95 R109 L110	E80-L93 HydrophobicContact CG-CD1 4.12Å; E80-L93 HydrophobicContact CG-CD2 3.64Å; E80-L93 HydrophobicContact CG-CG 3.72Å; H81-L93 WeakPolarHBondContact O-CA 3.45Å; M91-L93 HydrophobicContact CE-CB 4.3Å; M91-L93 HydrophobicContact CE-CD1 3.71Å; L93-S95 WeakPolarHBondContact CD2-OG 3.32Å; L93-R109 CarbonylContact O-C 3.59Å; L93-R109 WeakPolarHBondContact O-CA 3.5Å; L93-L110 HydrophobicContact CB-CB 4.32Å; L93-L110 HydrophobicContact CD2-CD1 4.1Å; L93-L110 PolarHBondContact N-O 3.04Å; L93-L110 PolarHBondContact O-N 3.05Å
94	C	94	Very high	87.6	Confident	38 Å²	38	54.9 Å²	54.9	26%	0.257	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.6	-179.7	-64.5	0	0	0	0	109.3	E80 H81 E108	E80-C94 CarbonylContact C-O 3.56Å; E80-C94 WeakPolarHBondContact CA-O 3.41Å; H81-C94 PolarHBondContact N-O 2.79Å; H81-C94 PolarHBondContact O-N 2.85Å; C94-E108 CarbonylContact C-O 3.49Å; C94-E108 VanDerWaalsContact CA-O 3.32Å; C94-E108 WeakPolarHBondContact CA-O 3.27Å
95	S	92.3	Very high	87.1	Confident	12 Å²	12	55.7 Å²	55.7	8%	0.084	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	134.5	178.6	-65.9	0	0	0	0	110.3	Q79 E80 L93 N107 E108	Q79-S95 CarbonylContact O-C 2.94Å; Q79-S95 WeakPolarHBondContact O-CA 3.37Å; E80-S95 WeakPolarHBondContact CG-OG 3.37Å; L93-S95 WeakPolarHBondContact CD2-OG 3.32Å; S95-N107 WeakPolarHBondContact O-CA 3.41Å; S95-E108 PolarHBondContact N-O 3.21Å; S95-E108 PolarHBondContact O-N 2.82Å
96	T	91.2	Very high	86.7	Confident	46 Å²	46	56 Å²	56	28%	0.282	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	134.8	176.5	-58.5	0	0	0	0	109.9	Q79 V106 N107	Q79-T96 PolarHBondContact N-O 3.01Å; Q79-T96 PolarHBondContact O-N 2.94Å; T96-V106 WeakPolarHBondContact CA-O 3.38Å; T96-N107 PolarHBondContact OG1-ND2 2.84Å
97	N	87.8	Confident	86.6	Confident	23 Å²	23	55.5 Å²	55.5	12%	0.123	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	135.6	174.3	67.7	-63	0	0	0	110.8	T99 T101 V104 S105 V106	N97-T99 PolarHBondContact ND2-O 2.83Å; N97-T101 WeakPolarHBondContact O-CG2 3.38Å; N97-V104 PolarHBondContact ND2-O 3.19Å; N97-S105 WeakPolarHBondContact OD1-CA 3.41Å; N97-V106 PolarHBondContact N-O 3.03Å; N97-V106 PolarHBondContact OD1-N 3.5Å; N97-V106 PolarHBondContact OD1-O 2.78Å
98	I	87.1	Confident	86.7	Confident	79 Å²	79	51.6 Å²	51.6	41%	0.405	27%	0.271	S	S	.	.			trans	-90.3	-43.7	173.3	-61.4	160.7	0	0	0	109.6	L54 Y77 Q79 T101	L54-I98 HydrophobicContact CD1-CD1 3.55Å; Y77-I98 PolarHBondContact O-N 2.68Å; Q79-I98 HydrophobicContact CB-CD1 3.79Å; Q79-I98 HydrophobicContact CB-CG1 3.86Å; I98-T101 WeakPolarHBondContact O-CG2 3.42Å; I98-T101 PolarHBondContact O-OG1 3.39Å
99	T	80.9	Confident	86.9	Confident	36 Å²	36	49.9 Å²	49.9	22%	0.221	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	147.4	179.4	48.4	0	0	0	0	111.6	T76 Y77 N97 T101	T76-T99 VanDerWaalsContact CA-OG1 3.27Å; T76-T99 WeakPolarHBondContact CA-OG1 3.5Å; T76-T99 WeakPolarHBondContact CB-OG1 3.22Å; Y77-T99 HydrophobicContact CD2-CG2 3.57Å; Y77-T99 HydrophobicContact CG-CG2 4.28Å; Y77-T99 PolarHBondContact N-OG1 2.91Å; Y77-T99 PolarHBondContact O-N 2.94Å; N97-T99 PolarHBondContact ND2-O 2.83Å; T99-T101 PolarHBondContact O-N 2.8Å
100	L	74.9	Confident	87	Confident	53 Å²	53	46 Å²	46	28%	0.277	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	15.5	176.4	-55.5	172.2	0	0	0	115.2	L69 T71 T76 N102 L103 V104	L69-L100 HydrophobicContact CD1-CD1 4.05Å; T71-L100 HydrophobicContact CG2-CD2 4.04Å; T76-L100 HydrophobicContact CG2-CD1 4.35Å; L100-N102 PolarHBondContact O-N 2.88Å; L100-N102 VanDerWaalsContact O-N 3.1Å; L100-L103 HydrophobicContact CD2-CD1 4.3Å; L100-L103 PolarHBondContact O-N 2.78Å; L100-V104 CarbonylContact C-O 3.56Å; L100-V104 PolarHBondContact O-N 2.82Å; L100-V104 VanDerWaalsContact O-O 3.06Å
101	T	77.8	Confident	87.1	Confident	49 Å²	49	43.3 Å²	43.3	30%	0.301	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.4	177	46.1	0	0	0	0	114.2	N97 I98 T99 L103 V104	N97-T101 WeakPolarHBondContact O-CG2 3.38Å; I98-T101 WeakPolarHBondContact O-CG2 3.42Å; I98-T101 PolarHBondContact O-OG1 3.39Å; T99-T101 PolarHBondContact O-N 2.8Å; T101-L103 PolarHBondContact O-N 2.83Å; T101-V104 WeakPolarHBondContact CA-O 3.4Å
102	N	74.1	Confident	87.1	Confident	138 Å²	138	43.5 Å²	43.5	74%	0.738	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-25	173.5	-65.8	-19	0	0	0	112.9	L100	L100-N102 PolarHBondContact O-N 2.88Å; L100-N102 VanDerWaalsContact O-N 3.1Å
103	L	75	Confident	87	Confident	49 Å²	49	42.7 Å²	42.7	26%	0.257	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-49.3	-176.4	-60.9	171.1	0	0	0	110.9	L69 L100 T101 V132 K133 I135	L69-L103 HydrophobicContact CD2-CB 4.31Å; L69-L103 HydrophobicContact CD2-CD1 3.39Å; L69-L103 HydrophobicContact CD2-CG 4.44Å; L100-L103 HydrophobicContact CD2-CD1 4.3Å; L100-L103 PolarHBondContact O-N 2.78Å; T101-L103 PolarHBondContact O-N 2.83Å; L103-V132 WeakPolarHBondContact O-CA 3.37Å; L103-K133 PolarHBondContact O-N 2.79Å; L103-I135 HydrophobicContact CD2-CD1 4.33Å
104	V	77.1	Confident	87	Confident	16 Å²	16	44 Å²	44	10%	0.097	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	128.1	-179.6	-171.4	0	0	0	0	110	N97 L100 T101 V106 I130 T131 V132 M145	N97-V104 PolarHBondContact ND2-O 3.19Å; L100-V104 CarbonylContact C-O 3.56Å; L100-V104 PolarHBondContact O-N 2.82Å; L100-V104 VanDerWaalsContact O-O 3.06Å; T101-V104 WeakPolarHBondContact CA-O 3.4Å; V104-V106 HydrophobicContact CG1-CG2 4.08Å; V104-I130 HydrophobicContact CG1-CG2 4.24Å; V104-T131 WeakPolarHBondContact CA-O 3.38Å; V104-V132 HydrophobicContact CG1-CG2 4.17Å; V104-V132 HydrophobicContact CG2-CG1 4.48Å; V104-V132 HydrophobicContact CG2-CG2 4.1Å; V104-M145 HydrophobicContact CG1-CE 3.98Å
105	S	84.2	Confident	86.9	Confident	33 Å²	33	44.5 Å²	44.5	23%	0.231	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.2	170.5	-168.4	0	0	0	0	108.8	N97 T131	N97-S105 WeakPolarHBondContact OD1-CA 3.41Å; S105-T131 PolarHBondContact N-O 2.84Å; S105-T131 PolarHBondContact O-N 3.19Å
106	V	84.8	Confident	86.7	Confident	26 Å²	26	49.6 Å²	49.6	16%	0.158	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.8	174.4	-177.8	0	0	0	0	107	T96 N97 V104 I129 I130 M145 I149	T96-V106 WeakPolarHBondContact CA-O 3.38Å; N97-V106 PolarHBondContact N-O 3.03Å; N97-V106 PolarHBondContact OD1-N 3.5Å; N97-V106 PolarHBondContact OD1-O 2.78Å; V104-V106 HydrophobicContact CG1-CG2 4.08Å; V106-I129 WeakPolarHBondContact CA-O 3.4Å; V106-I130 HydrophobicContact CG2-CG2 4.48Å; V106-M145 HydrophobicContact CG2-CE 3.87Å; V106-I149 HydrophobicContact CG1-CD1 3.54Å; V106-I149 HydrophobicContact CG2-CD1 4.5Å
107	N	89.4	Confident	86.6	Confident	67 Å²	67	55.6 Å²	55.6	36%	0.358	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.9	171.8	-167.1	-70.6	0	0	0	107.6	S95 T96 A128 I129	S95-N107 WeakPolarHBondContact O-CA 3.41Å; T96-N107 PolarHBondContact OG1-ND2 2.84Å; N107-A128 CarbonylContact O-C 3.51Å; N107-A128 WeakPolarHBondContact O-CA 3.44Å; N107-I129 PolarHBondContact N-O 2.81Å; N107-I129 PolarHBondContact O-N 2.9Å
108	E	91.3	Very high	86.7	Confident	44 Å²	44	57.1 Å²	57.1	21%	0.206	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	132.3	-179.6	-163.6	-171.5	-160.6	0	0	108.9	C94 S95 L110 E127 A128	C94-E108 CarbonylContact C-O 3.49Å; C94-E108 VanDerWaalsContact CA-O 3.32Å; C94-E108 WeakPolarHBondContact CA-O 3.27Å; S95-E108 PolarHBondContact N-O 3.21Å; S95-E108 PolarHBondContact O-N 2.82Å; E108-L110 HydrophobicContact CB-CD1 4.44Å; E108-L110 HydrophobicContact CG-CD1 3.61Å; E108-E127 CarbonylContact C-O 3.58Å; E108-E127 VanDerWaalsContact CA-O 3.31Å; E108-E127 WeakPolarHBondContact CA-O 3.42Å; E108-A128 HydrophobicContact CG-CB 4.2Å
109	R	93.8	Very high	86.6	Confident	101 Å²	101	57.9 Å²	57.9	38%	0.381	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.1	177.7	-175.9	172.7	77.4	147.4	0.2	109.3	E92 L93 V111 Q126 E127	E92-R109 WeakPolarHBondContact OE1-CD 3.44Å; E92-R109 IonicContact OE1-NH1 3.99Å; L93-R109 CarbonylContact O-C 3.59Å; L93-R109 WeakPolarHBondContact O-CA 3.5Å; R109-V111 HydrophobicContact CG-CG2 4.37Å; R109-Q126 CarbonylContact O-C 3.57Å; R109-Q126 WeakPolarHBondContact O-CA 3.31Å; R109-E127 IonicContact CZ-OE2 2.91Å; R109-E127 PolarHBondContact N-O 2.91Å; R109-E127 IonicContact NE-OE2 2.67Å; R109-E127 PolarHBondContact NE-OE2 2.67Å; R109-E127 IonicContact NH2-OE1 3.78Å; R109-E127 IonicContact NH2-OE2 3.7Å; R109-E127 PolarHBondContact NH2-OE2 3.1Å; R109-E127 PolarHBondContact O-N 2.86Å
110	L	94.2	Very high	87	Confident	7 Å²	7	61.9 Å²	61.9	4%	0.037	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.6	177	-70.3	76	0	0	0	108.4	E92 L93 E108 Y112 L124 T125 Q126	E92-L110 CarbonylContact C-O 3.58Å; E92-L110 WeakPolarHBondContact CA-O 3.43Å; L93-L110 HydrophobicContact CB-CB 4.32Å; L93-L110 HydrophobicContact CD2-CD1 4.1Å; L93-L110 PolarHBondContact N-O 3.04Å; L93-L110 PolarHBondContact O-N 3.05Å; E108-L110 HydrophobicContact CB-CD1 4.44Å; E108-L110 HydrophobicContact CG-CD1 3.61Å; L110-Y112 HydrophobicContact CB-CE2 4.01Å; L110-Y112 HydrophobicContact CD2-CE2 4.32Å; L110-L124 HydrophobicContact CB-CD1 3.95Å; L110-L124 HydrophobicContact CD2-CD1 4.23Å; L110-L124 HydrophobicContact CG-CD1 4.29Å; L110-T125 CarbonylContact C-O 3.58Å; L110-T125 WeakPolarHBondContact CA-O 3.47Å; L110-Q126 HydrophobicContact CD2-CG 4.32Å; L110-Q126 HydrophobicContact CG-CB 4.45Å; L110-Q126 HydrophobicContact CG-CG 3.95Å
111	V	95.4	Very high	87.9	Confident	21 Å²	21	62.6 Å²	62.6	13%	0.127	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.4	177.2	-176.9	0	0	0	0	108.6	K90 M91 E92 R109 T113 L124 T125	K90-V111 HydrophobicContact CG-CG1 4.36Å; M91-V111 CarbonylContact O-C 3.49Å; M91-V111 WeakPolarHBondContact O-CA 3.45Å; E92-V111 HydrophobicContact CG-CG2 4.31Å; R109-V111 HydrophobicContact CG-CG2 4.37Å; V111-T113 HydrophobicContact CG1-CG2 4.11Å; V111-L124 WeakPolarHBondContact O-CA 3.33Å; V111-T125 PolarHBondContact N-O 2.85Å; V111-T125 PolarHBondContact O-N 2.89Å
112	Y	94.3	Very high	88.7	Confident	5 Å²	5	60.3 Å²	60.3	2%	0.02	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.5	176.9	-59.7	-99.7	0	0	0	109.4	F10 W14 V17 I18 K90 M91 L110 T122 V123 L124 I160	F10-Y112 HydrophobicContact CE2-CD1 4.47Å; F10-Y112 HydrophobicContact CE2-CE1 4.07Å; W14-Y112 PolarHBondContact NE1-O 2.79Å; V17-Y112 HydrophobicContact CG1-CD1 3.85Å; V17-Y112 HydrophobicContact CG1-CE1 4.05Å; I18-Y112 HydrophobicContact CD1-CD1 4.29Å; I18-Y112 HydrophobicContact CD1-CD2 4.41Å; I18-Y112 HydrophobicContact CD1-CG 3.89Å; K90-Y112 WeakPolarHBondContact CA-O 3.27Å; M91-Y112 HydrophobicContact CB-CD2 4.28Å; M91-Y112 HydrophobicContact CG-CD2 4.12Å; M91-Y112 PolarHBondContact N-O 3.27Å; M91-Y112 PolarHBondContact O-N 2.84Å; M91-Y112 HydrophobicContact SD-CD2 4.45Å; L110-Y112 HydrophobicContact CB-CE2 4.01Å; L110-Y112 HydrophobicContact CD2-CE2 4.32Å; Y112-T122 HydrophobicContact CD1-CG2 4.46Å; Y112-V123 WeakPolarHBondContact CA-O 3.36Å; Y112-L124 HydrophobicContact CD1-CB 4.11Å; Y112-L124 HydrophobicContact CD1-CD1 3.87Å; Y112-L124 HydrophobicContact CD1-CG 4.4Å; Y112-L124 HydrophobicContact CD2-CD1 4.08Å; Y112-L124 HydrophobicContact CE1-CB 4.16Å; Y112-L124 HydrophobicContact CE1-CD1 3.62Å; Y112-L124 HydrophobicContact CE1-CD2 3.84Å; Y112-L124 HydrophobicContact CE1-CG 4.07Å; Y112-L124 HydrophobicContact CE2-CD1 3.82Å; Y112-L124 HydrophobicContact CG-CD1 4.09Å; Y112-I160 HydrophobicContact CE1-CD1 4.22Å
113	T	94.4	Very high	89.6	Confident	44 Å²	44	54.3 Å²	54.3	27%	0.27	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	147.9	178.4	49	0	0	0	0	110.3	K90 V111 V123	K90-T113 HydrophobicContact CB-CG2 4.4Å; K90-T113 HydrophobicContact CD-CG2 4.36Å; K90-T113 HydrophobicContact CG-CG2 3.95Å; V111-T113 HydrophobicContact CG1-CG2 4.11Å; T113-V123 PolarHBondContact N-O 3.32Å; T113-V123 PolarHBondContact O-N 3.04Å
114	P	93.9	Very high	90.5	Very high	38 Å²	38	52 Å²	52	25%	0.247	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	147.5	170.2	-21	28.4	0	0	0	111	W14 K89	W14-P114 HydrophobicContact CB-CG 4Å; W14-P114 HydrophobicContact CG-CG 4.16Å; K89-P114 HydrophobicContact CB-CG 3.73Å; K89-P114 HydrophobicContact CD-CG 4.17Å; K89-P114 WeakPolarHBondContact O-CD 3.37Å
115	H	91.4	Very high	91.3	Very high	47 Å²	47	53.4 Å²	53.4	22%	0.218	29%	0.286	C	S	.	.			trans	-66.8	132.9	175	-170.6	-80.8	0	0	0	109.8	E117 N118 M121 V123	H115-E117 IonicContact CE1-OE2 3.19Å; H115-E117 PolarHBondContact ND1-N 2.8Å; H115-E117 PolarHBondContact O-N 3.24Å; H115-N118 WeakPolarHBondContact CB-O 3.34Å; H115-N118 PolarHBondContact ND1-N 2.77Å; H115-N118 CarbonylContact O-C 3.33Å; H115-N118 PolarHBondContact O-N 2.87Å; H115-M121 HydrophobicContact CB-CB 3.81Å; H115-M121 PolarHBondContact N-O 3.41Å; H115-V123 HydrophobicContact CB-CG2 3.98Å
116	P	88.1	Confident	91.7	Very high	120 Å²	120	52 Å²	52	78%	0.779	28%	0.276	S	S	*	.	S	Bend	trans	-61.8	-31	-173.2	23	-33.9	0	0	0	113.3
117	E	89.4	Confident	92	Very high	171 Å²	171	54 Å²	54	80%	0.799	28%	0.283	S	S	*	.	S	Bend	trans	-96.6	-20.9	-179.7	-56.2	-179.2	165.2	0	0	113.6	H115	H115-E117 IonicContact CE1-OE2 3.19Å; H115-E117 PolarHBondContact ND1-N 2.8Å; H115-E117 PolarHBondContact O-N 3.24Å
118	N	89.3	Confident	92	Very high	56 Å²	56	50.8 Å²	50.8	30%	0.299	27%	0.266	S	S	.	.			trans	-140.2	98	-174.2	-170.5	-0.5	0	0	0	111.3	H115 E120 M121	H115-N118 WeakPolarHBondContact CB-O 3.34Å; H115-N118 PolarHBondContact ND1-N 2.77Å; H115-N118 CarbonylContact O-C 3.33Å; H115-N118 PolarHBondContact O-N 2.87Å; N118-E120 PolarHBondContact O-N 2.97Å; N118-E120 PolarHBondContact OD1-N 3.42Å; N118-M121 HydrophobicContact CB-CG 4.39Å; N118-M121 HydrophobicContact CB-SD 4.26Å; N118-M121 WeakPolarHBondContact ND2-CE 3.17Å; N118-M121 PolarHBondContact ND2-SD 3.03Å; N118-M121 PolarHBondContact O-N 3.05Å
119	P	84.6	Confident	91.8	Very high	95 Å²	95	52 Å²	52	62%	0.617	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.8	-178.5	-24.7	34.8	0	0	0	115	M121	P119-M121 PolarHBondContact O-N 3.4Å
120	E	90.6	Very high	91.4	Very high	120 Å²	120	47.3 Å²	47.3	56%	0.561	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-0.7	176.8	-59.9	-60.7	127.1	0	0	113.1	H12 P13 N118	H12-E120 CarbonylContact C-O 3.57Å; H12-E120 WeakPolarHBondContact CA-O 3.35Å; H12-E120 PolarHBondContact N-O 2.94Å; P13-E120 WeakPolarHBondContact CG-OE2 3.49Å; P13-E120 VanDerWaalsContact N-O 3.12Å; N118-E120 PolarHBondContact O-N 2.97Å; N118-E120 PolarHBondContact OD1-N 3.42Å
121	M	92.8	Very high	90.8	Very high	68 Å²	68	48.8 Å²	48.8	34%	0.335	27%	0.265	S	S	.	.	S	Bend	trans	-120.4	152.5	178.4	-66.4	178.9	175.6	0	0	110.9	V9 F10 H12 H115 N118 P119	V9-M121 HydrophobicContact CG1-CB 4.2Å; V9-M121 HydrophobicContact CG1-SD 4.45Å; F10-M121 WeakPolarHBondContact O-CA 3.35Å; H12-M121 CarbonylContact O-C 3.51Å; H115-M121 HydrophobicContact CB-CB 3.81Å; H115-M121 PolarHBondContact N-O 3.41Å; N118-M121 HydrophobicContact CB-CG 4.39Å; N118-M121 HydrophobicContact CB-SD 4.26Å; N118-M121 WeakPolarHBondContact ND2-CE 3.17Å; N118-M121 PolarHBondContact ND2-SD 3.03Å; N118-M121 PolarHBondContact O-N 3.05Å; P119-M121 PolarHBondContact O-N 3.4Å
122	T	94	Very high	90	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126	179.5	-55.2	0	0	0	0	110.4	V9 F10 H12 W14 V17 Y112	V9-T122 CarbonylContact C-O 3.49Å; V9-T122 WeakPolarHBondContact CA-O 3.27Å; F10-T122 PolarHBondContact N-O 2.95Å; F10-T122 PolarHBondContact O-N 3.33Å; H12-T122 PolarHBondContact O-N 3.01Å; H12-T122 PolarHBondContact O-OG1 3.4Å; W14-T122 WeakPolarHBondContact CA-OG1 3.49Å; W14-T122 PolarHBondContact N-OG1 2.93Å; W14-T122 VanDerWaalsContact N-OG1 3.09Å; V17-T122 HydrophobicContact CB-CG2 4.25Å; V17-T122 HydrophobicContact CG1-CG2 4.11Å; V17-T122 HydrophobicContact CG2-CG2 4.4Å; Y112-T122 HydrophobicContact CD1-CG2 4.46Å
123	V	94.8	Very high	89.1	Confident	13 Å²	13	54 Å²	54	8%	0.079	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.6	172	-176.6	0	0	0	0	108.8	E7 V9 Y112 T113 H115	E7-V123 HydrophobicContact CG-CG1 3.8Å; V9-V123 HydrophobicContact CG2-CG2 4.35Å; Y112-V123 WeakPolarHBondContact CA-O 3.36Å; T113-V123 PolarHBondContact N-O 3.32Å; T113-V123 PolarHBondContact O-N 3.04Å; H115-V123 HydrophobicContact CB-CG2 3.98Å
124	L	94	Very high	87.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	114.7	169.9	167.4	60.1	0	0	0	109.2	E7 H8 F10 L110 V111 Y112 Q126	E7-L124 CarbonylContact C-O 3.51Å; E7-L124 WeakPolarHBondContact CA-O 3.43Å; H8-L124 PolarHBondContact N-O 3.49Å; H8-L124 PolarHBondContact O-N 3.01Å; F10-L124 HydrophobicContact CD2-CB 4.19Å; F10-L124 HydrophobicContact CE2-CB 3.64Å; F10-L124 HydrophobicContact CE2-CD2 3.63Å; F10-L124 HydrophobicContact CE2-CG 4.26Å; F10-L124 HydrophobicContact CZ-CD2 3.92Å; L110-L124 HydrophobicContact CB-CD1 3.95Å; L110-L124 HydrophobicContact CD2-CD1 4.23Å; L110-L124 HydrophobicContact CG-CD1 4.29Å; V111-L124 WeakPolarHBondContact O-CA 3.33Å; Y112-L124 HydrophobicContact CD1-CB 4.11Å; Y112-L124 HydrophobicContact CD1-CD1 3.87Å; Y112-L124 HydrophobicContact CD1-CG 4.4Å; Y112-L124 HydrophobicContact CD2-CD1 4.08Å; Y112-L124 HydrophobicContact CE1-CB 4.16Å; Y112-L124 HydrophobicContact CE1-CD1 3.62Å; Y112-L124 HydrophobicContact CE1-CD2 3.84Å; Y112-L124 HydrophobicContact CE1-CG 4.07Å; Y112-L124 HydrophobicContact CE2-CD1 3.82Å; Y112-L124 HydrophobicContact CG-CD1 4.09Å; L124-Q126 HydrophobicContact CD1-CG 3.8Å; L124-Q126 HydrophobicContact CD2-CG 3.93Å; L124-Q126 HydrophobicContact CG-CG 3.68Å
125	T	93.8	Very high	86.1	Confident	45 Å²	45	56.4 Å²	56.4	28%	0.276	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	124.3	168.5	-47.2	0	0	0	0	108.9	L110 V111	L110-T125 CarbonylContact C-O 3.58Å; L110-T125 WeakPolarHBondContact CA-O 3.47Å; V111-T125 PolarHBondContact N-O 2.85Å; V111-T125 PolarHBondContact O-N 2.89Å
126	Q	92.1	Very high	84.6	Confident	5 Å²	5	60.2 Å²	60.2	2%	0.023	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.2	177.1	-52.7	-167.8	-81.6	0	0	110.6	W4 S5 S6 R109 L110 L124	W4-Q126 HydrophobicContact CZ3-CB 3.94Å; S5-Q126 CarbonylContact C-O 3.56Å; S5-Q126 WeakPolarHBondContact CA-O 3.34Å; S6-Q126 PolarHBondContact N-O 3.23Å; S6-Q126 PolarHBondContact O-N 3.41Å; R109-Q126 CarbonylContact O-C 3.57Å; R109-Q126 WeakPolarHBondContact O-CA 3.31Å; L110-Q126 HydrophobicContact CD2-CG 4.32Å; L110-Q126 HydrophobicContact CG-CB 4.45Å; L110-Q126 HydrophobicContact CG-CG 3.95Å; L124-Q126 HydrophobicContact CD1-CG 3.8Å; L124-Q126 HydrophobicContact CD2-CG 3.93Å; L124-Q126 HydrophobicContact CG-CG 3.68Å
127	E	91.6	Very high	83.4	Confident	67 Å²	67	58.9 Å²	58.9	31%	0.313	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	134.8	176.7	-63.6	175.5	149.2	0	0	108.7	W4 E108 R109	W4-E127 CarbonylContact O-C 3.5Å; W4-E127 WeakPolarHBondContact O-CA 3.19Å; E108-E127 CarbonylContact C-O 3.58Å; E108-E127 VanDerWaalsContact CA-O 3.31Å; E108-E127 WeakPolarHBondContact CA-O 3.42Å; R109-E127 IonicContact CZ-OE2 2.91Å; R109-E127 PolarHBondContact N-O 2.91Å; R109-E127 IonicContact NE-OE2 2.67Å; R109-E127 PolarHBondContact NE-OE2 2.67Å; R109-E127 IonicContact NH2-OE1 3.78Å; R109-E127 IonicContact NH2-OE2 3.7Å; R109-E127 PolarHBondContact NH2-OE2 3.1Å; R109-E127 PolarHBondContact O-N 2.86Å
128	A	88.2	Confident	82.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.5	176.3	0	0	0	0	0	110	I3 W4 N107 E108 I149	I3-A128 WeakPolarHBondContact CA-O 3.2Å; W4-A128 HydrophobicContact CB-CB 4.43Å; W4-A128 HydrophobicContact CE3-CB 4.17Å; W4-A128 PolarHBondContact N-O 2.74Å; W4-A128 PolarHBondContact O-N 2.88Å; N107-A128 CarbonylContact O-C 3.51Å; N107-A128 WeakPolarHBondContact O-CA 3.44Å; E108-A128 HydrophobicContact CG-CB 4.2Å; A128-I149 HydrophobicContact CB-CD1 4.19Å; A128-I149 HydrophobicContact CB-CG2 3.86Å
129	I	87.6	Confident	81.3	Confident	70 Å²	70	52.9 Å²	52.9	36%	0.359	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	116.1	176.5	-55.7	175.7	0	0	0	107.8	M1 V106 N107	M1-I129 HydrophobicContact CE-CG2 4.46Å; M1-I129 HydrophobicContact CG-CG2 4.2Å; M1-I129 HydrophobicContact SD-CG2 4.49Å; V106-I129 WeakPolarHBondContact CA-O 3.4Å; N107-I129 PolarHBondContact N-O 2.81Å; N107-I129 PolarHBondContact O-N 2.9Å
130	I	84.3	Confident	80.7	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124.1	178.8	-48.9	171.4	0	0	0	108.6	M1 K2 V104 V106 M145 A146 I149	M1-I130 VanDerWaalsContact CA-O 3.3Å; M1-I130 WeakPolarHBondContact CA-O 3.45Å; K2-I130 PolarHBondContact N-O 2.65Å; K2-I130 PolarHBondContact O-N 2.89Å; V104-I130 HydrophobicContact CG1-CG2 4.24Å; V106-I130 HydrophobicContact CG2-CG2 4.48Å; I130-M145 HydrophobicContact CD1-CB 4.17Å; I130-M145 HydrophobicContact CG2-CB 4.22Å; I130-A146 HydrophobicContact CD1-CB 3.91Å; I130-I149 HydrophobicContact CD1-CD1 3.6Å; I130-I149 HydrophobicContact CG1-CD1 3.69Å
131	T	82.3	Confident	79.8	Confident	38 Å²	38	49.9 Å²	49.9	23%	0.233	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	113.2	176.4	-57	0	0	0	0	109.7	V104 S105 K133	V104-T131 WeakPolarHBondContact CA-O 3.38Å; S105-T131 PolarHBondContact N-O 2.84Å; S105-T131 PolarHBondContact O-N 3.19Å; T131-K133 HydrophobicContact CG2-CG 4.32Å
132	V	77.8	Confident	78.8	Confident	23 Å²	23	48.3 Å²	48.3	14%	0.139	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.2	172.1	-179.8	0	0	0	0	109	L103 V104 E142	L103-V132 WeakPolarHBondContact O-CA 3.37Å; V104-V132 HydrophobicContact CG1-CG2 4.17Å; V104-V132 HydrophobicContact CG2-CG1 4.48Å; V104-V132 HydrophobicContact CG2-CG2 4.1Å; V132-E142 HydrophobicContact CB-CG 4.01Å; V132-E142 HydrophobicContact CG2-CB 4.48Å; V132-E142 HydrophobicContact CG2-CG 3.44Å; V132-E142 VanDerWaalsContact CG2-CG 3.44Å
133	K	75.6	Confident	77.9	Confident	112 Å²	112	50.6 Å²	50.6	49%	0.487	30%	0.301	S	S	.	.			trans	-115.8	133.9	-177.8	-62.9	179.7	-176.8	172.7	0	110.3	L103 T131 I135	L103-K133 PolarHBondContact O-N 2.79Å; T131-K133 HydrophobicContact CG2-CG 4.32Å; K133-I135 PolarHBondContact O-N 3.35Å
134	G	63.7	Low	77	Confident	93 Å²	93	52.6 Å²	52.6	96%	0.959	31%	0.311	S	S	*	.	S	Bend	trans	75.3	10	160.8	0	0	0	0	0	118.2
135	I	63.4	Low	76	Confident	40 Å²	40	55.1 Å²	55.1	21%	0.205	32%	0.324	C	S	.	.			trans	-117.5	128.2	-179.7	-54.8	169.2	0	0	0	110	I68 L103 K133 L137 G138 L141	I68-I135 HydrophobicContact CG2-CD1 4.43Å; L103-I135 HydrophobicContact CD2-CD1 4.33Å; K133-I135 PolarHBondContact O-N 3.35Å; I135-L137 HydrophobicContact CG2-CB 4.05Å; I135-L137 PolarHBondContact O-N 2.79Å; I135-G138 PolarHBondContact O-N 3.1Å; I135-L141 HydrophobicContact CD1-CD1 3.72Å; I135-L141 HydrophobicContact CG2-CD1 4.17Å
136	S	58.3	Low	75.1	Confident	128 Å²	128	53.3 Å²	53.3	90%	0.895	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17	178.6	68.6	0	0	0	0	113.9	G138	S136-G138 VanDerWaalsContact C-N 3.34Å
137	L	62.8	Low	74.5	Confident	92 Å²	92	58.3 Å²	58.3	48%	0.482	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	23	172.3	-63.6	169.1	0	0	0	113.3	I68 I135 S139 Y140 L141	I68-L137 HydrophobicContact CD1-CD1 4.5Å; I135-L137 HydrophobicContact CG2-CB 4.05Å; I135-L137 PolarHBondContact O-N 2.79Å; L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 2.8Å; L137-Y140 PolarHBondContact O-N 2.89Å; L137-L141 PolarHBondContact O-N 3.42Å
138	G	65	Low	73.7	Confident	15 Å²	15	57.4 Å²	57.4	16%	0.155	34%	0.339	C	S	.	.	H	α-helix	trans	-51.2	-41.9	-174.9	0	0	0	0	0	114	I135 S136 Y140 L141 E142	I135-G138 PolarHBondContact O-N 3.1Å; S136-G138 VanDerWaalsContact C-N 3.34Å; G138-Y140 PolarHBondContact O-N 3.33Å; G138-L141 PolarHBondContact O-N 3.1Å; G138-E142 VanDerWaalsContact O-CB 3.27Å; G138-E142 WeakPolarHBondContact O-CB 2.97Å; G138-E142 WeakPolarHBondContact O-CG 3.42Å; G138-E142 PolarHBondContact O-N 2.86Å
139	S	70.4	Confident	73.2	Confident	86 Å²	86	58.2 Å²	58.2	60%	0.601	34%	0.343	S	S	*	.	H	α-helix	trans	-67.3	-35.1	-177.5	58.1	0	0	0	0	114.2	L137 S143	L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 2.8Å; S139-S143 WeakPolarHBondContact O-CB 3.48Å; S139-S143 PolarHBondContact O-N 2.84Å; S139-S143 PolarHBondContact O-OG 2.75Å
140	Y	72.4	Confident	72.8	Confident	135 Å²	135	56.5 Å²	56.5	53%	0.529	34%	0.338	S	S	.	.	H	α-helix	trans	-71.2	-46.1	177.1	-179.3	-108.1	0	0	0	110.8	L137 G138 S143 L144	L137-Y140 PolarHBondContact O-N 2.89Å; G138-Y140 PolarHBondContact O-N 3.33Å; Y140-S143 PolarHBondContact O-N 3.22Å; Y140-L144 HydrophobicContact CD1-CD1 3.9Å; Y140-L144 HydrophobicContact CD1-CG 4.44Å; Y140-L144 HydrophobicContact CE1-CD1 3.36Å; Y140-L144 HydrophobicContact CE1-CG 4.08Å; Y140-L144 HydrophobicContact CE2-CG 4.42Å; Y140-L144 WeakPolarHBondContact O-CG 3.46Å; Y140-L144 PolarHBondContact O-N 2.97Å
141	L	70.1	Confident	72.6	Confident	16 Å²	16	59 Å²	59	8%	0.084	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-42.6	175.3	-72.1	173	0	0	0	111.8	V65 I135 L137 G138 S143 L144 M145	V65-L141 HydrophobicContact CG2-CD2 4.36Å; I135-L141 HydrophobicContact CD1-CD1 3.72Å; I135-L141 HydrophobicContact CG2-CD1 4.17Å; L137-L141 PolarHBondContact O-N 3.42Å; G138-L141 PolarHBondContact O-N 3.1Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 2.88Å; L141-L144 PolarHBondContact O-N 2.83Å; L141-M145 WeakPolarHBondContact O-CB 3.48Å; L141-M145 WeakPolarHBondContact O-CG 3.38Å; L141-M145 PolarHBondContact O-N 2.77Å
142	E	72.4	Confident	72.5	Confident	36 Å²	36	59.5 Å²	59.5	17%	0.168	36%	0.356	C	S	.	.	H	α-helix	trans	-58	-40.8	174	-79.2	-179.8	155	0	0	111.4	M1 V132 G138 A146	M1-E142 PolarHBondContact N-OE1 3.46Å; V132-E142 HydrophobicContact CB-CG 4.01Å; V132-E142 HydrophobicContact CG2-CB 4.48Å; V132-E142 HydrophobicContact CG2-CG 3.44Å; V132-E142 VanDerWaalsContact CG2-CG 3.44Å; G138-E142 VanDerWaalsContact O-CB 3.27Å; G138-E142 WeakPolarHBondContact O-CB 2.97Å; G138-E142 WeakPolarHBondContact O-CG 3.42Å; G138-E142 PolarHBondContact O-N 2.86Å; E142-A146 VanDerWaalsContact O-CB 3.26Å; E142-A146 WeakPolarHBondContact O-CB 3.44Å; E142-A146 PolarHBondContact O-N 2.97Å
143	S	75.2	Confident	72.7	Confident	47 Å²	47	58.5 Å²	58.5	33%	0.329	35%	0.35	S	S	.	.	H	α-helix	trans	-70.9	-42.3	179.1	-61.8	0	0	0	0	112.6	S139 Y140 L141 A146 N147	S139-S143 WeakPolarHBondContact O-CB 3.48Å; S139-S143 PolarHBondContact O-N 2.84Å; S139-S143 PolarHBondContact O-OG 2.75Å; Y140-S143 PolarHBondContact O-N 3.22Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 2.88Å; S143-A146 PolarHBondContact O-N 3.49Å; S143-N147 VanDerWaalsContact O-CG 3.27Å; S143-N147 PolarHBondContact O-N 2.89Å; S143-N147 PolarHBondContact O-ND2 2.82Å
144	L	75.3	Confident	73.1	Confident	55 Å²	55	59.3 Å²	59.3	29%	0.288	35%	0.354	S	S	.	.	H	α-helix	trans	-59.9	-48.8	173.2	-73.5	-179.7	0	0	0	111.2	Y140 L141 A146 N147 T148	Y140-L144 HydrophobicContact CD1-CD1 3.9Å; Y140-L144 HydrophobicContact CD1-CG 4.44Å; Y140-L144 HydrophobicContact CE1-CD1 3.36Å; Y140-L144 HydrophobicContact CE1-CG 4.08Å; Y140-L144 HydrophobicContact CE2-CG 4.42Å; Y140-L144 WeakPolarHBondContact O-CG 3.46Å; Y140-L144 PolarHBondContact O-N 2.97Å; L141-L144 PolarHBondContact O-N 2.83Å; L144-A146 PolarHBondContact O-N 2.78Å; L144-N147 PolarHBondContact O-N 3.5Å; L144-T148 PolarHBondContact O-N 2.87Å; L144-T148 PolarHBondContact O-OG1 3.49Å
145	M	73.9	Confident	74.2	Confident	54 Å²	54	58.7 Å²	58.7	27%	0.266	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-40.7	179.7	-68.1	-66.2	-80.1	0	0	111.8	V104 V106 I130 L141 N147 T148 I149	V104-M145 HydrophobicContact CG1-CE 3.98Å; V106-M145 HydrophobicContact CG2-CE 3.87Å; I130-M145 HydrophobicContact CD1-CB 4.17Å; I130-M145 HydrophobicContact CG2-CB 4.22Å; L141-M145 WeakPolarHBondContact O-CB 3.48Å; L141-M145 WeakPolarHBondContact O-CG 3.38Å; L141-M145 PolarHBondContact O-N 2.77Å; M145-N147 PolarHBondContact O-N 2.9Å; M145-T148 WeakPolarHBondContact O-CB 3.37Å; M145-T148 PolarHBondContact O-N 3.04Å; M145-I149 WeakPolarHBondContact O-CG1 3.48Å; M145-I149 PolarHBondContact O-N 3.47Å
146	A	75.4	Confident	75.2	Confident	7 Å²	7	56.9 Å²	56.9	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-61.9	-42.3	175.7	0	0	0	0	0	112.3	K2 I130 E142 S143 L144 T148 I149 S150	K2-A146 HydrophobicContact CD-CB 4.07Å; I130-A146 HydrophobicContact CD1-CB 3.91Å; E142-A146 VanDerWaalsContact O-CB 3.26Å; E142-A146 WeakPolarHBondContact O-CB 3.44Å; E142-A146 PolarHBondContact O-N 2.97Å; S143-A146 PolarHBondContact O-N 3.49Å; L144-A146 PolarHBondContact O-N 2.78Å; A146-T148 VanDerWaalsContact C-N 3.32Å; A146-T148 PolarHBondContact O-N 3.4Å; A146-I149 PolarHBondContact O-N 3.25Å; A146-S150 WeakPolarHBondContact O-CB 3.49Å; A146-S150 PolarHBondContact O-N 3.13Å
147	N	78.3	Confident	76.6	Confident	110 Å²	110	52.5 Å²	52.5	59%	0.588	28%	0.28	S	S	*	.	H	α-helix	trans	-64.3	-39.9	175.9	-71	-18.2	0	0	0	111.6	S143 L144 M145 S150 S151	S143-N147 VanDerWaalsContact O-CG 3.27Å; S143-N147 PolarHBondContact O-N 2.89Å; S143-N147 PolarHBondContact O-ND2 2.82Å; L144-N147 PolarHBondContact O-N 3.5Å; M145-N147 PolarHBondContact O-N 2.9Å; N147-S150 PolarHBondContact O-N 2.83Å; N147-S151 WeakPolarHBondContact O-CB 3.45Å; N147-S151 PolarHBondContact O-N 2.85Å
148	T	75.9	Confident	77.8	Confident	48 Å²	48	50 Å²	50	29%	0.294	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-44.9	176	-61.5	0	0	0	0	112.1	W59 L144 M145 A146 S151 N152	W59-T148 HydrophobicContact CE3-CG2 4.24Å; W59-T148 HydrophobicContact CH2-CG2 3.72Å; W59-T148 HydrophobicContact CZ3-CG2 3.24Å; L144-T148 PolarHBondContact O-N 2.87Å; L144-T148 PolarHBondContact O-OG1 3.49Å; M145-T148 WeakPolarHBondContact O-CB 3.37Å; M145-T148 PolarHBondContact O-N 3.04Å; A146-T148 VanDerWaalsContact C-N 3.32Å; A146-T148 PolarHBondContact O-N 3.4Å; T148-S151 PolarHBondContact O-N 2.99Å; T148-N152 WeakPolarHBondContact O-CB 3.49Å; T148-N152 VanDerWaalsContact O-CG 3.26Å; T148-N152 PolarHBondContact O-N 3.37Å
149	I	77	Confident	78.8	Confident	17 Å²	17	49.3 Å²	49.3	9%	0.087	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-45.6	177	-69	176.7	0	0	0	110.7	W4 V106 A128 I130 M145 A146 S151 N152 A153	W4-I149 HydrophobicContact CE3-CG2 4.21Å; V106-I149 HydrophobicContact CG1-CD1 3.54Å; V106-I149 HydrophobicContact CG2-CD1 4.5Å; A128-I149 HydrophobicContact CB-CD1 4.19Å; A128-I149 HydrophobicContact CB-CG2 3.86Å; I130-I149 HydrophobicContact CD1-CD1 3.6Å; I130-I149 HydrophobicContact CG1-CD1 3.69Å; M145-I149 WeakPolarHBondContact O-CG1 3.48Å; M145-I149 PolarHBondContact O-N 3.47Å; A146-I149 PolarHBondContact O-N 3.25Å; I149-S151 VanDerWaalsContact C-N 3.3Å; I149-S151 PolarHBondContact O-N 3.31Å; I149-N152 CarbonylContact O-C 3.59Å; I149-N152 PolarHBondContact O-N 2.97Å; I149-N152 VanDerWaalsContact O-N 3.1Å; I149-A153 WeakPolarHBondContact O-CB 3.42Å; I149-A153 PolarHBondContact O-N 3.42Å
150	S	79.9	Confident	79.5	Confident	34 Å²	34	45.2 Å²	45.2	24%	0.238	24%	0.237	C	C	.	.	H	α-helix	trans	-58.6	-41	175.9	177.3	0	0	0	0	112.4	A146 N147 K154	A146-S150 WeakPolarHBondContact O-CB 3.49Å; A146-S150 PolarHBondContact O-N 3.13Å; N147-S150 PolarHBondContact O-N 2.83Å; S150-K154 PolarHBondContact O-N 3.45Å
151	S	80.5	Confident	80.3	Confident	54 Å²	54	41.1 Å²	41.1	38%	0.378	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-42.4	173.9	-175	0	0	0	0	112.2	N147 T148 I149 K154 K155	N147-S151 WeakPolarHBondContact O-CB 3.45Å; N147-S151 PolarHBondContact O-N 2.85Å; T148-S151 PolarHBondContact O-N 2.99Å; I149-S151 VanDerWaalsContact C-N 3.3Å; I149-S151 PolarHBondContact O-N 3.31Å; S151-K154 PolarHBondContact O-N 2.94Å; S151-K155 WeakPolarHBondContact O-CG 3.17Å; S151-K155 PolarHBondContact O-N 3.03Å
152	N	79	Confident	81.1	Confident	47 Å²	47	44.4 Å²	44.4	25%	0.251	23%	0.234	S	C	.	.	H	α-helix	trans	-69.8	-32.9	179.7	-73.9	-8.2	0	0	0	113.1	W59 T148 I149 K155 G156	W59-N152 WeakPolarHBondContact CH2-ND2 3.3Å; T148-N152 WeakPolarHBondContact O-CB 3.49Å; T148-N152 VanDerWaalsContact O-CG 3.26Å; T148-N152 PolarHBondContact O-N 3.37Å; I149-N152 CarbonylContact O-C 3.59Å; I149-N152 PolarHBondContact O-N 2.97Å; I149-N152 VanDerWaalsContact O-N 3.1Å; N152-K155 PolarHBondContact O-N 3.49Å; N152-G156 PolarHBondContact O-N 3.47Å
153	A	82.3	Confident	81.7	Confident	2 Å²	2	43.4 Å²	43.4	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-50.9	172.6	0	0	0	0	0	110.6	W4 I149 K155 G156 W157	W4-A153 HydrophobicContact CH2-CB 3.42Å; W4-A153 VanDerWaalsContact CH2-CB 3.42Å; W4-A153 HydrophobicContact CZ2-CB 4.22Å; W4-A153 HydrophobicContact CZ3-CB 4.03Å; I149-A153 WeakPolarHBondContact O-CB 3.42Å; I149-A153 PolarHBondContact O-N 3.42Å; A153-K155 PolarHBondContact O-N 3.44Å; A153-G156 CarbonylContact O-C 3.57Å; A153-G156 WeakPolarHBondContact O-CA 3.33Å; A153-G156 PolarHBondContact O-N 2.88Å; A153-W157 HydrophobicContact CB-CZ2 4.23Å; A153-W157 PolarHBondContact O-N 2.94Å
154	K	84.8	Confident	82.3	Confident	129 Å²	129	41.5 Å²	41.5	56%	0.561	22%	0.216	S	C	*	.	H	α-helix	trans	-59.8	-43.8	176.5	-67.8	179.7	-178.1	-175.5	0	112.8	S150 S151 G156 W157 A158	S150-K154 PolarHBondContact O-N 3.45Å; S151-K154 PolarHBondContact O-N 2.94Å; K154-G156 PolarHBondContact O-N 3.33Å; K154-W157 HydrophobicContact CB-CE3 4.47Å; K154-W157 HydrophobicContact CG-CE3 4.14Å; K154-W157 HydrophobicContact CG-CZ3 3.87Å; K154-W157 PolarHBondContact O-N 3.33Å; K154-A158 PolarHBondContact O-N 3.48Å
155	K	85.6	Confident	82.7	Confident	80 Å²	80	44.7 Å²	44.7	35%	0.348	23%	0.229	S	C	.	.	H	α-helix	trans	-62	-35.1	173.2	-69.8	171.2	179.7	-179	0	111.8	M29 N30 S151 N152 A153 A159	M29-K155 HydrophobicContact CB-CB 4.43Å; N30-K155 WeakPolarHBondContact OD1-CB 3.44Å; S151-K155 WeakPolarHBondContact O-CG 3.17Å; S151-K155 PolarHBondContact O-N 3.03Å; N152-K155 PolarHBondContact O-N 3.49Å; A153-K155 PolarHBondContact O-N 3.44Å; K155-A159 VanDerWaalsContact O-CB 3.27Å; K155-A159 WeakPolarHBondContact O-CB 3.46Å; K155-A159 PolarHBondContact O-N 3.11Å
156	G	84.4	Confident	83	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-64.3	-44	176.4	0	0	0	0	0	112.6	N152 A153 K154 A159 I160	N152-G156 PolarHBondContact O-N 3.47Å; A153-G156 CarbonylContact O-C 3.57Å; A153-G156 WeakPolarHBondContact O-CA 3.33Å; A153-G156 PolarHBondContact O-N 2.88Å; K154-G156 PolarHBondContact O-N 3.33Å; G156-A159 PolarHBondContact O-N 2.88Å; G156-I160 WeakPolarHBondContact O-CG1 3.5Å; G156-I160 PolarHBondContact O-N 2.89Å
157	W	88.3	Confident	82.5	Confident	35 Å²	35	47.8 Å²	47.8	13%	0.133	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-49.7	175	-52	-26.4	0	0	0	111.2	S6 H8 F10 A153 K154 A159 I160 E161	S6-W157 WeakPolarHBondContact OG-CH2 3.2Å; H8-W157 HydrophobicContact CB-CD2 3.99Å; H8-W157 HydrophobicContact CB-CE3 4.36Å; H8-W157 HydrophobicContact CB-CG 4.48Å; H8-W157 HydrophobicContact CB-CH2 4.28Å; H8-W157 HydrophobicContact CB-CZ2 3.88Å; H8-W157 HydrophobicContact CB-CZ3 4.5Å; H8-W157 AromaticContact CD2-CG 3.83Å; H8-W157 AromaticContact CG-CD2 3.74Å; H8-W157 AromaticContact CG-CE3 3.95Å; H8-W157 AromaticContact ND1-CE3 3.78Å; F10-W157 HydrophobicContact CE1-CB 4.18Å; F10-W157 HydrophobicContact CZ-CB 4.25Å; F10-W157 HydrophobicContact CZ-CG 4.37Å; A153-W157 HydrophobicContact CB-CZ2 4.23Å; A153-W157 PolarHBondContact O-N 2.94Å; K154-W157 HydrophobicContact CB-CE3 4.47Å; K154-W157 HydrophobicContact CG-CE3 4.14Å; K154-W157 HydrophobicContact CG-CZ3 3.87Å; K154-W157 PolarHBondContact O-N 3.33Å; W157-A159 VanDerWaalsContact C-N 3.26Å; W157-A159 PolarHBondContact O-N 3.08Å; W157-I160 PolarHBondContact O-N 2.96Å; W157-E161 PolarHBondContact O-N 3.45Å
158	A	87	Confident	81.5	Confident	40 Å²	40	49.8 Å²	49.8	33%	0.331	25%	0.252	S	S	.	.	H	α-helix	trans	-60.2	-34.7	178.1	0	0	0	0	0	112.8	M29 K154 W162	M29-A158 HydrophobicContact CG-CB 4.43Å; K154-A158 PolarHBondContact O-N 3.48Å; A158-W162 VanDerWaalsContact O-CB 3.28Å; A158-W162 WeakPolarHBondContact O-CB 3.37Å; A158-W162 PolarHBondContact O-N 3.34Å
159	A	86.4	Confident	80.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.8	-38.5	175.1	0	0	0	0	0	112.4	K24 N27 M29 K155 G156 W157 I163	K24-A159 HydrophobicContact CG-CB 4.47Å; N27-A159 HydrophobicContact CB-CB 4.13Å; M29-A159 HydrophobicContact CB-CB 4.26Å; M29-A159 HydrophobicContact CG-CB 4.39Å; K155-A159 VanDerWaalsContact O-CB 3.27Å; K155-A159 WeakPolarHBondContact O-CB 3.46Å; K155-A159 PolarHBondContact O-N 3.11Å; G156-A159 PolarHBondContact O-N 2.88Å; W157-A159 VanDerWaalsContact C-N 3.26Å; W157-A159 PolarHBondContact O-N 3.08Å; A159-I163 WeakPolarHBondContact O-CD1 3.26Å; A159-I163 WeakPolarHBondContact O-CG1 3.46Å; A159-I163 PolarHBondContact O-N 3.04Å
160	I	86.4	Confident	78.5	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-49.2	176.9	-70.8	170.2	0	0	0	109.6	F10 V17 A20 A21 Y112 G156 W157 W162 I163 I164	F10-I160 HydrophobicContact CD1-CG2 4.36Å; F10-I160 HydrophobicContact CE1-CB 4.12Å; F10-I160 HydrophobicContact CE1-CG2 3.94Å; F10-I160 HydrophobicContact CZ-CB 4.36Å; F10-I160 HydrophobicContact CZ-CD1 3.99Å; F10-I160 HydrophobicContact CZ-CG2 4.26Å; V17-I160 HydrophobicContact CG1-CG2 4.29Å; A20-I160 HydrophobicContact CB-CG2 4.04Å; A21-I160 HydrophobicContact CB-CD1 4.25Å; Y112-I160 HydrophobicContact CE1-CD1 4.22Å; G156-I160 WeakPolarHBondContact O-CG1 3.5Å; G156-I160 PolarHBondContact O-N 2.89Å; W157-I160 PolarHBondContact O-N 2.96Å; I160-W162 VanDerWaalsContact C-N 3.34Å; I160-W162 PolarHBondContact O-N 3.24Å; I160-I163 PolarHBondContact O-N 3.44Å; I160-I163 VanDerWaalsContact O-N 3.14Å; I160-I164 HydrophobicContact CG2-CD1 3.85Å; I160-I164 HydrophobicContact CG2-CG1 4.45Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.48Å; I160-I164 PolarHBondContact O-N 2.82Å
161	E	87.7	Confident	76.7	Confident	48 Å²	48	59.1 Å²	59.1	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-55.8	-48.7	176.1	-72.7	-68.9	174.1	0	0	111.6	F10 H12 W157 I163 I164 E165	F10-E161 HydrophobicContact CD1-CG 4.34Å; F10-E161 WeakPolarHBondContact CD1-OE1 3.35Å; F10-E161 HydrophobicContact CE1-CG 4.44Å; H12-E161 IonicContact CD2-OE1 2.75Å; H12-E161 IonicContact CD2-OE2 3.2Å; H12-E161 PolarHBondContact CD2-OE2 2.92Å; H12-E161 IonicContact CE1-OE2 3.77Å; H12-E161 IonicContact NE2-OE1 2.89Å; H12-E161 IonicContact NE2-OE2 3.9Å; H12-E161 PolarHBondContact NE2-OE2 3.13Å; W157-E161 PolarHBondContact O-N 3.45Å; E161-I163 VanDerWaalsContact C-N 3.3Å; E161-I163 PolarHBondContact O-N 2.92Å; E161-I164 PolarHBondContact O-N 2.99Å; E161-I164 VanDerWaalsContact O-N 3.09Å; E161-E165 WeakPolarHBondContact O-CG 3.26Å; E161-E165 PolarHBondContact O-N 2.82Å
162	W	87.3	Confident	74.4	Confident	85 Å²	85	64.8 Å²	64.8	32%	0.322	36%	0.36	S	S	.	.	H	α-helix	trans	-58.2	-41.4	177.5	-177.3	83.2	0	0	0	112.3	P28 A158 I160 H166	P28-W162 HydrophobicContact CG-CD2 4.26Å; P28-W162 HydrophobicContact CG-CZ2 4.26Å; A158-W162 VanDerWaalsContact O-CB 3.28Å; A158-W162 WeakPolarHBondContact O-CB 3.37Å; A158-W162 PolarHBondContact O-N 3.34Å; I160-W162 VanDerWaalsContact C-N 3.34Å; I160-W162 PolarHBondContact O-N 3.24Å; W162-H166 AromaticContact CD1-CE1 3.35Å; W162-H166 AromaticContact CD1-ND1 3.59Å; W162-H166 AromaticContact CD2-ND1 3.82Å; W162-H166 AromaticContact CE2-CD2 3.9Å; W162-H166 AromaticContact CE2-CE1 3.54Å; W162-H166 AromaticContact CE2-CG 3.8Å; W162-H166 AromaticContact CE2-ND1 3.54Å; W162-H166 AromaticContact CE2-NE2 3.71Å; W162-H166 AromaticContact CG-ND1 3.86Å; W162-H166 AromaticContact CZ2-CD2 3.71Å; W162-H166 AromaticContact CZ2-CG 3.86Å; W162-H166 AromaticContact CZ2-NE2 3.86Å; W162-H166 AromaticContact NE1-CE1 2.99Å; W162-H166 PolarHBondContact NE1-CE1 2.91Å; W162-H166 AromaticContact NE1-ND1 3.41Å; W162-H166 PolarHBondContact NE1-ND1 3.27Å; W162-H166 AromaticContact NE1-NE2 3.36Å; W162-H166 PolarHBondContact NE1-NE2 3.36Å; W162-H166 WeakPolarHBondContact O-CB 3.18Å; W162-H166 PolarHBondContact O-N 3.44Å; W162-H166 PolarHBondContact O-ND1 3.19Å
163	I	86.4	Confident	74.2	Confident	16 Å²	16	65.7 Å²	65.7	8%	0.082	37%	0.366	C	S	.	.	H	α-helix	trans	-66.6	-39.9	177.3	-70.6	165	0	0	0	111.2	A20 R23 K24 A159 I160 E161 H166 S167	A20-I163 HydrophobicContact CB-CB 4.2Å; A20-I163 HydrophobicContact CB-CG2 3.78Å; R23-I163 WeakPolarHBondContact O-CD1 3.4Å; K24-I163 HydrophobicContact CB-CD1 4.47Å; A159-I163 WeakPolarHBondContact O-CD1 3.26Å; A159-I163 WeakPolarHBondContact O-CG1 3.46Å; A159-I163 PolarHBondContact O-N 3.04Å; I160-I163 PolarHBondContact O-N 3.44Å; I160-I163 VanDerWaalsContact O-N 3.14Å; E161-I163 VanDerWaalsContact C-N 3.3Å; E161-I163 PolarHBondContact O-N 2.92Å; I163-H166 PolarHBondContact O-N 3.4Å; I163-S167 WeakPolarHBondContact O-CA 3.27Å; I163-S167 WeakPolarHBondContact O-CB 3.36Å; I163-S167 PolarHBondContact O-N 3.31Å; I163-S167 PolarHBondContact O-OG 2.81Å
164	I	85.8	Confident	73.7	Confident	6 Å²	6	69.1 Å²	69.1	3%	0.031	38%	0.384	C	S	.	.	H	α-helix	trans	-60.7	-52.2	178	-65.9	170.2	0	0	0	109.3	H12 T16 V17 A20 I160 E161 H166 S167	H12-I164 HydrophobicContact CB-CD1 4.18Å; T16-I164 HydrophobicContact CG2-CD1 4.28Å; T16-I164 HydrophobicContact CG2-CG1 4.05Å; T16-I164 HydrophobicContact CG2-CG2 3.82Å; V17-I164 HydrophobicContact CG2-CD1 4.19Å; A20-I164 HydrophobicContact CB-CD1 4.2Å; A20-I164 HydrophobicContact CB-CG1 3.54Å; I160-I164 HydrophobicContact CG2-CD1 3.85Å; I160-I164 HydrophobicContact CG2-CG1 4.45Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.48Å; I160-I164 PolarHBondContact O-N 2.82Å; E161-I164 PolarHBondContact O-N 2.99Å; E161-I164 VanDerWaalsContact O-N 3.09Å; I164-H166 VanDerWaalsContact C-N 3.3Å; I164-H166 PolarHBondContact O-N 3.46Å; I164-S167 PolarHBondContact O-N 3.19Å; I164-S167 PolarHBondContact O-OG 3.04Å
165	E	84.4	Confident	73.1	Confident	123 Å²	123	65.7 Å²	65.7	58%	0.575	37%	0.374	S	S	*	.	H	α-helix	trans	-57	-38.7	176.8	-67.8	176.2	167.3	0	0	113.2	E161	E161-E165 WeakPolarHBondContact O-CG 3.26Å; E161-E165 PolarHBondContact O-N 2.82Å
166	H	79.9	Confident	72.4	Confident	84 Å²	84	64.9 Å²	64.9	39%	0.389	38%	0.376	S	S	.	.	H	α-helix	trans	-89	-12.1	-178.1	-68.5	68.2	0	0	0	113.5	W162 I163 I164 S169	W162-H166 AromaticContact CD1-CE1 3.35Å; W162-H166 AromaticContact CD1-ND1 3.59Å; W162-H166 AromaticContact CD2-ND1 3.82Å; W162-H166 AromaticContact CE2-CD2 3.9Å; W162-H166 AromaticContact CE2-CE1 3.54Å; W162-H166 AromaticContact CE2-CG 3.8Å; W162-H166 AromaticContact CE2-ND1 3.54Å; W162-H166 AromaticContact CE2-NE2 3.71Å; W162-H166 AromaticContact CG-ND1 3.86Å; W162-H166 AromaticContact CZ2-CD2 3.71Å; W162-H166 AromaticContact CZ2-CG 3.86Å; W162-H166 AromaticContact CZ2-NE2 3.86Å; W162-H166 AromaticContact NE1-CE1 2.99Å; W162-H166 PolarHBondContact NE1-CE1 2.91Å; W162-H166 AromaticContact NE1-ND1 3.41Å; W162-H166 PolarHBondContact NE1-ND1 3.27Å; W162-H166 AromaticContact NE1-NE2 3.36Å; W162-H166 PolarHBondContact NE1-NE2 3.36Å; W162-H166 WeakPolarHBondContact O-CB 3.18Å; W162-H166 PolarHBondContact O-N 3.44Å; W162-H166 PolarHBondContact O-ND1 3.19Å; I163-H166 PolarHBondContact O-N 3.4Å; I164-H166 VanDerWaalsContact C-N 3.3Å; I164-H166 PolarHBondContact O-N 3.46Å; H166-S169 PolarHBondContact O-OG 3.02Å
167	S	66.5	Low	71.6	Confident	42 Å²	42	68.8 Å²	68.8	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-76.2	-28.8	176.8	68.3	0	0	0	0	112.6	I163 I164 S169 A170	I163-S167 WeakPolarHBondContact O-CA 3.27Å; I163-S167 WeakPolarHBondContact O-CB 3.36Å; I163-S167 PolarHBondContact O-N 3.31Å; I163-S167 PolarHBondContact O-OG 2.81Å; I164-S167 PolarHBondContact O-N 3.19Å; I164-S167 PolarHBondContact O-OG 3.04Å; S167-S169 VanDerWaalsContact C-N 3.31Å; S167-A170 PolarHBondContact O-N 3.23Å
168	E	55.3	Low	70.5	Confident	152 Å²	152	71 Å²	71	71%	0.71	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-70	-30	175.7	-67.1	-170.6	155	0	0	112	A170	E168-A170 VanDerWaalsContact C-N 3.32Å; E168-A170 PolarHBondContact O-N 3.17Å
169	S	48.6	Very low	69.4	Low	79 Å²	79	73.2 Å²	73.2	55%	0.552	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-78.6	-11.5	179.5	46.6	0	0	0	0	114.4	H166 S167	H166-S169 PolarHBondContact O-OG 3.02Å; S167-S169 VanDerWaalsContact C-N 3.31Å
170	A	42.5	Very low	68	Low	86 Å²	86	78.8 Å²	78.8	71%	0.711	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-90	-0.2	178.9	0	0	0	0	0	114.2	S167 E168	S167-A170 PolarHBondContact O-N 3.23Å; E168-A170 VanDerWaalsContact C-N 3.32Å; E168-A170 PolarHBondContact O-N 3.17Å
171	V	42.8	Very low	66.5	Low	129 Å²	129	85.3 Å²	85.3	78%	0.782	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-111.3	9.2	-179.2	-166.4	0	0	0	0	112.2
172	S	30.9	Very low	64.6	Low	174 Å²	174	88.7 Å²	88.7	100%	1.217	52%	0.515	S	S	*	.			trans	-101.1	0	174.5	-61.6	0	0	0	0	112.9

Retrieved 172 of 172 residues in 52.5 ms (Link to these results)

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