A0A5K4F9P5_SCHMA Loading...

ABC transporter ATP-binding protein

AlphaFold DB , UniProt , Accession A0A5K4F9P5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 64 aa.

						>A0A5K4F9P5_SCHMA|A0A5K4F9P5
MIVFEFCGVLGTGRFNPEEFTVVIDNTLFILPSFAFANYDVRLTDIVLSRTTVEENLLHYAEVF
					

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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	62.2	Low	62.6	Low	166 Å²	166	96 Å²	96	82%	0.818	54%	0.537	S	S	*	.				0	85.8	0	-153.1	174.3	86.5	0	0	110.4	V3 E18	M1-V3 HydrophobicContact CE-CG2 4.03Å; M1-V3 HydrophobicContact CG-CG2 4.2Å; M1-E18 WeakPolarHBondContact CA-OE1 3.36Å; M1-E18 WeakPolarHBondContact CA-OE2 3.35Å; M1-E18 PolarHBondContact N-OE1 3.35Å; M1-E18 PolarHBondContact N-OE2 3.39Å
2	I	56.2	Low	63.2	Low	102 Å²	102	95.8 Å²	95.8	52%	0.523	54%	0.54	S	S	.	.			trans	-88.4	123.5	169.2	-60.9	173.6	0	0	0	106.9	F4 P17 E18	I2-F4 HydrophobicContact CG2-CD2 4.08Å; I2-F4 HydrophobicContact CG2-CE1 4.22Å; I2-F4 HydrophobicContact CG2-CE2 3.45Å; I2-F4 VanDerWaalsContact CG2-CE2 3.45Å; I2-F4 HydrophobicContact CG2-CZ 3.53Å; I2-P17 WeakPolarHBondContact O-CD 3.2Å; I2-E18 PolarHBondContact N-OE1 2.93Å
3	V	69.1	Low	64.3	Low	62 Å²	62	88.6 Å²	88.6	38%	0.376	50%	0.501	S	S	.	.			trans	-119.6	127.7	174.7	180	0	0	0	0	107.7	M1 R14 F15	M1-V3 HydrophobicContact CE-CG2 4.03Å; M1-V3 HydrophobicContact CG-CG2 4.2Å; V3-R14 HydrophobicContact CG1-CB 3.97Å; V3-R14 HydrophobicContact CG1-CG 4.43Å; V3-F15 WeakPolarHBondContact CA-O 3.46Å
4	F	66.7	Low	65.2	Low	95 Å²	95	92.6 Å²	92.6	42%	0.417	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.7	176.3	-63.5	-86.2	0	0	0	109.3	I2 R14 F15 P17	I2-F4 HydrophobicContact CG2-CD2 4.08Å; I2-F4 HydrophobicContact CG2-CE1 4.22Å; I2-F4 HydrophobicContact CG2-CE2 3.45Å; I2-F4 VanDerWaalsContact CG2-CE2 3.45Å; I2-F4 HydrophobicContact CG2-CZ 3.53Å; F4-R14 CarbonylContact O-C 3.53Å; F4-R14 WeakPolarHBondContact O-CA 3.42Å; F4-F15 HydrophobicContact CB-CB 4.29Å; F4-F15 HydrophobicContact CB-CD1 4.06Å; F4-F15 AromaticContact CD2-CD1 3.6Å; F4-F15 HydrophobicContact CD2-CD1 3.6Å; F4-F15 AromaticContact CD2-CE1 3.96Å; F4-F15 HydrophobicContact CD2-CE1 3.96Å; F4-F15 HydrophobicContact CE2-CD1 4.46Å; F4-F15 HydrophobicContact CE2-CE1 4.39Å; F4-F15 HydrophobicContact CG-CD1 4.17Å; F4-F15 PolarHBondContact N-O 2.98Å; F4-F15 PolarHBondContact O-N 3.47Å; F4-P17 HydrophobicContact CD2-CG 4.31Å; F4-P17 HydrophobicContact CE2-CG 3.98Å
5	E	70.1	Confident	66	Low	141 Å²	141	87.3 Å²	87.3	66%	0.659	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.3	171.2	-55.8	-160.4	136.8	0	0	109.3	G13 R14	E5-G13 WeakPolarHBondContact CA-O 3.44Å; E5-R14 HydrophobicContact CG-CG 4.25Å; E5-R14 IonicContact OE1-CZ 3.58Å; E5-R14 IonicContact OE1-NE 2.89Å; E5-R14 PolarHBondContact OE1-NE 2.87Å; E5-R14 IonicContact OE1-NH2 3.44Å; E5-R14 PolarHBondContact OE1-NH2 3.05Å
6	F	68.6	Low	66.9	Low	71 Å²	71	82.6 Å²	82.6	31%	0.311	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.8	176.8	64.2	-91.9	0	0	0	110.7	T12 G13 F15 V22 I24	F6-T12 CarbonylContact O-C 3.4Å; F6-T12 WeakPolarHBondContact O-CA 3.47Å; F6-G13 WeakPolarHBondContact CD1-O 3.27Å; F6-G13 PolarHBondContact N-O 2.89Å; F6-G13 PolarHBondContact O-N 3.44Å; F6-F15 HydrophobicContact CD1-CB 4.28Å; F6-F15 HydrophobicContact CE1-CB 4.07Å; F6-V22 HydrophobicContact CE1-CG1 4.13Å; F6-V22 HydrophobicContact CZ-CG1 3.71Å; F6-I24 HydrophobicContact CE2-CD1 4.29Å; F6-I24 HydrophobicContact CE2-CG1 4.39Å; F6-I24 HydrophobicContact CZ-CD1 4.17Å; F6-I24 HydrophobicContact CZ-CG1 4.07Å
7	C	58.9	Low	67.1	Low	108 Å²	108	80 Å²	80	73%	0.73	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.8	172.7	-169	0	0	0	0	108	T12	C7-T12 HydrophobicContact CB-CG2 3.87Å
8	G	60.3	Low	67.4	Low	40 Å²	40	82.1 Å²	82.1	41%	0.412	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	-175	-176.9	0	0	0	0	0	112.6	L10 G11	G8-L10 PolarHBondContact O-N 3.03Å; G8-G11 PolarHBondContact N-O 3.28Å; G8-G11 PolarHBondContact O-N 3.04Å
9	V	56.5	Low	67.8	Low	158 Å²	158	84.3 Å²	84.3	96%	0.958	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.3	177.5	-177.1	0	0	0	0	111.8	G11	V9-G11 VanDerWaalsContact C-N 3.33Å
10	L	56.2	Low	68.2	Low	90 Å²	90	83.6 Å²	83.6	47%	0.471	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	0.7	179.8	-63.1	171.1	0	0	0	113.6	G8 I24 F34	G8-L10 PolarHBondContact O-N 3.03Å; L10-I24 HydrophobicContact CB-CD1 4.28Å; L10-I24 WeakPolarHBondContact O-CG2 3.42Å; L10-F34 HydrophobicContact CD1-CE2 3.93Å; L10-F34 HydrophobicContact CD1-CZ 3.7Å
11	G	63.4	Low	68.7	Low	23 Å²	23	80.4 Å²	80.4	24%	0.237	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	115.2	-166.2	-177.6	0	0	0	0	0	113.3	G8 V9	G8-G11 PolarHBondContact N-O 3.28Å; G8-G11 PolarHBondContact O-N 3.04Å; V9-G11 VanDerWaalsContact C-N 3.33Å
12	T	70.5	Confident	69.5	Low	93 Å²	93	72.9 Å²	72.9	57%	0.571	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	131.8	173.5	29.2	0	0	0	0	109.4	F6 C7	F6-T12 CarbonylContact O-C 3.4Å; F6-T12 WeakPolarHBondContact O-CA 3.47Å; C7-T12 HydrophobicContact CB-CG2 3.87Å
13	G	77.3	Confident	70.6	Confident	3 Å²	3	70.2 Å²	70.2	3%	0.031	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	158.5	-176.8	0	0	0	0	0	113.3	E5 F6 V23	E5-G13 WeakPolarHBondContact CA-O 3.44Å; F6-G13 WeakPolarHBondContact CD1-O 3.27Å; F6-G13 PolarHBondContact N-O 2.89Å; F6-G13 PolarHBondContact O-N 3.44Å; G13-V23 CarbonylContact C-O 3.57Å; G13-V23 WeakPolarHBondContact CA-O 3.28Å
14	R	76.4	Confident	70.9	Confident	145 Å²	145	67.7 Å²	67.7	55%	0.547	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.7	172.9	-62.9	-171.8	176.8	145.8	5.5	109.2	V3 F4 E5 V22 V23	V3-R14 HydrophobicContact CG1-CB 3.97Å; V3-R14 HydrophobicContact CG1-CG 4.43Å; F4-R14 CarbonylContact O-C 3.53Å; F4-R14 WeakPolarHBondContact O-CA 3.42Å; E5-R14 HydrophobicContact CG-CG 4.25Å; E5-R14 IonicContact OE1-CZ 3.58Å; E5-R14 IonicContact OE1-NE 2.89Å; E5-R14 PolarHBondContact OE1-NE 2.87Å; E5-R14 IonicContact OE1-NH2 3.44Å; E5-R14 PolarHBondContact OE1-NH2 3.05Å; R14-V22 CarbonylContact O-C 3.49Å; R14-V22 VanDerWaalsContact O-CA 3.29Å; R14-V22 WeakPolarHBondContact O-CA 3.49Å; R14-V23 PolarHBondContact N-O 3.45Å; R14-V23 PolarHBondContact O-N 2.77Å
15	F	77.7	Confident	71.4	Confident	12 Å²	12	68.6 Å²	68.6	5%	0.053	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.5	176.3	164.7	-124.4	0	0	0	109.4	V3 F4 F6 P17 V22 L31 I46	V3-F15 WeakPolarHBondContact CA-O 3.46Å; F4-F15 HydrophobicContact CB-CB 4.29Å; F4-F15 HydrophobicContact CB-CD1 4.06Å; F4-F15 AromaticContact CD2-CD1 3.6Å; F4-F15 HydrophobicContact CD2-CD1 3.6Å; F4-F15 AromaticContact CD2-CE1 3.96Å; F4-F15 HydrophobicContact CD2-CE1 3.96Å; F4-F15 HydrophobicContact CE2-CD1 4.46Å; F4-F15 HydrophobicContact CE2-CE1 4.39Å; F4-F15 HydrophobicContact CG-CD1 4.17Å; F4-F15 PolarHBondContact N-O 2.98Å; F4-F15 PolarHBondContact O-N 3.47Å; F6-F15 HydrophobicContact CD1-CB 4.28Å; F6-F15 HydrophobicContact CE1-CB 4.07Å; F15-P17 HydrophobicContact CE1-CB 3.72Å; F15-P17 HydrophobicContact CE1-CG 4.14Å; F15-P17 HydrophobicContact CE2-CB 4.12Å; F15-P17 HydrophobicContact CZ-CB 3.41Å; F15-P17 VanDerWaalsContact CZ-CB 3.41Å; F15-P17 HydrophobicContact CZ-CG 4.26Å; F15-V22 HydrophobicContact CB-CG2 4.34Å; F15-V22 HydrophobicContact CD2-CG2 4.04Å; F15-L31 HydrophobicContact CD2-CD1 3.51Å; F15-L31 HydrophobicContact CE2-CD1 3.29Å; F15-L31 HydrophobicContact CE2-CD2 3.88Å; F15-L31 HydrophobicContact CE2-CG 4.2Å; F15-L31 HydrophobicContact CZ-CD1 4.5Å; F15-L31 HydrophobicContact CZ-CD2 4.46Å; F15-I46 HydrophobicContact CD1-CD1 3.95Å; F15-I46 HydrophobicContact CE1-CD1 3.49Å; F15-I46 VanDerWaalsContact CE1-CD1 3.49Å
16	N	80.1	Confident	71.8	Confident	12 Å²	12	69.7 Å²	69.7	6%	0.064	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	103.2	169	-172.2	-7.7	0	0	0	109.3	E18 E19 F20 T21	N16-E18 VanDerWaalsContact C-N 3.3Å; N16-E18 PolarHBondContact O-N 3.45Å; N16-E18 WeakPolarHBondContact OD1-CB 3.24Å; N16-E18 PolarHBondContact OD1-N 2.97Å; N16-E19 HydrophobicContact CB-CB 4.3Å; N16-E19 VanDerWaalsContact ND2-CG 3.27Å; N16-E19 WeakPolarHBondContact ND2-CG 3.43Å; N16-E19 PolarHBondContact ND2-OE2 3.08Å; N16-E19 PolarHBondContact O-N 3.5Å; N16-E19 PolarHBondContact OD1-N 3.47Å; N16-F20 WeakPolarHBondContact O-CA 3.34Å; N16-F20 PolarHBondContact O-N 2.91Å; N16-T21 PolarHBondContact N-O 3.49Å; N16-T21 PolarHBondContact O-N 2.78Å; N16-T21 VanDerWaalsContact O-N 3.08Å
17	P	69.8	Low	72.2	Confident	39 Å²	39	69.8 Å²	69.8	25%	0.253	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-29	176.5	27.9	-36.9	0	0	0	113.3	I2 F4 F15 E19 F20	I2-P17 WeakPolarHBondContact O-CD 3.2Å; F4-P17 HydrophobicContact CD2-CG 4.31Å; F4-P17 HydrophobicContact CE2-CG 3.98Å; F15-P17 HydrophobicContact CE1-CB 3.72Å; F15-P17 HydrophobicContact CE1-CG 4.14Å; F15-P17 HydrophobicContact CE2-CB 4.12Å; F15-P17 HydrophobicContact CZ-CB 3.41Å; F15-P17 VanDerWaalsContact CZ-CB 3.41Å; F15-P17 HydrophobicContact CZ-CG 4.26Å; P17-E19 VanDerWaalsContact C-N 3.29Å; P17-E19 PolarHBondContact O-N 2.79Å; P17-F20 WeakPolarHBondContact O-CD2 3.41Å; P17-F20 PolarHBondContact O-N 2.86Å
18	E	73.7	Confident	73.2	Confident	117 Å²	117	70 Å²	70	55%	0.547	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-34.8	-179.1	-65.3	173.4	-165.3	0	0	110.3	M1 I2 N16	M1-E18 WeakPolarHBondContact CA-OE1 3.36Å; M1-E18 WeakPolarHBondContact CA-OE2 3.35Å; M1-E18 PolarHBondContact N-OE1 3.35Å; M1-E18 PolarHBondContact N-OE2 3.39Å; I2-E18 PolarHBondContact N-OE1 2.93Å; N16-E18 VanDerWaalsContact C-N 3.3Å; N16-E18 PolarHBondContact O-N 3.45Å; N16-E18 WeakPolarHBondContact OD1-CB 3.24Å; N16-E18 PolarHBondContact OD1-N 2.97Å
19	E	74.4	Confident	73.8	Confident	124 Å²	124	71.4 Å²	71.4	58%	0.579	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-0.4	-179.9	-65.7	178.2	171.1	0	0	113.5	N16 P17 T21	N16-E19 HydrophobicContact CB-CB 4.3Å; N16-E19 VanDerWaalsContact ND2-CG 3.27Å; N16-E19 WeakPolarHBondContact ND2-CG 3.43Å; N16-E19 PolarHBondContact ND2-OE2 3.08Å; N16-E19 PolarHBondContact O-N 3.5Å; N16-E19 PolarHBondContact OD1-N 3.47Å; P17-E19 VanDerWaalsContact C-N 3.29Å; P17-E19 PolarHBondContact O-N 2.79Å; E19-T21 HydrophobicContact CB-CG2 4.08Å; E19-T21 VanDerWaalsContact O-CG2 3.28Å; E19-T21 WeakPolarHBondContact O-CG2 3.29Å; E19-T21 PolarHBondContact O-N 2.83Å
20	F	76	Confident	74.6	Confident	70 Å²	70	68.6 Å²	68.6	31%	0.307	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	42.8	-171.6	-71.4	-95.4	0	0	0	112.7	N16 P17 L31	N16-F20 WeakPolarHBondContact O-CA 3.34Å; N16-F20 PolarHBondContact O-N 2.91Å; P17-F20 WeakPolarHBondContact O-CD2 3.41Å; P17-F20 PolarHBondContact O-N 2.86Å; F20-L31 HydrophobicContact CB-CB 4.35Å; F20-L31 WeakPolarHBondContact O-CB 3.02Å; F20-L31 WeakPolarHBondContact O-CD1 3.28Å; F20-L31 PolarHBondContact O-N 2.82Å
21	T	78.1	Confident	75.2	Confident	18 Å²	18	65.6 Å²	65.6	11%	0.11	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	147.5	-178.9	61.4	0	0	0	0	112.4	N16 E19 L28 F29	N16-T21 PolarHBondContact N-O 3.49Å; N16-T21 PolarHBondContact O-N 2.78Å; N16-T21 VanDerWaalsContact O-N 3.08Å; E19-T21 HydrophobicContact CB-CG2 4.08Å; E19-T21 VanDerWaalsContact O-CG2 3.28Å; E19-T21 WeakPolarHBondContact O-CG2 3.29Å; E19-T21 PolarHBondContact O-N 2.83Å; T21-L28 HydrophobicContact CG2-CD1 3.99Å; T21-F29 CarbonylContact C-O 3.56Å; T21-F29 WeakPolarHBondContact CA-O 3.27Å
22	V	78.8	Confident	75	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.7	172.6	165.2	0	0	0	0	107.8	F6 R14 F15 I24 F29 L31	F6-V22 HydrophobicContact CE1-CG1 4.13Å; F6-V22 HydrophobicContact CZ-CG1 3.71Å; R14-V22 CarbonylContact O-C 3.49Å; R14-V22 VanDerWaalsContact O-CA 3.29Å; R14-V22 WeakPolarHBondContact O-CA 3.49Å; F15-V22 HydrophobicContact CB-CG2 4.34Å; F15-V22 HydrophobicContact CD2-CG2 4.04Å; V22-I24 HydrophobicContact CG1-CD1 3.89Å; V22-I24 HydrophobicContact CG1-CG1 3.72Å; V22-F29 PolarHBondContact N-O 3.14Å; V22-F29 PolarHBondContact O-N 2.8Å; V22-L31 HydrophobicContact CG2-CD1 3.67Å; V22-L31 HydrophobicContact CG2-CG 4.28Å
23	V	79.3	Confident	74.4	Confident	46 Å²	46	65.5 Å²	65.5	28%	0.279	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.9	171.1	-179.5	0	0	0	0	108.4	G13 R14 T27 L28	G13-V23 CarbonylContact C-O 3.57Å; G13-V23 WeakPolarHBondContact CA-O 3.28Å; R14-V23 PolarHBondContact N-O 3.45Å; R14-V23 PolarHBondContact O-N 2.77Å; V23-T27 CarbonylContact C-O 3.58Å; V23-T27 VanDerWaalsContact CA-O 3.27Å; V23-T27 WeakPolarHBondContact CA-O 3.36Å; V23-L28 HydrophobicContact CG2-CD1 3.56Å
24	I	77	Confident	73.5	Confident	10 Å²	10	66 Å²	66	5%	0.051	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.3	172.7	-59.9	172.2	0	0	0	107.3	F6 L10 V22 N26 T27 F29 F34	F6-I24 HydrophobicContact CE2-CD1 4.29Å; F6-I24 HydrophobicContact CE2-CG1 4.39Å; F6-I24 HydrophobicContact CZ-CD1 4.17Å; F6-I24 HydrophobicContact CZ-CG1 4.07Å; L10-I24 HydrophobicContact CB-CD1 4.28Å; L10-I24 WeakPolarHBondContact O-CG2 3.42Å; V22-I24 HydrophobicContact CG1-CD1 3.89Å; V22-I24 HydrophobicContact CG1-CG1 3.72Å; I24-N26 VanDerWaalsContact C-N 3.25Å; I24-N26 PolarHBondContact O-N 3.07Å; I24-T27 PolarHBondContact N-O 3.18Å; I24-T27 WeakPolarHBondContact O-CA 3.43Å; I24-T27 WeakPolarHBondContact O-CB 3.35Å; I24-T27 PolarHBondContact O-N 3.42Å; I24-F29 HydrophobicContact CB-CE2 4.29Å; I24-F34 HydrophobicContact CD1-CD2 4.41Å; I24-F34 HydrophobicContact CD1-CE1 4.46Å; I24-F34 HydrophobicContact CD1-CE2 3.4Å; I24-F34 HydrophobicContact CD1-CZ 3.42Å; I24-F34 VanDerWaalsContact CD1-CZ 3.42Å
25	D	76.6	Confident	72.8	Confident	114 Å²	114	61.5 Å²	61.5	61%	0.61	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	46.9	-179	-63.3	-21.9	0	0	0	113.2	T27	D25-T27 PolarHBondContact O-N 2.82Å; D25-T27 VanDerWaalsContact O-N 3.1Å
26	N	78.8	Confident	71.5	Confident	163 Å²	163	66.8 Å²	66.8	87%	0.872	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	9.1	-175.3	-70.5	13.4	0	0	0	116.1	I24	I24-N26 VanDerWaalsContact C-N 3.25Å; I24-N26 PolarHBondContact O-N 3.07Å
27	T	76.4	Confident	70.3	Confident	74 Å²	74	69.8 Å²	69.8	45%	0.454	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.1	173.1	-55.2	0	0	0	0	109.8	V23 I24 D25 F29	V23-T27 CarbonylContact C-O 3.58Å; V23-T27 VanDerWaalsContact CA-O 3.27Å; V23-T27 WeakPolarHBondContact CA-O 3.36Å; I24-T27 PolarHBondContact N-O 3.18Å; I24-T27 WeakPolarHBondContact O-CA 3.43Å; I24-T27 WeakPolarHBondContact O-CB 3.35Å; I24-T27 PolarHBondContact O-N 3.42Å; D25-T27 PolarHBondContact O-N 2.82Å; D25-T27 VanDerWaalsContact O-N 3.1Å; T27-F29 HydrophobicContact CG2-CD2 4.33Å; T27-F29 HydrophobicContact CG2-CE1 4.21Å; T27-F29 HydrophobicContact CG2-CE2 3.6Å; T27-F29 HydrophobicContact CG2-CZ 3.53Å; T27-F29 WeakPolarHBondContact O-CD2 3.45Å; T27-F29 WeakPolarHBondContact O-CE2 3.32Å
28	L	80.1	Confident	69.5	Low	111 Å²	111	70.9 Å²	70.9	58%	0.581	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	128.6	178.3	-176.8	71.7	0	0	0	110.8	T21 V23	T21-L28 HydrophobicContact CG2-CD1 3.99Å; V23-L28 HydrophobicContact CG2-CD1 3.56Å
29	F	73.6	Confident	68	Low	71 Å²	71	74.8 Å²	74.8	31%	0.311	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.3	173.4	-58.4	-90.4	0	0	0	109.7	T21 V22 I24 T27 F34	T21-F29 CarbonylContact C-O 3.56Å; T21-F29 WeakPolarHBondContact CA-O 3.27Å; V22-F29 PolarHBondContact N-O 3.14Å; V22-F29 PolarHBondContact O-N 2.8Å; I24-F29 HydrophobicContact CB-CE2 4.29Å; T27-F29 HydrophobicContact CG2-CD2 4.33Å; T27-F29 HydrophobicContact CG2-CE1 4.21Å; T27-F29 HydrophobicContact CG2-CE2 3.6Å; T27-F29 HydrophobicContact CG2-CZ 3.53Å; T27-F29 WeakPolarHBondContact O-CD2 3.45Å; T27-F29 WeakPolarHBondContact O-CE2 3.32Å; F29-F34 HydrophobicContact CB-CB 3.95Å; F29-F34 HydrophobicContact CB-CD2 4.11Å; F29-F34 HydrophobicContact CB-CG 4.37Å; F29-F34 HydrophobicContact CD1-CD2 4.23Å; F29-F34 HydrophobicContact CD2-CD2 4.27Å; F29-F34 AromaticContact CG-CD2 3.95Å; F29-F34 HydrophobicContact CG-CD2 3.95Å
30	I	73.1	Confident	66.7	Low	98 Å²	98	74.9 Å²	74.9	50%	0.503	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	134.7	167.9	-43.9	-177	0	0	0	107.3	P32 S33 F34	I30-P32 VanDerWaalsContact C-CD 3.41Å; I30-P32 HydrophobicContact CG2-CG 4.49Å; I30-S33 WeakPolarHBondContact O-CA 3.48Å; I30-S33 WeakPolarHBondContact O-CB 3.43Å; I30-S33 PolarHBondContact O-N 2.81Å; I30-F34 PolarHBondContact O-N 2.79Å
31	L	67.7	Low	65.2	Low	28 Å²	28	74.9 Å²	74.9	15%	0.147	41%	0.408	C	S	.	.	H	α-helix	trans	-49.7	-46	-173.1	-115.1	92.4	0	0	0	114.6	F15 F20 V22 S33 F34 A35	F15-L31 HydrophobicContact CD2-CD1 3.51Å; F15-L31 HydrophobicContact CE2-CD1 3.29Å; F15-L31 HydrophobicContact CE2-CD2 3.88Å; F15-L31 HydrophobicContact CE2-CG 4.2Å; F15-L31 HydrophobicContact CZ-CD1 4.5Å; F15-L31 HydrophobicContact CZ-CD2 4.46Å; F20-L31 HydrophobicContact CB-CB 4.35Å; F20-L31 WeakPolarHBondContact O-CB 3.02Å; F20-L31 WeakPolarHBondContact O-CD1 3.28Å; F20-L31 PolarHBondContact O-N 2.82Å; V22-L31 HydrophobicContact CG2-CD1 3.67Å; V22-L31 HydrophobicContact CG2-CG 4.28Å; L31-S33 VanDerWaalsContact C-N 3.32Å; L31-S33 PolarHBondContact O-N 3.04Å; L31-F34 PolarHBondContact O-N 3.21Å; L31-A35 VanDerWaalsContact O-CB 3.23Å; L31-A35 WeakPolarHBondContact O-CB 3.27Å; L31-A35 PolarHBondContact O-N 3.49Å
32	P	59.2	Low	63.6	Low	42 Å²	42	83.6 Å²	83.6	27%	0.273	44%	0.439	S	S	.	.	H	α-helix	trans	-58.2	-48	178	-22.6	34.6	0	0	0	110.2	I30 F34 A35 F36 L57	I30-P32 VanDerWaalsContact C-CD 3.41Å; I30-P32 HydrophobicContact CG2-CG 4.49Å; P32-F34 VanDerWaalsContact C-N 3.34Å; P32-F34 PolarHBondContact O-N 2.8Å; P32-A35 PolarHBondContact O-N 2.89Å; P32-F36 HydrophobicContact CB-CD2 4.45Å; P32-F36 HydrophobicContact CB-CE2 4.47Å; P32-F36 WeakPolarHBondContact O-CB 3.24Å; P32-F36 WeakPolarHBondContact O-CD2 3.33Å; P32-F36 PolarHBondContact O-N 2.87Å; P32-L57 HydrophobicContact CB-CD2 4.3Å
33	S	58.1	Low	62	Low	71 Å²	71	86.2 Å²	86.2	50%	0.497	45%	0.452	S	S	.	.	H	α-helix	trans	-61.6	-40	177.7	-49.3	0	0	0	0	112.6	I30 L31 A37	I30-S33 WeakPolarHBondContact O-CA 3.48Å; I30-S33 WeakPolarHBondContact O-CB 3.43Å; I30-S33 PolarHBondContact O-N 2.81Å; L31-S33 VanDerWaalsContact C-N 3.32Å; L31-S33 PolarHBondContact O-N 3.04Å; S33-A37 VanDerWaalsContact O-CB 3.27Å; S33-A37 WeakPolarHBondContact O-CB 3.45Å; S33-A37 PolarHBondContact O-N 3.35Å
34	F	59.6	Low	60	Low	15 Å²	15	90 Å²	90	7%	0.066	48%	0.476	C	S	.	.	H	α-helix	trans	-68.8	-42.1	177.5	-172.9	-104.5	0	0	0	112.6	L10 I24 F29 I30 L31 P32 A37 N38 V41	L10-F34 HydrophobicContact CD1-CE2 3.93Å; L10-F34 HydrophobicContact CD1-CZ 3.7Å; I24-F34 HydrophobicContact CD1-CD2 4.41Å; I24-F34 HydrophobicContact CD1-CE1 4.46Å; I24-F34 HydrophobicContact CD1-CE2 3.4Å; I24-F34 HydrophobicContact CD1-CZ 3.42Å; I24-F34 VanDerWaalsContact CD1-CZ 3.42Å; F29-F34 HydrophobicContact CB-CB 3.95Å; F29-F34 HydrophobicContact CB-CD2 4.11Å; F29-F34 HydrophobicContact CB-CG 4.37Å; F29-F34 HydrophobicContact CD1-CD2 4.23Å; F29-F34 HydrophobicContact CD2-CD2 4.27Å; F29-F34 AromaticContact CG-CD2 3.95Å; F29-F34 HydrophobicContact CG-CD2 3.95Å; I30-F34 PolarHBondContact O-N 2.79Å; L31-F34 PolarHBondContact O-N 3.21Å; P32-F34 VanDerWaalsContact C-N 3.34Å; P32-F34 PolarHBondContact O-N 2.8Å; F34-A37 PolarHBondContact O-N 3.21Å; F34-N38 WeakPolarHBondContact CD2-ND2 3.43Å; F34-N38 VanDerWaalsContact CE2-ND2 3.32Å; F34-N38 WeakPolarHBondContact CE2-ND2 3.38Å; F34-N38 PolarHBondContact O-N 2.8Å; F34-N38 VanDerWaalsContact O-N 3.13Å; F34-N38 PolarHBondContact O-ND2 3.3Å; F34-V41 HydrophobicContact CD1-CG2 4Å; F34-V41 HydrophobicContact CE1-CG1 4.48Å; F34-V41 HydrophobicContact CE1-CG2 3.63Å
35	A	60.6	Low	58	Low	49 Å²	49	97.1 Å²	97.1	41%	0.405	51%	0.514	S	S	.	.	H	α-helix	trans	-67.6	-41.4	178.6	0	0	0	0	0	111.6	L31 P32 Y39	L31-A35 VanDerWaalsContact O-CB 3.23Å; L31-A35 WeakPolarHBondContact O-CB 3.27Å; L31-A35 PolarHBondContact O-N 3.49Å; P32-A35 PolarHBondContact O-N 2.89Å; A35-Y39 PolarHBondContact O-N 2.9Å; A35-Y39 VanDerWaalsContact O-N 3.09Å
36	F	50.8	Low	56.1	Low	123 Å²	123	94 Å²	94	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-37.6	173.8	-80.7	-65.1	0	0	0	112.3	P32 Y39 L57	P32-F36 HydrophobicContact CB-CD2 4.45Å; P32-F36 HydrophobicContact CB-CE2 4.47Å; P32-F36 WeakPolarHBondContact O-CB 3.24Å; P32-F36 WeakPolarHBondContact O-CD2 3.33Å; P32-F36 PolarHBondContact O-N 2.87Å; F36-Y39 WeakPolarHBondContact O-CD2 3.45Å; F36-Y39 WeakPolarHBondContact O-CE2 3.36Å; F36-L57 HydrophobicContact CE2-CD2 4.16Å; F36-L57 HydrophobicContact CZ-CD2 4.5Å
37	A	53.9	Low	54.1	Low	75 Å²	75	93 Å²	93	62%	0.62	50%	0.497	S	S	*	.	H	α-helix	trans	-72.3	-29.9	-179.6	0	0	0	0	0	113.3	S33 F34	S33-A37 VanDerWaalsContact O-CB 3.27Å; S33-A37 WeakPolarHBondContact O-CB 3.45Å; S33-A37 PolarHBondContact O-N 3.35Å; F34-A37 PolarHBondContact O-N 3.21Å
38	N	54	Low	52.4	Low	63 Å²	63	93.1 Å²	93.1	34%	0.337	49%	0.494	S	S	.	.	H	α-helix	trans	-111.3	-2.7	-170.6	-67	-76.2	0	0	0	115.1	F34 D40 V41	F34-N38 WeakPolarHBondContact CD2-ND2 3.43Å; F34-N38 VanDerWaalsContact CE2-ND2 3.32Å; F34-N38 WeakPolarHBondContact CE2-ND2 3.38Å; F34-N38 PolarHBondContact O-N 2.8Å; F34-N38 VanDerWaalsContact O-N 3.13Å; F34-N38 PolarHBondContact O-ND2 3.3Å; N38-D40 PolarHBondContact O-N 3.15Å; N38-V41 HydrophobicContact CB-CG2 4.08Å
39	Y	43	Very low	50.4	Low	199 Å²	199	90.2 Å²	90.2	78%	0.78	48%	0.483	S	S	*	.	S	Bend	trans	48.2	-4.9	171	-82.7	-82	0	0	0	119.3	A35 F36	A35-Y39 PolarHBondContact O-N 2.9Å; A35-Y39 VanDerWaalsContact O-N 3.09Å; F36-Y39 WeakPolarHBondContact O-CD2 3.45Å; F36-Y39 WeakPolarHBondContact O-CE2 3.36Å
40	D	46.6	Very low	48.9	Very low	126 Å²	126	96.1 Å²	96.1	67%	0.674	50%	0.503	S	S	*	.			trans	-151.7	35.7	-173.5	-142	3.3	0	0	0	112.6	N38 R42	N38-D40 PolarHBondContact O-N 3.15Å; D40-R42 PolarHBondContact O-N 3.45Å
41	V	43.2	Very low	47.7	Very low	69 Å²	69	95.1 Å²	95.1	42%	0.418	50%	0.502	S	S	.	.			trans	-75.5	81.9	170	-171.3	0	0	0	0	108.4	F34 N38 L43	F34-V41 HydrophobicContact CD1-CG2 4Å; F34-V41 HydrophobicContact CE1-CG1 4.48Å; F34-V41 HydrophobicContact CE1-CG2 3.63Å; N38-V41 HydrophobicContact CB-CG2 4.08Å; V41-L43 HydrophobicContact CG1-CG 4.36Å; V41-L43 PolarHBondContact O-N 3.13Å; V41-L43 VanDerWaalsContact O-N 3.14Å
42	R	45.4	Very low	46.8	Very low	201 Å²	201	96.2 Å²	96.2	76%	0.758	51%	0.509	S	S	*	.			trans	-70.9	98.8	160.6	-72.6	-174.7	177.9	-153.3	-1.9	107.4	D40 T44	D40-R42 PolarHBondContact O-N 3.45Å; R42-T44 HydrophobicContact CB-CG2 4.42Å; R42-T44 PolarHBondContact O-N 3.46Å
43	L	45.8	Very low	46.2	Very low	62 Å²	62	97.2 Å²	97.2	33%	0.325	52%	0.515	S	S	.	.			trans	-65.5	84.7	161.5	-78.9	160.8	0	0	0	107.3	V41 D45 I46 L48	V41-L43 HydrophobicContact CG1-CG 4.36Å; V41-L43 PolarHBondContact O-N 3.13Å; V41-L43 VanDerWaalsContact O-N 3.14Å; L43-D45 PolarHBondContact O-N 3.02Å; L43-I46 HydrophobicContact CB-CB 3.92Å; L43-I46 HydrophobicContact CB-CG1 4.34Å; L43-I46 HydrophobicContact CD1-CB 4.35Å; L43-I46 HydrophobicContact CD1-CD1 4.42Å; L43-I46 HydrophobicContact CD2-CD1 4.04Å; L43-I46 HydrophobicContact CD2-CG1 4.33Å; L43-I46 CarbonylContact O-C 3.59Å; L43-I46 PolarHBondContact O-N 3.49Å; L43-L48 HydrophobicContact CD1-CD1 4.48Å
44	T	35.9	Very low	45.6	Very low	125 Å²	125	98.4 Å²	98.4	77%	0.767	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.8	-172.8	15.1	0	0	0	0	114.3	R42	R42-T44 HydrophobicContact CB-CG2 4.42Å; R42-T44 PolarHBondContact O-N 3.46Å
45	D	35.6	Very low	45.1	Very low	161 Å²	161	103.6 Å²	103.6	86%	0.861	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	2.6	172.4	-84.4	-52.6	0	0	0	114.3	L43	L43-D45 PolarHBondContact O-N 3.02Å
46	I	37.4	Very low	44.4	Very low	48 Å²	48	104.2 Å²	104.2	25%	0.246	53%	0.533	C	S	.	.			trans	-122.4	91.4	174.3	-44.2	-175.1	0	0	0	108	F15 L43 L48	F15-I46 HydrophobicContact CD1-CD1 3.95Å; F15-I46 HydrophobicContact CE1-CD1 3.49Å; F15-I46 VanDerWaalsContact CE1-CD1 3.49Å; L43-I46 HydrophobicContact CB-CB 3.92Å; L43-I46 HydrophobicContact CB-CG1 4.34Å; L43-I46 HydrophobicContact CD1-CB 4.35Å; L43-I46 HydrophobicContact CD1-CD1 4.42Å; L43-I46 HydrophobicContact CD2-CD1 4.04Å; L43-I46 HydrophobicContact CD2-CG1 4.33Å; L43-I46 CarbonylContact O-C 3.59Å; L43-I46 PolarHBondContact O-N 3.49Å; I46-L48 HydrophobicContact CG2-CD1 4.5Å; I46-L48 HydrophobicContact CG2-CD2 4.08Å; I46-L48 HydrophobicContact CG2-CG 3.79Å; I46-L48 PolarHBondContact O-N 2.83Å
47	V	37.3	Very low	44.1	Very low	143 Å²	143	101.6 Å²	101.6	87%	0.867	53%	0.525	S	S	*	.			trans	-70.8	78.9	166.4	-175	0	0	0	0	107.6	S49	V47-S49 PolarHBondContact O-N 2.89Å
48	L	39.6	Very low	43.4	Very low	76 Å²	76	103.8 Å²	103.8	40%	0.398	53%	0.525	S	S	.	.			trans	-68.9	114	158.2	-67	172.1	0	0	0	105.4	L43 I46 R50 T52 V53	L43-L48 HydrophobicContact CD1-CD1 4.48Å; I46-L48 HydrophobicContact CG2-CD1 4.5Å; I46-L48 HydrophobicContact CG2-CD2 4.08Å; I46-L48 HydrophobicContact CG2-CG 3.79Å; I46-L48 PolarHBondContact O-N 2.83Å; L48-R50 PolarHBondContact O-N 2.94Å; L48-T52 HydrophobicContact CD2-CG2 4.46Å; L48-V53 HydrophobicContact CB-CG2 3.69Å; L48-V53 HydrophobicContact CD1-CG2 4.34Å
49	S	38.9	Very low	42.8	Very low	50 Å²	50	107.6 Å²	107.6	35%	0.35	54%	0.541	S	S	.	.			trans	-55.5	143.5	176.8	87.9	0	0	0	0	108.6	V47 T51 T52 V53	V47-S49 PolarHBondContact O-N 2.89Å; S49-T51 PolarHBondContact O-N 3.04Å; S49-T52 WeakPolarHBondContact O-CA 3.44Å; S49-T52 WeakPolarHBondContact O-CB 3.33Å; S49-T52 PolarHBondContact O-N 3.1Å; S49-T52 PolarHBondContact OG-N 2.83Å; S49-T52 PolarHBondContact OG-OG1 2.74Å; S49-V53 PolarHBondContact O-N 2.91Å; S49-V53 VanDerWaalsContact O-N 3.15Å
50	R	41.9	Very low	42.5	Very low	194 Å²	194	105 Å²	105	73%	0.732	53%	0.53	S	S	*	.	H	α-helix	trans	-50.6	-36.3	178.6	-172.4	179.3	175.1	168.8	4.6	111.8	L48 V53 E54	L48-R50 PolarHBondContact O-N 2.94Å; R50-V53 PolarHBondContact O-N 2.97Å; R50-E54 IonicContact CZ-OE1 3.84Å; R50-E54 IonicContact NE-OE1 3.04Å; R50-E54 PolarHBondContact NE-OE1 3Å; R50-E54 IonicContact NH2-OE1 3.77Å; R50-E54 WeakPolarHBondContact O-CB 3.46Å; R50-E54 WeakPolarHBondContact O-CG 3.4Å; R50-E54 PolarHBondContact O-N 3.41Å
51	T	47	Very low	41.9	Very low	78 Å²	78	102.6 Å²	102.6	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-61.5	-42.9	174.6	-38.6	0	0	0	0	112.1	S49 V53 E54 E55	S49-T51 PolarHBondContact O-N 3.04Å; T51-V53 VanDerWaalsContact C-N 3.35Å; T51-V53 PolarHBondContact O-N 3.32Å; T51-E54 PolarHBondContact O-N 3.2Å; T51-E55 HydrophobicContact CG2-CG 4.39Å; T51-E55 VanDerWaalsContact O-CB 3.24Å; T51-E55 WeakPolarHBondContact O-CB 3.23Å; T51-E55 VanDerWaalsContact O-CG 3.24Å; T51-E55 WeakPolarHBondContact O-CG 3.48Å; T51-E55 PolarHBondContact O-N 3.4Å
52	T	49.5	Very low	41.5	Very low	50 Å²	50	107.7 Å²	107.7	31%	0.307	55%	0.547	S	S	.	.	H	α-helix	trans	-67	-34.9	178.7	-47.4	0	0	0	0	112.3	L48 S49 N56	L48-T52 HydrophobicContact CD2-CG2 4.46Å; S49-T52 WeakPolarHBondContact O-CA 3.44Å; S49-T52 WeakPolarHBondContact O-CB 3.33Å; S49-T52 PolarHBondContact O-N 3.1Å; S49-T52 PolarHBondContact OG-N 2.83Å; S49-T52 PolarHBondContact OG-OG1 2.74Å; T52-N56 WeakPolarHBondContact O-CB 3.25Å; T52-N56 PolarHBondContact O-N 2.97Å; T52-N56 VanDerWaalsContact O-N 3.13Å; T52-N56 PolarHBondContact O-ND2 3.5Å
53	V	47.3	Very low	40.9	Very low	63 Å²	63	102.8 Å²	102.8	38%	0.382	54%	0.54	S	S	.	.	H	α-helix	trans	-74.2	-43.9	176.2	179.2	0	0	0	0	110.8	L48 S49 R50 T51 L57	L48-V53 HydrophobicContact CB-CG2 3.69Å; L48-V53 HydrophobicContact CD1-CG2 4.34Å; S49-V53 PolarHBondContact O-N 2.91Å; S49-V53 VanDerWaalsContact O-N 3.15Å; R50-V53 PolarHBondContact O-N 2.97Å; T51-V53 VanDerWaalsContact C-N 3.35Å; T51-V53 PolarHBondContact O-N 3.32Å; V53-L57 HydrophobicContact CG1-CD1 3.73Å; V53-L57 HydrophobicContact CG1-CG 4.4Å; V53-L57 VanDerWaalsContact O-CB 3.28Å; V53-L57 WeakPolarHBondContact O-CB 3.22Å; V53-L57 VanDerWaalsContact O-CG 3.27Å; V53-L57 WeakPolarHBondContact O-CG 3.32Å; V53-L57 PolarHBondContact O-N 2.81Å
54	E	44.9	Very low	40.2	Very low	97 Å²	97	112.8 Å²	112.8	45%	0.453	58%	0.581	S	S	.	*	H	α-helix	trans	-65.8	-41.4	177.3	-74.4	174.9	-175.8	0	0	111.9	R50 T51 L57 L58	R50-E54 IonicContact CZ-OE1 3.84Å; R50-E54 IonicContact NE-OE1 3.04Å; R50-E54 PolarHBondContact NE-OE1 3Å; R50-E54 IonicContact NH2-OE1 3.77Å; R50-E54 WeakPolarHBondContact O-CB 3.46Å; R50-E54 WeakPolarHBondContact O-CG 3.4Å; R50-E54 PolarHBondContact O-N 3.41Å; T51-E54 PolarHBondContact O-N 3.2Å; E54-L57 PolarHBondContact O-N 3.35Å; E54-L58 WeakPolarHBondContact O-CB 3.36Å; E54-L58 WeakPolarHBondContact O-CD1 3.02Å; E54-L58 WeakPolarHBondContact O-CG 3.45Å; E54-L58 PolarHBondContact O-N 3.13Å
55	E	48.5	Very low	40.4	Very low	124 Å²	124	112.2 Å²	112.2	58%	0.579	57%	0.572	S	S	*	*	H	α-helix	trans	-67.2	-41.1	176.3	-74.7	174.9	168.9	0	0	112.5	T51 L58 H59	T51-E55 HydrophobicContact CG2-CG 4.39Å; T51-E55 VanDerWaalsContact O-CB 3.24Å; T51-E55 WeakPolarHBondContact O-CB 3.23Å; T51-E55 VanDerWaalsContact O-CG 3.24Å; T51-E55 WeakPolarHBondContact O-CG 3.48Å; T51-E55 PolarHBondContact O-N 3.4Å; E55-L58 PolarHBondContact O-N 3.24Å; E55-H59 WeakPolarHBondContact O-CB 3.17Å; E55-H59 PolarHBondContact O-N 3.43Å
56	N	46.9	Very low	40.7	Very low	62 Å²	62	109.6 Å²	109.6	33%	0.332	56%	0.557	S	S	.	*	H	α-helix	trans	-71.5	-34.2	176	-80.8	-67.3	0	0	0	112.4	T52 H59 Y60	T52-N56 WeakPolarHBondContact O-CB 3.25Å; T52-N56 PolarHBondContact O-N 2.97Å; T52-N56 VanDerWaalsContact O-N 3.13Å; T52-N56 PolarHBondContact O-ND2 3.5Å; N56-H59 PolarHBondContact O-N 2.88Å; N56-Y60 WeakPolarHBondContact O-CD2 3.27Å; N56-Y60 PolarHBondContact O-N 2.87Å
57	L	43	Very low	40.8	Very low	68 Å²	68	113.1 Å²	113.1	36%	0.356	57%	0.574	S	S	.	*	H	α-helix	trans	-69.1	-38.9	173.7	-77.8	167.7	0	0	0	111.9	P32 F36 V53 E54 H59 Y60 A61	P32-L57 HydrophobicContact CB-CD2 4.3Å; F36-L57 HydrophobicContact CE2-CD2 4.16Å; F36-L57 HydrophobicContact CZ-CD2 4.5Å; V53-L57 HydrophobicContact CG1-CD1 3.73Å; V53-L57 HydrophobicContact CG1-CG 4.4Å; V53-L57 VanDerWaalsContact O-CB 3.28Å; V53-L57 WeakPolarHBondContact O-CB 3.22Å; V53-L57 VanDerWaalsContact O-CG 3.27Å; V53-L57 WeakPolarHBondContact O-CG 3.32Å; V53-L57 PolarHBondContact O-N 2.81Å; E54-L57 PolarHBondContact O-N 3.35Å; L57-H59 VanDerWaalsContact C-N 3.34Å; L57-Y60 PolarHBondContact O-N 3.38Å; L57-A61 VanDerWaalsContact O-CB 3.25Å; L57-A61 WeakPolarHBondContact O-CB 3.01Å; L57-A61 PolarHBondContact O-N 3.26Å
58	L	40.4	Very low	41.1	Very low	120 Å²	120	111.3 Å²	111.3	63%	0.628	56%	0.557	S	S	*	*	H	α-helix	trans	-64.7	-37.8	174.3	-83.6	158.4	0	0	0	111.9	E54 E55 Y60 A61	E54-L58 WeakPolarHBondContact O-CB 3.36Å; E54-L58 WeakPolarHBondContact O-CD1 3.02Å; E54-L58 WeakPolarHBondContact O-CG 3.45Å; E54-L58 PolarHBondContact O-N 3.13Å; E55-L58 PolarHBondContact O-N 3.24Å; L58-Y60 VanDerWaalsContact C-N 3.27Å; L58-Y60 PolarHBondContact O-N 2.68Å; L58-A61 PolarHBondContact O-N 3.45Å
59	H	40.6	Very low	41.1	Very low	144 Å²	144	113.5 Å²	113.5	67%	0.667	57%	0.567	S	S	*	*	H	α-helix	trans	-67.7	-26.4	177.9	-140.1	69	0	0	0	113.5	E55 N56 L57	E55-H59 WeakPolarHBondContact O-CB 3.17Å; E55-H59 PolarHBondContact O-N 3.43Å; N56-H59 PolarHBondContact O-N 2.88Å; L57-H59 VanDerWaalsContact C-N 3.34Å
60	Y	36.8	Very low	41.3	Very low	143 Å²	143	117.7 Å²	117.7	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-98	-20.9	177.5	-85.3	-85.3	0	0	0	113.9	N56 L57 L58 E62 V63	N56-Y60 WeakPolarHBondContact O-CD2 3.27Å; N56-Y60 PolarHBondContact O-N 2.87Å; L57-Y60 PolarHBondContact O-N 3.38Å; L58-Y60 VanDerWaalsContact C-N 3.27Å; L58-Y60 PolarHBondContact O-N 2.68Å; Y60-E62 VanDerWaalsContact C-N 3.28Å; Y60-E62 PolarHBondContact O-N 3.09Å; Y60-V63 PolarHBondContact O-N 3.02Å
61	A	34.5	Very low	41.3	Very low	76 Å²	76	112.3 Å²	112.3	63%	0.628	57%	0.57	S	S	*	*	H	α-helix	trans	-72.3	-19	175.9	0	0	0	0	0	113.3	L57 L58 V63	L57-A61 VanDerWaalsContact O-CB 3.25Å; L57-A61 WeakPolarHBondContact O-CB 3.01Å; L57-A61 PolarHBondContact O-N 3.26Å; L58-A61 PolarHBondContact O-N 3.45Å; A61-V63 VanDerWaalsContact C-N 3.32Å
62	E	34.7	Very low	40.8	Very low	176 Å²	176	114.9 Å²	114.9	82%	0.822	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-1.8	171.7	-74.4	-168.5	145.3	0	0	113.9	Y60	Y60-E62 VanDerWaalsContact C-N 3.28Å; Y60-E62 PolarHBondContact O-N 3.09Å
63	V	32.6	Very low	40.1	Very low	99 Å²	99	120.3 Å²	120.3	60%	0.6	60%	0.6	S	S	*	*			trans	-107.1	45.3	179.2	-164.4	0	0	0	0	110.7	Y60 A61	Y60-V63 PolarHBondContact O-N 3.02Å; A61-V63 VanDerWaalsContact C-N 3.32Å
64	F	31.1	Very low	39.4	Very low	272 Å²	272	125.5 Å²	125.5	100%	1.193	62%	0.62	S	S	*	*			trans	-155.1	0	161.7	-87.2	-71.5	0	0	0	111.9

Retrieved 64 of 64 residues in 83.5 ms (Link to these results)

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