A0A077ZKE8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKE8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 131 aa.

						>A0A077ZKE8_TRITR|A0A077ZKE8
MALNGGTLQGQGVYSVWLQPTARILAKADVIVSRRKPFGFDFIVGMKGIKALGGVQVDANGRAHFGLNGAMACATKEADIRLEEPHFSVVLNRAKRHWTASWKWRNSMGGSRSLEERGTGVPPSEKLQPPI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.5	Very low	55.4	Low	205 Å²	205	82.2 Å²	82.2	100%	1.01	50%	0.498	S	S	*	.				0	136.3	0	-164.4	-179.2	-64.5	0	0	108.3	L8	M1-L8 WeakPolarHBondContact O-CB 3.4Å
2	A	47.7	Very low	57.1	Low	28 Å²	28	77.5 Å²	77.5	23%	0.231	48%	0.479	C	S	.	.			trans	-125.2	143.1	179.3	0	0	0	0	0	114.4	G6 L8	A2-G6 WeakPolarHBondContact CB-O 3.09Å; A2-L8 HydrophobicContact CB-CB 3.98Å; A2-L8 HydrophobicContact CB-CD1 4.13Å
3	L	50.5	Low	58.6	Low	86 Å²	86	79.5 Å²	79.5	45%	0.45	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-45.6	177.3	-73.4	155.7	0	0	0	109.2	G5 L8 P37 F38 I43	L3-G5 PolarHBondContact O-N 3.29Å; L3-L8 HydrophobicContact CB-CD1 3.77Å; L3-L8 HydrophobicContact CD1-CD1 3.8Å; L3-L8 HydrophobicContact CG-CD1 3.9Å; L3-L8 VanDerWaalsContact N-CD1 3.26Å; L3-P37 HydrophobicContact CB-CB 4.26Å; L3-P37 HydrophobicContact CD1-CB 4.15Å; L3-F38 HydrophobicContact CB-CD2 4.06Å; L3-F38 HydrophobicContact CB-CE2 3.68Å; L3-F38 WeakPolarHBondContact O-CE2 3.28Å; L3-F38 WeakPolarHBondContact O-CZ 3.1Å; L3-I43 HydrophobicContact CB-CD1 4.42Å; L3-I43 HydrophobicContact CD1-CD1 4.09Å
4	N	50.5	Low	59.6	Low	70 Å²	70	82.6 Å²	82.6	37%	0.374	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	28.7	-172.2	67.4	-18.8	0	0	0	116.3	G6 F38	N4-G6 PolarHBondContact O-N 2.83Å; N4-G6 PolarHBondContact OD1-N 2.87Å; N4-F38 HydrophobicContact CB-CD1 3.84Å; N4-F38 HydrophobicContact CB-CE1 4.06Å; N4-F38 HydrophobicContact CB-CG 4.15Å
5	G	51.4	Low	60.8	Low	55 Å²	55	81.5 Å²	81.5	57%	0.567	49%	0.488	S	S	*	.	S	Bend	trans	69.6	-5.8	-178.4	0	0	0	0	0	115.7	L3	L3-G5 PolarHBondContact O-N 3.29Å
6	G	51.5	Low	61.6	Low	45 Å²	45	79.7 Å²	79.7	46%	0.464	48%	0.477	S	S	.	.	S	Bend	trans	-85.6	-153.2	171.1	0	0	0	0	0	112.7	A2 N4	A2-G6 WeakPolarHBondContact CB-O 3.09Å; N4-G6 PolarHBondContact O-N 2.83Å; N4-G6 PolarHBondContact OD1-N 2.87Å
7	T	55.4	Low	62.6	Low	117 Å²	117	84.7 Å²	84.7	72%	0.718	49%	0.486	S	S	*	.			trans	-105.5	122.7	163.2	-43.8	0	0	0	0	108.2	Q9	T7-Q9 PolarHBondContact O-N 3.18Å; T7-Q9 VanDerWaalsContact O-N 3.14Å
8	L	57	Low	63.1	Low	31 Å²	31	81.5 Å²	81.5	16%	0.162	47%	0.467	C	S	.	.			trans	-73.7	109.8	172.7	-133	109.7	0	0	0	106.5	M1 A2 L3 G10 I31	M1-L8 WeakPolarHBondContact O-CB 3.4Å; A2-L8 HydrophobicContact CB-CB 3.98Å; A2-L8 HydrophobicContact CB-CD1 4.13Å; L3-L8 HydrophobicContact CB-CD1 3.77Å; L3-L8 HydrophobicContact CD1-CD1 3.8Å; L3-L8 HydrophobicContact CG-CD1 3.9Å; L3-L8 VanDerWaalsContact N-CD1 3.26Å; L8-G10 VanDerWaalsContact C-N 3.28Å; L8-G10 PolarHBondContact O-N 2.77Å; L8-G10 VanDerWaalsContact O-N 3.14Å; L8-I31 HydrophobicContact CD2-CG2 4.03Å
9	Q	64.8	Low	63.4	Low	114 Å²	114	83.9 Å²	83.9	53%	0.533	47%	0.474	S	S	.	.			trans	-85.6	81.6	171.3	-65.6	-174.2	5.9	0	0	107.7	T7 Q11 R34	T7-Q9 PolarHBondContact O-N 3.18Å; T7-Q9 VanDerWaalsContact O-N 3.14Å; Q9-Q11 PolarHBondContact O-N 3.16Å; Q9-R34 PolarHBondContact O-N 3.48Å
10	G	65.9	Low	63.5	Low	45 Å²	45	81.2 Å²	81.2	46%	0.464	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	126.4	170.5	0	0	0	0	0	109.6	L8 V32	L8-G10 VanDerWaalsContact C-N 3.28Å; L8-G10 PolarHBondContact O-N 2.77Å; L8-G10 VanDerWaalsContact O-N 3.14Å; G10-V32 CarbonylContact C-O 3.38Å; G10-V32 VanDerWaalsContact CA-O 3.28Å; G10-V32 WeakPolarHBondContact CA-O 2.73Å
11	Q	76.2	Confident	63.2	Low	108 Å²	108	84.6 Å²	84.6	51%	0.505	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-22.7	170.7	-72.5	-174.9	-39.3	0	0	111.8	Q9 V32 R34	Q9-Q11 PolarHBondContact O-N 3.16Å; Q11-V32 HydrophobicContact CB-CG1 4.39Å; Q11-V32 PolarHBondContact N-O 2.77Å; Q11-R34 HydrophobicContact CG-CG 3.69Å
12	G	75.8	Confident	63.8	Low	26 Å²	26	78.8 Å²	78.8	27%	0.268	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	166.8	174.7	179.7	0	0	0	0	0	112	V32	G12-V32 PolarHBondContact O-N 3.07Å; G12-V32 VanDerWaalsContact O-N 3.08Å
13	V	76.7	Confident	64.5	Low	104 Å²	104	83.4 Å²	83.4	63%	0.63	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.6	169.5	178.3	0	0	0	0	107.7	D29 V30 I31	V13-D29 HydrophobicContact CG1-CB 4.17Å; V13-V30 WeakPolarHBondContact CA-O 3.28Å; V13-I31 HydrophobicContact CG2-CG1 4.37Å
14	Y	72.7	Confident	65	Low	123 Å²	123	84.8 Å²	84.8	48%	0.482	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	152.3	-180	-61.3	-94.1	0	0	0	109.1	D29 V30 V32	Y14-D29 CarbonylContact O-C 3.4Å; Y14-D29 WeakPolarHBondContact O-CA 3.35Å; Y14-V30 PolarHBondContact N-O 3.18Å; Y14-V30 WeakPolarHBondContact O-CG2 3.4Å; Y14-V30 PolarHBondContact O-N 2.64Å; Y14-V32 HydrophobicContact CD2-CB 3.88Å; Y14-V32 HydrophobicContact CD2-CG2 3.32Å; Y14-V32 HydrophobicContact CE2-CB 3.87Å; Y14-V32 HydrophobicContact CE2-CG2 3.75Å; Y14-V32 HydrophobicContact CG-CG2 4.15Å
15	S	77.4	Confident	65.9	Low	65 Å²	65	85.5 Å²	85.5	46%	0.455	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.9	168	-55.8	0	0	0	0	109.6	K27 D29	S15-K27 WeakPolarHBondContact OG-CE 3.35Å; S15-D29 PolarHBondContact OG-OD1 3.12Å
16	V	73.3	Confident	66.7	Low	53 Å²	53	83.5 Å²	83.5	32%	0.321	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	157.5	173.3	-62.7	0	0	0	0	110.2	L18 K27 A28 V30	V16-L18 HydrophobicContact CG2-CD2 3.88Å; V16-L18 HydrophobicContact CG2-CG 4.35Å; V16-K27 WeakPolarHBondContact O-CA 3.43Å; V16-A28 PolarHBondContact N-O 3.44Å; V16-A28 PolarHBondContact O-N 3.14Å; V16-V30 HydrophobicContact CB-CG2 4.31Å; V16-V30 HydrophobicContact CG1-CG2 3.56Å; V16-V30 HydrophobicContact CG2-CB 4.28Å; V16-V30 HydrophobicContact CG2-CG1 3.42Å; V16-V30 VanDerWaalsContact CG2-CG1 3.42Å; V16-V30 HydrophobicContact CG2-CG2 3.86Å
17	W	78.7	Confident	67.9	Low	165 Å²	165	87 Å²	87	63%	0.625	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	119.8	168.4	-67.2	103.7	0	0	0	109.4	L25 K27	W17-L25 HydrophobicContact CB-CB 4.44Å; W17-L25 HydrophobicContact CB-CD2 3.53Å; W17-L25 HydrophobicContact CD2-CB 4.35Å; W17-L25 HydrophobicContact CE3-CB 3.65Å; W17-L25 HydrophobicContact CG-CD2 4.12Å; W17-L25 HydrophobicContact CZ3-CB 4.22Å; W17-K27 HydrophobicContact CD2-CB 4.37Å; W17-K27 HydrophobicContact CE3-CB 3.84Å; W17-K27 HydrophobicContact CH2-CB 3.98Å; W17-K27 HydrophobicContact CZ2-CB 4.44Å; W17-K27 HydrophobicContact CZ2-CD 4.4Å; W17-K27 HydrophobicContact CZ3-CB 3.66Å
18	L	71.7	Confident	68.5	Low	27 Å²	27	81.7 Å²	81.7	14%	0.141	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.1	173.6	-58.5	-179.6	0	0	0	107.6	V16 P20 L25 A26 A28 F42 L52	V16-L18 HydrophobicContact CG2-CD2 3.88Å; V16-L18 HydrophobicContact CG2-CG 4.35Å; L18-P20 WeakPolarHBondContact O-CD 3.25Å; L18-L25 WeakPolarHBondContact O-CA 2.8Å; L18-A26 PolarHBondContact N-O 2.91Å; L18-A26 PolarHBondContact O-N 3.49Å; L18-A28 HydrophobicContact CD1-CB 3.65Å; L18-A28 HydrophobicContact CG-CB 4.13Å; L18-F42 HydrophobicContact CD1-CE2 4.39Å; L18-F42 HydrophobicContact CD2-CE2 4.06Å; L18-L52 HydrophobicContact CB-CD2 3.89Å; L18-L52 HydrophobicContact CD1-CD1 3.88Å; L18-L52 HydrophobicContact CD1-CD2 4.3Å; L18-L52 HydrophobicContact CD1-CG 4.17Å
19	Q	69.6	Low	69.3	Low	128 Å²	128	85.1 Å²	85.1	60%	0.598	46%	0.455	S	S	*	.			trans	-112.4	100.9	173.5	-169.7	176	0.3	0	0	109	R23 L25	Q19-R23 WeakPolarHBondContact CG-O 3.32Å; Q19-L25 HydrophobicContact CB-CD2 4.04Å; Q19-L25 HydrophobicContact CB-CG 4.07Å; Q19-L25 HydrophobicContact CG-CG 4.18Å
20	P	63.8	Low	69.8	Low	29 Å²	29	81.1 Å²	81.1	19%	0.188	44%	0.439	C	S	.	.			trans	-62.9	151.4	167.1	-16.6	30.4	0	0	0	110.1	L18 A22 R23 L52 A70	L18-P20 WeakPolarHBondContact O-CD 3.25Å; P20-A22 PolarHBondContact O-N 2.99Å; P20-R23 PolarHBondContact O-N 3.4Å; P20-R23 VanDerWaalsContact O-N 3.1Å; P20-L52 HydrophobicContact CG-CD2 4.08Å; P20-A70 HydrophobicContact CB-CB 3.1Å; P20-A70 HydrophobicContact CG-CB 3.8Å
21	T	58.4	Low	70.1	Confident	152 Å²	152	84.2 Å²	84.2	93%	0.933	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-1.3	-162.8	-44.8	0	0	0	0	118.2
22	A	51.4	Low	70	Confident	83 Å²	83	81.6 Å²	81.6	69%	0.686	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.2	7.4	174.6	0	0	0	0	0	116.1	P20	P20-A22 PolarHBondContact O-N 2.99Å
23	R	61.6	Low	69.8	Low	126 Å²	126	81.9 Å²	81.9	48%	0.475	43%	0.432	S	S	.	.	S	Bend	trans	-149.3	-179.5	-159.7	-61.1	-170.6	-179.1	-114.3	-6.4	115.3	Q19 P20 N68	Q19-R23 WeakPolarHBondContact CG-O 3.32Å; P20-R23 PolarHBondContact O-N 3.4Å; P20-R23 VanDerWaalsContact O-N 3.1Å; R23-N68 HydrophobicContact CB-CB 4.11Å; R23-N68 VanDerWaalsContact CD-CB 3.41Å; R23-N68 WeakPolarHBondContact CD-O 3.49Å; R23-N68 HydrophobicContact CG-CB 4.27Å; R23-N68 PolarHBondContact NE-O 2.8Å; R23-N68 PolarHBondContact NH1-OD1 3.22Å
24	I	60.4	Low	69.7	Low	115 Å²	115	85.3 Å²	85.3	59%	0.59	43%	0.434	S	S	*	.			trans	-43.3	131	-170.5	-58.7	174.4	0	0	0	112.3	A26	I24-A26 PolarHBondContact O-N 3.14Å
25	L	70.9	Confident	69.7	Low	84 Å²	84	88.8 Å²	88.8	44%	0.44	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-67.7	124.7	173	-68.1	113.6	0	0	0	110.2	W17 L18 Q19	W17-L25 HydrophobicContact CB-CB 4.44Å; W17-L25 HydrophobicContact CB-CD2 3.53Å; W17-L25 HydrophobicContact CD2-CB 4.35Å; W17-L25 HydrophobicContact CE3-CB 3.65Å; W17-L25 HydrophobicContact CG-CD2 4.12Å; W17-L25 HydrophobicContact CZ3-CB 4.22Å; L18-L25 WeakPolarHBondContact O-CA 2.8Å; Q19-L25 HydrophobicContact CB-CD2 4.04Å; Q19-L25 HydrophobicContact CB-CG 4.07Å; Q19-L25 HydrophobicContact CG-CG 4.18Å
26	A	68.4	Low	69.5	Low	13 Å²	13	91.5 Å²	91.5	11%	0.107	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.8	170.5	0	0	0	0	0	109.7	L18 I24 A51 L52	L18-A26 PolarHBondContact N-O 2.91Å; L18-A26 PolarHBondContact O-N 3.49Å; I24-A26 PolarHBondContact O-N 3.14Å; A26-A51 HydrophobicContact CB-CB 4.45Å; A26-A51 WeakPolarHBondContact CB-O 3.47Å; A26-L52 HydrophobicContact CB-CD2 3.62Å; A26-L52 HydrophobicContact CB-CG 4.2Å
27	K	75.4	Confident	69.2	Low	119 Å²	119	89.7 Å²	89.7	52%	0.517	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	126.3	171.4	-167	178.5	178.9	-176.6	0	108.9	S15 V16 W17	S15-K27 WeakPolarHBondContact OG-CE 3.35Å; V16-K27 WeakPolarHBondContact O-CA 3.43Å; W17-K27 HydrophobicContact CD2-CB 4.37Å; W17-K27 HydrophobicContact CE3-CB 3.84Å; W17-K27 HydrophobicContact CH2-CB 3.98Å; W17-K27 HydrophobicContact CZ2-CB 4.44Å; W17-K27 HydrophobicContact CZ2-CD 4.4Å; W17-K27 HydrophobicContact CZ3-CB 3.66Å
28	A	69.2	Low	68.8	Low	6 Å²	6	84.9 Å²	84.9	5%	0.05	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	140.5	175.1	0	0	0	0	0	110.4	V16 L18	V16-A28 PolarHBondContact N-O 3.44Å; V16-A28 PolarHBondContact O-N 3.14Å; L18-A28 HydrophobicContact CD1-CB 3.65Å; L18-A28 HydrophobicContact CG-CB 4.13Å
29	D	73.3	Confident	68.9	Low	102 Å²	102	86.3 Å²	86.3	55%	0.545	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.9	167.8	-62.5	-33.8	0	0	0	109.4	V13 Y14 S15	V13-D29 HydrophobicContact CG1-CB 4.17Å; Y14-D29 CarbonylContact O-C 3.4Å; Y14-D29 WeakPolarHBondContact O-CA 3.35Å; S15-D29 PolarHBondContact OG-OD1 3.12Å
30	V	74.6	Confident	68.9	Low	31 Å²	31	86.6 Å²	86.6	19%	0.188	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146.5	179.3	-67.7	0	0	0	0	110.4	V13 Y14 V16	V13-V30 WeakPolarHBondContact CA-O 3.28Å; Y14-V30 PolarHBondContact N-O 3.18Å; Y14-V30 WeakPolarHBondContact O-CG2 3.4Å; Y14-V30 PolarHBondContact O-N 2.64Å; V16-V30 HydrophobicContact CB-CG2 4.31Å; V16-V30 HydrophobicContact CG1-CG2 3.56Å; V16-V30 HydrophobicContact CG2-CB 4.28Å; V16-V30 HydrophobicContact CG2-CG1 3.42Å; V16-V30 VanDerWaalsContact CG2-CG1 3.42Å; V16-V30 HydrophobicContact CG2-CG2 3.86Å
31	I	72.6	Confident	69.4	Low	110 Å²	110	91.5 Å²	91.5	56%	0.564	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.5	168.4	-60.7	171.6	0	0	0	106.5	L8 V13	L8-I31 HydrophobicContact CD2-CG2 4.03Å; V13-I31 HydrophobicContact CG2-CG1 4.37Å
32	V	74.2	Confident	69.9	Low	53 Å²	53	89.3 Å²	89.3	32%	0.321	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	127.5	174.6	174.2	0	0	0	0	108	G10 Q11 G12 Y14	G10-V32 CarbonylContact C-O 3.38Å; G10-V32 VanDerWaalsContact CA-O 3.28Å; G10-V32 WeakPolarHBondContact CA-O 2.73Å; Q11-V32 HydrophobicContact CB-CG1 4.39Å; Q11-V32 PolarHBondContact N-O 2.77Å; G12-V32 PolarHBondContact O-N 3.07Å; G12-V32 VanDerWaalsContact O-N 3.08Å; Y14-V32 HydrophobicContact CD2-CB 3.88Å; Y14-V32 HydrophobicContact CD2-CG2 3.32Å; Y14-V32 HydrophobicContact CE2-CB 3.87Å; Y14-V32 HydrophobicContact CE2-CG2 3.75Å; Y14-V32 HydrophobicContact CG-CG2 4.15Å
33	S	72.6	Confident	70.9	Confident	32 Å²	32	88.3 Å²	88.3	22%	0.224	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	143	-179.3	170.8	0	0	0	0	110	R35	S33-R35 WeakPolarHBondContact CB-O 3.17Å; S33-R35 PolarHBondContact O-N 3.19Å; S33-R35 PolarHBondContact OG-N 3.25Å; S33-R35 PolarHBondContact OG-O 3.29Å
34	R	73.2	Confident	71.4	Confident	176 Å²	176	83.7 Å²	83.7	66%	0.664	41%	0.414	S	S	*	.	S	Bend	trans	-61.9	-24.8	172.6	-67.8	-170.4	-179.9	-144	1.2	113.2	Q9 Q11	Q9-R34 PolarHBondContact O-N 3.48Å; Q11-R34 HydrophobicContact CG-CG 3.69Å
35	R	72.9	Confident	71.8	Confident	196 Å²	196	80.4 Å²	80.4	74%	0.74	41%	0.408	S	S	*	.	S	Bend	trans	-121	140.9	-178.5	-63.9	-173.7	-179.9	-172.5	0.2	109.9	S33 P37	S33-R35 WeakPolarHBondContact CB-O 3.17Å; S33-R35 PolarHBondContact O-N 3.19Å; S33-R35 PolarHBondContact OG-N 3.25Å; S33-R35 PolarHBondContact OG-O 3.29Å; R35-P37 WeakPolarHBondContact O-CD 3.16Å
36	K	74.3	Confident	71.8	Confident	121 Å²	121	81.5 Å²	81.5	53%	0.526	41%	0.412	S	S	.	.			trans	-57.6	115.6	172.3	-69.6	-164.8	-170.8	-165.7	0	109.8	F38 G39 F40 D41	K36-F38 PolarHBondContact O-N 3.07Å; K36-G39 WeakPolarHBondContact CD-O 3.27Å; K36-G39 PolarHBondContact O-N 2.71Å; K36-F40 WeakPolarHBondContact CB-O 3.31Å; K36-D41 WeakPolarHBondContact CE-OD1 3.14Å; K36-D41 IonicContact NZ-OD1 2.65Å; K36-D41 PolarHBondContact NZ-OD1 3.26Å
37	P	66.7	Low	71.7	Confident	16 Å²	16	89.2 Å²	89.2	10%	0.104	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-68.3	123.4	178.4	31.2	-37.1	0	0	0	109.2	L3 R35 G39 F40 I43	L3-P37 HydrophobicContact CB-CB 4.26Å; L3-P37 HydrophobicContact CD1-CB 4.15Å; R35-P37 WeakPolarHBondContact O-CD 3.16Å; P37-G39 PolarHBondContact O-N 3.36Å; P37-G39 VanDerWaalsContact O-N 3.07Å; P37-F40 WeakPolarHBondContact CD-O 3.26Å; P37-F40 PolarHBondContact O-N 2.76Å; P37-I43 HydrophobicContact CB-CD1 3.53Å; P37-I43 HydrophobicContact CB-CG1 4.33Å; P37-I43 HydrophobicContact CG-CD1 3.63Å; P37-I43 HydrophobicContact CG-CG1 3.86Å
38	F	69.3	Low	71.5	Confident	64 Å²	64	84 Å²	84	28%	0.281	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	52.9	25	-173.3	-61.4	-75	0	0	0	114.7	L3 N4 K36 F40 I43 E84 F87	L3-F38 HydrophobicContact CB-CD2 4.06Å; L3-F38 HydrophobicContact CB-CE2 3.68Å; L3-F38 WeakPolarHBondContact O-CE2 3.28Å; L3-F38 WeakPolarHBondContact O-CZ 3.1Å; N4-F38 HydrophobicContact CB-CD1 3.84Å; N4-F38 HydrophobicContact CB-CE1 4.06Å; N4-F38 HydrophobicContact CB-CG 4.15Å; K36-F38 PolarHBondContact O-N 3.07Å; F38-F40 HydrophobicContact CB-CD2 3.85Å; F38-F40 HydrophobicContact CB-CE2 4.15Å; F38-F40 WeakPolarHBondContact O-CD2 3.16Å; F38-F40 PolarHBondContact O-N 3.28Å; F38-I43 HydrophobicContact CD2-CD1 3.64Å; F38-I43 HydrophobicContact CE2-CD1 4.37Å; F38-E84 WeakPolarHBondContact CE1-OE2 3.4Å; F38-F87 HydrophobicContact CZ-CE1 4.35Å
39	G	73.6	Confident	71.6	Confident	56 Å²	56	85.6 Å²	85.6	58%	0.577	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	77.8	-4.4	-176.6	0	0	0	0	0	115.1	K36 P37	K36-G39 WeakPolarHBondContact CD-O 3.27Å; K36-G39 PolarHBondContact O-N 2.71Å; P37-G39 PolarHBondContact O-N 3.36Å; P37-G39 VanDerWaalsContact O-N 3.07Å
40	F	71.2	Confident	71.4	Confident	134 Å²	134	86.1 Å²	86.1	59%	0.588	43%	0.428	S	S	*	.			trans	-82.5	148.6	174.2	-63.3	-79.5	0	0	0	111.5	K36 P37 F38 F42	K36-F40 WeakPolarHBondContact CB-O 3.31Å; P37-F40 WeakPolarHBondContact CD-O 3.26Å; P37-F40 PolarHBondContact O-N 2.76Å; F38-F40 HydrophobicContact CB-CD2 3.85Å; F38-F40 HydrophobicContact CB-CE2 4.15Å; F38-F40 WeakPolarHBondContact O-CD2 3.16Å; F38-F40 PolarHBondContact O-N 3.28Å; F40-F42 VanDerWaalsContact C-N 3.26Å; F40-F42 PolarHBondContact O-N 3.39Å
41	D	73.4	Confident	71.2	Confident	132 Å²	132	86.3 Å²	86.3	71%	0.706	43%	0.432	S	S	*	.	S	Bend	trans	-67	-31.1	175.9	-64.1	-52.1	0	0	0	112	K36	K36-D41 WeakPolarHBondContact CE-OD1 3.14Å; K36-D41 IonicContact NZ-OD1 2.65Å; K36-D41 PolarHBondContact NZ-OD1 3.26Å
42	F	69.1	Low	71.3	Confident	106 Å²	106	81.6 Å²	81.6	47%	0.465	41%	0.408	S	S	.	.			trans	-151.7	153.7	177.5	115.6	-76.9	0	0	0	111.6	L18 F40 V44	L18-F42 HydrophobicContact CD1-CE2 4.39Å; L18-F42 HydrophobicContact CD2-CE2 4.06Å; F40-F42 VanDerWaalsContact C-N 3.26Å; F40-F42 PolarHBondContact O-N 3.39Å; F42-V44 HydrophobicContact CD2-CG2 4.26Å; F42-V44 HydrophobicContact CE1-CG2 3.86Å; F42-V44 HydrophobicContact CE2-CB 4.1Å; F42-V44 HydrophobicContact CE2-CG2 3.18Å; F42-V44 HydrophobicContact CZ-CB 4.26Å; F42-V44 HydrophobicContact CZ-CG2 2.95Å
43	I	71.5	Confident	71.3	Confident	62 Å²	62	80.5 Å²	80.5	32%	0.318	41%	0.408	S	S	.	.			trans	-127.3	126.9	171.3	-66.5	177	0	0	0	108	L3 P37 F38 G45	L3-I43 HydrophobicContact CB-CD1 4.42Å; L3-I43 HydrophobicContact CD1-CD1 4.09Å; P37-I43 HydrophobicContact CB-CD1 3.53Å; P37-I43 HydrophobicContact CB-CG1 4.33Å; P37-I43 HydrophobicContact CG-CD1 3.63Å; P37-I43 HydrophobicContact CG-CG1 3.86Å; F38-I43 HydrophobicContact CD2-CD1 3.64Å; F38-I43 HydrophobicContact CE2-CD1 4.37Å; I43-G45 PolarHBondContact O-N 3.45Å
44	V	72.1	Confident	71.4	Confident	30 Å²	30	79.8 Å²	79.8	18%	0.182	41%	0.406	C	S	.	.			trans	-81.1	111.3	172.9	-162.6	0	0	0	0	108.7	F42 I49 L52 F65	F42-V44 HydrophobicContact CD2-CG2 4.26Å; F42-V44 HydrophobicContact CE1-CG2 3.86Å; F42-V44 HydrophobicContact CE2-CB 4.1Å; F42-V44 HydrophobicContact CE2-CG2 3.18Å; F42-V44 HydrophobicContact CZ-CB 4.26Å; F42-V44 HydrophobicContact CZ-CG2 2.95Å; V44-I49 HydrophobicContact CB-CG1 4.13Å; V44-I49 HydrophobicContact CG1-CB 4.47Å; V44-I49 HydrophobicContact CG1-CG1 3.65Å; V44-I49 VanDerWaalsContact CG1-N 3.27Å; V44-L52 HydrophobicContact CG1-CD1 4.16Å; V44-F65 HydrophobicContact CG2-CZ 3.97Å
45	G	70.5	Confident	71.5	Confident	45 Å²	45	73.3 Å²	73.3	46%	0.464	39%	0.386	S	S	.	.			trans	-72.2	170.1	165.5	0	0	0	0	0	111.9	I43 K47 G48 I49	I43-G45 PolarHBondContact O-N 3.45Å; G45-K47 VanDerWaalsContact C-N 3.25Å; G45-K47 PolarHBondContact O-N 2.82Å; G45-K47 VanDerWaalsContact O-N 3.11Å; G45-G48 WeakPolarHBondContact O-CA 3.31Å; G45-G48 PolarHBondContact O-N 2.87Å; G45-I49 PolarHBondContact O-N 2.77Å
46	M	69.1	Low	71.3	Confident	107 Å²	107	69.6 Å²	69.6	53%	0.527	38%	0.377	S	S	.	.	H	α-helix	trans	-54.2	-37	-176.9	-168.2	62.7	69.2	0	0	114.3	G48 I49 K50	M46-G48 VanDerWaalsContact C-N 3.35Å; M46-G48 PolarHBondContact O-N 2.65Å; M46-I49 PolarHBondContact O-N 3.08Å; M46-K50 WeakPolarHBondContact O-CG 3.36Å; M46-K50 PolarHBondContact O-N 2.85Å
47	K	66.5	Low	71.2	Confident	176 Å²	176	67.8 Å²	67.8	77%	0.765	38%	0.376	S	S	*	.	H	α-helix	trans	-62.7	-41.3	176	-71.5	-172.8	177.1	-176.6	0	112.1	G45 K50 A51	G45-K47 VanDerWaalsContact C-N 3.25Å; G45-K47 PolarHBondContact O-N 2.82Å; G45-K47 VanDerWaalsContact O-N 3.11Å; K47-K50 PolarHBondContact O-N 3.24Å; K47-A51 WeakPolarHBondContact O-CB 3.48Å; K47-A51 PolarHBondContact O-N 2.81Å
48	G	71	Confident	71.5	Confident	8 Å²	8	69.3 Å²	69.3	8%	0.082	38%	0.383	C	S	.	.	H	α-helix	trans	-65.9	-40.5	174.4	0	0	0	0	0	111.6	G45 M46 K50 A51 L52	G45-G48 WeakPolarHBondContact O-CA 3.31Å; G45-G48 PolarHBondContact O-N 2.87Å; M46-G48 VanDerWaalsContact C-N 3.35Å; M46-G48 PolarHBondContact O-N 2.65Å; G48-K50 PolarHBondContact O-N 3.44Å; G48-A51 PolarHBondContact O-N 2.84Å; G48-L52 WeakPolarHBondContact O-CB 3.02Å; G48-L52 WeakPolarHBondContact O-CD1 3.43Å; G48-L52 VanDerWaalsContact O-CG 3.22Å; G48-L52 WeakPolarHBondContact O-CG 3.49Å; G48-L52 PolarHBondContact O-N 3.01Å
49	I	72.2	Confident	71.6	Confident	41 Å²	41	70.9 Å²	70.9	21%	0.21	41%	0.408	C	S	.	.	H	α-helix	trans	-59.6	-47.1	174.9	-63.7	179.5	0	0	0	110	V44 G45 M46 L52 G53 G54 V55 F65	V44-I49 HydrophobicContact CB-CG1 4.13Å; V44-I49 HydrophobicContact CG1-CB 4.47Å; V44-I49 HydrophobicContact CG1-CG1 3.65Å; V44-I49 VanDerWaalsContact CG1-N 3.27Å; G45-I49 PolarHBondContact O-N 2.77Å; M46-I49 PolarHBondContact O-N 3.08Å; I49-L52 CarbonylContact O-C 3.55Å; I49-L52 PolarHBondContact O-N 3.2Å; I49-G53 PolarHBondContact O-N 2.91Å; I49-G54 WeakPolarHBondContact O-CA 3.33Å; I49-G54 PolarHBondContact O-N 2.84Å; I49-V55 HydrophobicContact CD1-CG2 4.48Å; I49-V55 HydrophobicContact CG2-CG2 3.67Å; I49-F65 HydrophobicContact CG1-CE1 4.11Å
50	K	69.7	Low	71.7	Confident	113 Å²	113	73 Å²	73	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-62.2	-43.2	176	-74.9	-175.4	178.3	-175.4	0	112.4	M46 K47 G48 L52 G53 S124	M46-K50 WeakPolarHBondContact O-CG 3.36Å; M46-K50 PolarHBondContact O-N 2.85Å; K47-K50 PolarHBondContact O-N 3.24Å; G48-K50 PolarHBondContact O-N 3.44Å; K50-L52 PolarHBondContact O-N 2.98Å; K50-G53 WeakPolarHBondContact O-CA 3.35Å; K50-G53 PolarHBondContact O-N 2.65Å; K50-S124 WeakPolarHBondContact CE-OG 3.09Å
51	A	70.6	Confident	71.3	Confident	34 Å²	34	67 Å²	67	28%	0.281	38%	0.381	S	S	.	.	H	α-helix	trans	-61.9	-31.4	176.6	0	0	0	0	0	112.2	A26 K47 G48 G53	A26-A51 HydrophobicContact CB-CB 4.45Å; A26-A51 WeakPolarHBondContact CB-O 3.47Å; K47-A51 WeakPolarHBondContact O-CB 3.48Å; K47-A51 PolarHBondContact O-N 2.81Å; G48-A51 PolarHBondContact O-N 2.84Å; A51-G53 PolarHBondContact O-N 2.85Å
52	L	73.3	Confident	71.1	Confident	11 Å²	11	66 Å²	66	6%	0.058	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	3.4	173.9	-65.9	166.5	0	0	0	113.5	L18 P20 A26 V44 G48 I49 K50 F65 G66 L67	L18-L52 HydrophobicContact CB-CD2 3.89Å; L18-L52 HydrophobicContact CD1-CD1 3.88Å; L18-L52 HydrophobicContact CD1-CD2 4.3Å; L18-L52 HydrophobicContact CD1-CG 4.17Å; P20-L52 HydrophobicContact CG-CD2 4.08Å; A26-L52 HydrophobicContact CB-CD2 3.62Å; A26-L52 HydrophobicContact CB-CG 4.2Å; V44-L52 HydrophobicContact CG1-CD1 4.16Å; G48-L52 WeakPolarHBondContact O-CB 3.02Å; G48-L52 WeakPolarHBondContact O-CD1 3.43Å; G48-L52 VanDerWaalsContact O-CG 3.22Å; G48-L52 WeakPolarHBondContact O-CG 3.49Å; G48-L52 PolarHBondContact O-N 3.01Å; I49-L52 CarbonylContact O-C 3.55Å; I49-L52 PolarHBondContact O-N 3.2Å; K50-L52 PolarHBondContact O-N 2.98Å; L52-F65 HydrophobicContact CB-CB 3.77Å; L52-F65 HydrophobicContact CB-CD1 3.87Å; L52-F65 HydrophobicContact CB-CG 3.85Å; L52-F65 HydrophobicContact CD1-CD1 3.79Å; L52-F65 HydrophobicContact CD1-CD2 3.86Å; L52-F65 HydrophobicContact CD1-CE1 3.92Å; L52-F65 HydrophobicContact CD1-CE2 3.95Å; L52-F65 HydrophobicContact CD1-CG 3.79Å; L52-F65 HydrophobicContact CD1-CZ 4Å; L52-F65 HydrophobicContact CG-CD1 4.49Å; L52-F65 HydrophobicContact CG-CG 4.38Å; L52-G66 CarbonylContact O-C 3.55Å; L52-G66 PolarHBondContact O-N 3.49Å; L52-G66 VanDerWaalsContact O-N 3.09Å; L52-L67 PolarHBondContact O-N 2.69Å
53	G	74.6	Confident	71	Confident	31 Å²	31	61.5 Å²	61.5	32%	0.32	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	20	178.5	0	0	0	0	0	115.4	I49 K50 A51 G66	I49-G53 PolarHBondContact O-N 2.91Å; K50-G53 WeakPolarHBondContact O-CA 3.35Å; K50-G53 PolarHBondContact O-N 2.65Å; A51-G53 PolarHBondContact O-N 2.85Å; G53-G66 VanDerWaalsContact C-C 3.44Å; G53-G66 CarbonylContact C-O 3.5Å; G53-G66 VanDerWaalsContact CA-O 3.3Å; G53-G66 WeakPolarHBondContact CA-O 3.21Å; G53-G66 CarbonylContact O-C 3.12Å; G53-G66 VanDerWaalsContact O-CA 3.22Å; G53-G66 WeakPolarHBondContact O-CA 3.49Å
54	G	75.2	Confident	70.9	Confident	17 Å²	17	60.2 Å²	60.2	18%	0.175	34%	0.343	C	S	.	.			trans	90.7	-172.9	-178.6	0	0	0	0	0	112.5	I49 F65 G66	I49-G54 WeakPolarHBondContact O-CA 3.33Å; I49-G54 PolarHBondContact O-N 2.84Å; G54-F65 CarbonylContact O-C 3.33Å; G54-F65 WeakPolarHBondContact O-CA 3.48Å; G54-F65 WeakPolarHBondContact O-CD1 3.44Å; G54-G66 PolarHBondContact O-N 2.76Å
55	V	74.1	Confident	70.8	Confident	40 Å²	40	60.3 Å²	60.3	24%	0.242	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131	176.2	176.7	0	0	0	0	108.9	I49 A63 H64 F65 V121	I49-V55 HydrophobicContact CD1-CG2 4.48Å; I49-V55 HydrophobicContact CG2-CG2 3.67Å; V55-A63 HydrophobicContact CG1-CB 3.88Å; V55-H64 CarbonylContact C-O 3.49Å; V55-H64 WeakPolarHBondContact CA-O 3.26Å; V55-F65 HydrophobicContact CG2-CD1 3.62Å; V55-F65 HydrophobicContact CG2-CE1 3.48Å; V55-F65 VanDerWaalsContact CG2-CE1 3.48Å; V55-V121 WeakPolarHBondContact O-CG2 3.34Å
56	Q	69.7	Low	70.3	Confident	117 Å²	117	59 Å²	59	55%	0.547	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	147.1	171.9	-62.8	179.9	3.3	0	0	108.8	A63 H64	Q56-A63 CarbonylContact O-C 3.4Å; Q56-A63 VanDerWaalsContact O-CA 3.31Å; Q56-A63 WeakPolarHBondContact O-CA 3.49Å; Q56-H64 PolarHBondContact N-O 3.11Å; Q56-H64 PolarHBondContact O-N 2.92Å
57	V	71.6	Confident	69.8	Low	84 Å²	84	59.4 Å²	59.4	51%	0.509	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.7	175.7	-177.1	0	0	0	0	108.7	R62 A63	V57-R62 CarbonylContact C-O 3.57Å; V57-R62 VanDerWaalsContact CA-O 3.24Å; V57-R62 WeakPolarHBondContact CA-O 3.38Å; V57-A63 HydrophobicContact CG2-CB 4.33Å
58	D	72.9	Confident	69.2	Low	48 Å²	48	54.6 Å²	54.6	26%	0.257	31%	0.314	S	S	.	.			trans	-75.7	174.1	179.3	84	-7	0	0	0	112	N60 G61 R62 H64	D58-N60 PolarHBondContact O-N 2.96Å; D58-N60 VanDerWaalsContact O-N 3.13Å; D58-N60 VanDerWaalsContact OD1-C 3.28Å; D58-N60 VanDerWaalsContact OD1-CA 3.26Å; D58-N60 WeakPolarHBondContact OD1-CA 3.33Å; D58-N60 WeakPolarHBondContact OD1-CB 3.37Å; D58-N60 PolarHBondContact OD1-N 3.28Å; D58-N60 PolarHBondContact OD2-ND2 3.38Å; D58-N60 VanDerWaalsContact OD2-ND2 3.07Å; D58-G61 PolarHBondContact O-N 3.39Å; D58-G61 PolarHBondContact OD1-N 2.76Å; D58-R62 PolarHBondContact N-O 2.93Å; D58-R62 VanDerWaalsContact OD1-CB 3.27Å; D58-R62 WeakPolarHBondContact OD1-CB 3.33Å; D58-R62 PolarHBondContact OD1-N 3.44Å; D58-R62 VanDerWaalsContact OD2-CD 3.24Å; D58-R62 WeakPolarHBondContact OD2-CD 3.46Å; D58-H64 IonicContact OD2-NE2 3.84Å
59	A	71.9	Confident	68.2	Low	96 Å²	96	55.9 Å²	55.9	79%	0.793	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.9	178.7	0	0	0	0	0	113.6	G61	A59-G61 VanDerWaalsContact C-N 3.32Å
60	N	74.7	Confident	67.2	Low	102 Å²	102	54.6 Å²	54.6	55%	0.545	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	4.6	177.9	-50	-60	0	0	0	112.4	D58 R62	D58-N60 PolarHBondContact O-N 2.96Å; D58-N60 VanDerWaalsContact O-N 3.13Å; D58-N60 VanDerWaalsContact OD1-C 3.28Å; D58-N60 VanDerWaalsContact OD1-CA 3.26Å; D58-N60 WeakPolarHBondContact OD1-CA 3.33Å; D58-N60 WeakPolarHBondContact OD1-CB 3.37Å; D58-N60 PolarHBondContact OD1-N 3.28Å; D58-N60 PolarHBondContact OD2-ND2 3.38Å; D58-N60 VanDerWaalsContact OD2-ND2 3.07Å; N60-R62 VanDerWaalsContact C-N 3.34Å; N60-R62 HydrophobicContact CB-CG 4.17Å
61	G	63.6	Low	66.1	Low	7 Å²	7	53.4 Å²	53.4	7%	0.072	32%	0.32	C	S	.	.	S	Bend	trans	76.1	20.9	-177.9	0	0	0	0	0	113.8	D58 A59	D58-G61 PolarHBondContact O-N 3.39Å; D58-G61 PolarHBondContact OD1-N 2.76Å; A59-G61 VanDerWaalsContact C-N 3.32Å
62	R	69	Low	65.2	Low	110 Å²	110	53.9 Å²	53.9	42%	0.415	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.4	176.7	-59.9	161.6	159.7	-163.1	4.6	108.2	V57 D58 N60 H64 M71 C73 A74	V57-R62 CarbonylContact C-O 3.57Å; V57-R62 VanDerWaalsContact CA-O 3.24Å; V57-R62 WeakPolarHBondContact CA-O 3.38Å; D58-R62 PolarHBondContact N-O 2.93Å; D58-R62 VanDerWaalsContact OD1-CB 3.27Å; D58-R62 WeakPolarHBondContact OD1-CB 3.33Å; D58-R62 PolarHBondContact OD1-N 3.44Å; D58-R62 VanDerWaalsContact OD2-CD 3.24Å; D58-R62 WeakPolarHBondContact OD2-CD 3.46Å; N60-R62 VanDerWaalsContact C-N 3.34Å; N60-R62 HydrophobicContact CB-CG 4.17Å; R62-H64 PolarHBondContact O-CD2 3.01Å; R62-M71 HydrophobicContact CB-CE 3.61Å; R62-M71 HydrophobicContact CG-CE 3.44Å; R62-M71 VanDerWaalsContact CG-CE 3.44Å; R62-C73 CarbonylContact C-O 3.36Å; R62-C73 WeakPolarHBondContact CA-O 3.42Å; R62-A74 HydrophobicContact CG-CB 4.07Å
63	A	66.1	Low	64.3	Low	13 Å²	13	56.9 Å²	56.9	11%	0.107	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	145.3	174.2	0	0	0	0	0	109.6	V55 Q56 V57 M71 A72 C73	V55-A63 HydrophobicContact CG1-CB 3.88Å; Q56-A63 CarbonylContact O-C 3.4Å; Q56-A63 VanDerWaalsContact O-CA 3.31Å; Q56-A63 WeakPolarHBondContact O-CA 3.49Å; V57-A63 HydrophobicContact CG2-CB 4.33Å; A63-M71 CarbonylContact O-C 3.47Å; A63-M71 VanDerWaalsContact O-CA 3.3Å; A63-M71 WeakPolarHBondContact O-CA 3.41Å; A63-A72 HydrophobicContact CB-CB 4.13Å; A63-A72 PolarHBondContact O-N 2.9Å; A63-C73 PolarHBondContact N-O 3.25Å; A63-C73 PolarHBondContact O-N 2.8Å
64	H	70.1	Confident	63	Low	34 Å²	34	58.1 Å²	58.1	16%	0.157	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	141.9	-178.9	-63.6	-98.5	0	0	0	110.2	V55 Q56 D58 R62 G69 A70 M71	V55-H64 CarbonylContact C-O 3.49Å; V55-H64 WeakPolarHBondContact CA-O 3.26Å; Q56-H64 PolarHBondContact N-O 3.11Å; Q56-H64 PolarHBondContact O-N 2.92Å; D58-H64 IonicContact OD2-NE2 3.84Å; R62-H64 PolarHBondContact O-CD2 3.01Å; H64-G69 PolarHBondContact ND1-O 3.13Å; H64-A70 CarbonylContact C-O 3.42Å; H64-A70 VanDerWaalsContact C-O 3.3Å; H64-A70 WeakPolarHBondContact CA-O 3.25Å; H64-M71 VanDerWaalsContact ND1-CA 3.28Å; H64-M71 WeakPolarHBondContact ND1-CA 3.45Å; H64-M71 PolarHBondContact ND1-N 2.91Å; H64-M71 VanDerWaalsContact ND1-N 3.19Å
65	F	70.6	Confident	61.9	Low	32 Å²	32	59.2 Å²	59.2	14%	0.14	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	142.2	172	-66.4	-68.4	0	0	0	112.9	V44 I49 L52 G54 V55 G69 A70 A72	V44-F65 HydrophobicContact CG2-CZ 3.97Å; I49-F65 HydrophobicContact CG1-CE1 4.11Å; L52-F65 HydrophobicContact CB-CB 3.77Å; L52-F65 HydrophobicContact CB-CD1 3.87Å; L52-F65 HydrophobicContact CB-CG 3.85Å; L52-F65 HydrophobicContact CD1-CD1 3.79Å; L52-F65 HydrophobicContact CD1-CD2 3.86Å; L52-F65 HydrophobicContact CD1-CE1 3.92Å; L52-F65 HydrophobicContact CD1-CE2 3.95Å; L52-F65 HydrophobicContact CD1-CG 3.79Å; L52-F65 HydrophobicContact CD1-CZ 4Å; L52-F65 HydrophobicContact CG-CD1 4.49Å; L52-F65 HydrophobicContact CG-CG 4.38Å; G54-F65 CarbonylContact O-C 3.33Å; G54-F65 WeakPolarHBondContact O-CA 3.48Å; G54-F65 WeakPolarHBondContact O-CD1 3.44Å; V55-F65 HydrophobicContact CG2-CD1 3.62Å; V55-F65 HydrophobicContact CG2-CE1 3.48Å; V55-F65 VanDerWaalsContact CG2-CE1 3.48Å; F65-G69 WeakPolarHBondContact O-CA 3.43Å; F65-G69 PolarHBondContact O-N 3.32Å; F65-A70 PolarHBondContact N-O 2.86Å; F65-A70 PolarHBondContact O-N 3.13Å; F65-A72 HydrophobicContact CD2-CB 3.74Å; F65-A72 HydrophobicContact CE1-CB 4.4Å; F65-A72 HydrophobicContact CE2-CB 3.37Å; F65-A72 HydrophobicContact CG-CB 4.4Å; F65-A72 HydrophobicContact CZ-CB 3.73Å
66	G	60.6	Low	60.9	Low	18 Å²	18	67.7 Å²	67.7	19%	0.186	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	43.4	-158.1	0	0	0	0	0	118.1	L52 G53 G54	L52-G66 CarbonylContact O-C 3.55Å; L52-G66 PolarHBondContact O-N 3.49Å; L52-G66 VanDerWaalsContact O-N 3.09Å; G53-G66 VanDerWaalsContact C-C 3.44Å; G53-G66 CarbonylContact C-O 3.5Å; G53-G66 VanDerWaalsContact CA-O 3.3Å; G53-G66 WeakPolarHBondContact CA-O 3.21Å; G53-G66 CarbonylContact O-C 3.12Å; G53-G66 VanDerWaalsContact O-CA 3.22Å; G53-G66 WeakPolarHBondContact O-CA 3.49Å; G54-G66 PolarHBondContact O-N 2.76Å
67	L	58.1	Low	60.2	Low	115 Å²	115	69 Å²	69	60%	0.602	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-9.1	149.2	-102.6	154.6	0	0	0	111.4	L52	L52-L67 PolarHBondContact O-N 2.69Å
68	N	53.5	Low	59.6	Low	75 Å²	75	67.8 Å²	67.8	40%	0.401	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-171.1	19.6	-174.9	-118.3	-32.3	0	0	0	115.8	R23	R23-N68 HydrophobicContact CB-CB 4.11Å; R23-N68 VanDerWaalsContact CD-CB 3.41Å; R23-N68 WeakPolarHBondContact CD-O 3.49Å; R23-N68 HydrophobicContact CG-CB 4.27Å; R23-N68 PolarHBondContact NE-O 2.8Å; R23-N68 PolarHBondContact NH1-OD1 3.22Å
69	G	49.3	Very low	59.1	Low	35 Å²	35	70.7 Å²	70.7	36%	0.361	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	29.4	168.4	0	0	0	0	0	115.8	H64 F65 M71	H64-G69 PolarHBondContact ND1-O 3.13Å; F65-G69 WeakPolarHBondContact O-CA 3.43Å; F65-G69 PolarHBondContact O-N 3.32Å; G69-M71 PolarHBondContact O-N 3.34Å
70	A	52.1	Low	58.6	Low	15 Å²	15	68.8 Å²	68.8	12%	0.124	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	121.3	-176	0	0	0	0	0	112.6	P20 H64 F65 A72	P20-A70 HydrophobicContact CB-CB 3.1Å; P20-A70 HydrophobicContact CG-CB 3.8Å; H64-A70 CarbonylContact C-O 3.42Å; H64-A70 VanDerWaalsContact C-O 3.3Å; H64-A70 WeakPolarHBondContact CA-O 3.25Å; F65-A70 PolarHBondContact N-O 2.86Å; F65-A70 PolarHBondContact O-N 3.13Å; A70-A72 PolarHBondContact O-N 2.94Å; A70-A72 VanDerWaalsContact O-N 3.09Å
71	M	47	Very low	58.2	Low	88 Å²	88	72.8 Å²	72.8	43%	0.433	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	113.9	-176.2	-173.3	-174.8	-109.5	0	0	111.8	R62 A63 H64 G69 A74	R62-M71 HydrophobicContact CB-CE 3.61Å; R62-M71 HydrophobicContact CG-CE 3.44Å; R62-M71 VanDerWaalsContact CG-CE 3.44Å; A63-M71 CarbonylContact O-C 3.47Å; A63-M71 VanDerWaalsContact O-CA 3.3Å; A63-M71 WeakPolarHBondContact O-CA 3.41Å; H64-M71 VanDerWaalsContact ND1-CA 3.28Å; H64-M71 WeakPolarHBondContact ND1-CA 3.45Å; H64-M71 PolarHBondContact ND1-N 2.91Å; H64-M71 VanDerWaalsContact ND1-N 3.19Å; G69-M71 PolarHBondContact O-N 3.34Å; M71-A74 HydrophobicContact CE-CB 3.8Å; M71-A74 HydrophobicContact SD-CB 4.02Å
72	A	51.9	Low	58.3	Low	44 Å²	44	75.9 Å²	75.9	36%	0.364	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-43	176.6	0	0	0	0	0	111.4	A63 F65 A70	A63-A72 HydrophobicContact CB-CB 4.13Å; A63-A72 PolarHBondContact O-N 2.9Å; F65-A72 HydrophobicContact CD2-CB 3.74Å; F65-A72 HydrophobicContact CE1-CB 4.4Å; F65-A72 HydrophobicContact CE2-CB 3.37Å; F65-A72 HydrophobicContact CG-CB 4.4Å; F65-A72 HydrophobicContact CZ-CB 3.73Å; A70-A72 PolarHBondContact O-N 2.94Å; A70-A72 VanDerWaalsContact O-N 3.09Å
73	C	53.1	Low	58.4	Low	73 Å²	73	75.1 Å²	75.1	49%	0.493	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	148.3	174.3	64.5	0	0	0	0	111.3	R62 A63	R62-C73 CarbonylContact C-O 3.36Å; R62-C73 WeakPolarHBondContact CA-O 3.42Å; A63-C73 PolarHBondContact N-O 3.25Å; A63-C73 PolarHBondContact O-N 2.8Å
74	A	47.9	Very low	58.4	Low	57 Å²	57	77 Å²	77	47%	0.471	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.1	170.1	0	0	0	0	0	107.8	R62 M71	R62-A74 HydrophobicContact CG-CB 4.07Å; M71-A74 HydrophobicContact CE-CB 3.8Å; M71-A74 HydrophobicContact SD-CB 4.02Å
75	T	52	Low	57.8	Low	41 Å²	41	79.9 Å²	79.9	25%	0.252	44%	0.437	S	S	.	.			trans	-88.9	136.9	166.4	-177	0	0	0	0	109.2	E77 I80	T75-E77 VanDerWaalsContact C-N 3.31Å; T75-E77 WeakPolarHBondContact CG2-O 3.37Å; T75-E77 WeakPolarHBondContact OG1-CB 3.39Å; T75-E77 PolarHBondContact OG1-N 3.22Å; T75-E77 PolarHBondContact OG1-O 2.9Å; T75-I80 HydrophobicContact CG2-CD1 3.56Å; T75-I80 HydrophobicContact CG2-CG1 3.36Å
76	K	54.2	Low	57.4	Low	218 Å²	218	82.7 Å²	82.7	95%	0.948	45%	0.45	S	S	*	.			trans	-82.8	-18.1	163.2	-71.2	-175.4	179.2	179.9	0	111.4
77	E	53.6	Low	57.4	Low	144 Å²	144	84 Å²	84	67%	0.673	45%	0.451	S	S	*	.	S	Bend	trans	-78.6	139.2	-174.4	-137.7	163.1	-169.7	0	0	109.9	T75 D79 R93	T75-E77 VanDerWaalsContact C-N 3.31Å; T75-E77 WeakPolarHBondContact CG2-O 3.37Å; T75-E77 WeakPolarHBondContact OG1-CB 3.39Å; T75-E77 PolarHBondContact OG1-N 3.22Å; T75-E77 PolarHBondContact OG1-O 2.9Å; E77-D79 PolarHBondContact O-N 2.79Å; E77-R93 PolarHBondContact O-NH2 3.25Å
78	A	58.8	Low	58	Low	58 Å²	58	78.9 Å²	78.9	48%	0.479	43%	0.425	S	S	.	.	S	Bend	trans	-62.5	-30.1	-175.9	0	0	0	0	0	112	R93	A78-R93 VanDerWaalsContact O-CD 3.26Å; A78-R93 WeakPolarHBondContact O-CD 3.43Å; A78-R93 PolarHBondContact O-NE 3.2Å; A78-R93 VanDerWaalsContact O-NE 3.13Å; A78-R93 PolarHBondContact O-NH1 3.14Å; A78-R93 VanDerWaalsContact O-NH1 3.13Å
79	D	62.1	Low	58.5	Low	110 Å²	110	77.2 Å²	77.2	59%	0.588	42%	0.417	S	S	*	.	S	Bend	trans	-124.4	117.3	-176	-61.6	-46.6	0	0	0	109.5	E77 R81	E77-D79 PolarHBondContact O-N 2.79Å; D79-R81 PolarHBondContact O-N 3.26Å
80	I	61.7	Low	59.6	Low	55 Å²	55	78.1 Å²	78.1	28%	0.282	42%	0.416	S	S	.	.			trans	-80	103	169.7	-55.3	178.1	0	0	0	106.2	T75 V90 L91	T75-I80 HydrophobicContact CG2-CD1 3.56Å; T75-I80 HydrophobicContact CG2-CG1 3.36Å; I80-V90 WeakPolarHBondContact O-CA 3.24Å; I80-L91 HydrophobicContact CB-CB 3.9Å; I80-L91 HydrophobicContact CB-CD2 4.47Å; I80-L91 HydrophobicContact CD1-CD2 3.67Å; I80-L91 HydrophobicContact CG1-CB 4.44Å; I80-L91 HydrophobicContact CG1-CD2 4.11Å; I80-L91 PolarHBondContact O-N 3.22Å
81	R	66.5	Low	60.1	Low	186 Å²	186	78.7 Å²	78.7	70%	0.702	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	110.4	172.2	-158.1	166.5	86.9	178.1	6	110	D79 E83 V89 V90	D79-R81 PolarHBondContact O-N 3.26Å; R81-E83 HydrophobicContact CG-CG 4.28Å; R81-V89 WeakPolarHBondContact CA-O 3.49Å; R81-V90 HydrophobicContact CG-CG2 4.08Å
82	L	65.9	Low	61.2	Low	73 Å²	73	77.7 Å²	77.7	38%	0.382	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	119.4	172	-179.7	62	0	0	0	107.6	E84 F87 S88 V89	L82-E84 HydrophobicContact CD1-CG 4.11Å; L82-E84 HydrophobicContact CG-CG 4.13Å; L82-F87 HydrophobicContact CD2-CE2 3.65Å; L82-F87 HydrophobicContact CD2-CZ 3.99Å; L82-F87 HydrophobicContact CG-CE2 4.32Å; L82-S88 CarbonylContact O-C 3.4Å; L82-S88 WeakPolarHBondContact O-CA 3.46Å; L82-S88 VanDerWaalsContact O-CB 3.28Å; L82-S88 WeakPolarHBondContact O-CB 3.32Å; L82-V89 HydrophobicContact CB-CB 4.29Å; L82-V89 PolarHBondContact N-O 3.26Å; L82-V89 PolarHBondContact O-N 3.4Å
83	E	71	Confident	61.8	Low	94 Å²	94	80 Å²	80	44%	0.439	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	101.9	178.9	-80.2	-69.1	160.7	0	0	108.8	R81 S88 K103	R81-E83 HydrophobicContact CG-CG 4.28Å; E83-S88 WeakPolarHBondContact OE1-CB 3.02Å; E83-S88 PolarHBondContact OE1-OG 2.92Å; E83-S88 VanDerWaalsContact OE2-CB 3.31Å; E83-S88 WeakPolarHBondContact OE2-CB 3.5Å; E83-K103 IonicContact OE2-NZ 2.64Å; E83-K103 PolarHBondContact OE2-NZ 2.68Å
84	E	65.9	Low	62.6	Low	51 Å²	51	81.4 Å²	81.4	24%	0.238	43%	0.429	C	S	.	.			trans	-106.8	162.6	176.1	-66.8	-66.4	159.8	0	0	110.4	F38 L82 H86 F87 K103	F38-E84 WeakPolarHBondContact CE1-OE2 3.4Å; L82-E84 HydrophobicContact CD1-CG 4.11Å; L82-E84 HydrophobicContact CG-CG 4.13Å; E84-H86 PolarHBondContact O-N 3.45Å; E84-F87 CarbonylContact C-O 3.59Å; E84-F87 VanDerWaalsContact CA-O 3.27Å; E84-F87 WeakPolarHBondContact CA-O 3.45Å; E84-F87 HydrophobicContact CB-CD1 3.86Å; E84-F87 HydrophobicContact CB-CE1 3.72Å; E84-F87 HydrophobicContact CB-CG 4.37Å; E84-F87 HydrophobicContact CB-CZ 4.14Å; E84-F87 VanDerWaalsContact CB-O 3.26Å; E84-F87 WeakPolarHBondContact CB-O 3.21Å; E84-F87 HydrophobicContact CG-CD1 4.34Å; E84-F87 HydrophobicContact CG-CE1 3.72Å; E84-F87 HydrophobicContact CG-CE2 4.31Å; E84-F87 HydrophobicContact CG-CZ 3.7Å; E84-F87 PolarHBondContact N-O 3.49Å; E84-K103 PolarHBondContact O-NZ 2.72Å
85	P	59.1	Low	63.7	Low	96 Å²	96	85.3 Å²	85.3	62%	0.623	44%	0.435	S	S	*	.	S	Bend	trans	-57.8	-31.6	178.9	-27	35.3	0	0	0	113.9
86	H	61.9	Low	64.2	Low	90 Å²	90	92.3 Å²	92.3	42%	0.417	46%	0.457	S	S	.	.	S	Bend	trans	-113.8	-8.8	-172.2	-59.5	-54.7	0	0	0	114.1	E84 K103	E84-H86 PolarHBondContact O-N 3.45Å; H86-K103 PolarHBondContact O-N 3.19Å
87	F	60.9	Low	64.6	Low	47 Å²	47	84.9 Å²	84.9	21%	0.206	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	160.8	173.7	70.7	-80.9	0	0	0	110.6	F38 L82 E84 V89 S101 W102	F38-F87 HydrophobicContact CZ-CE1 4.35Å; L82-F87 HydrophobicContact CD2-CE2 3.65Å; L82-F87 HydrophobicContact CD2-CZ 3.99Å; L82-F87 HydrophobicContact CG-CE2 4.32Å; E84-F87 CarbonylContact C-O 3.59Å; E84-F87 VanDerWaalsContact CA-O 3.27Å; E84-F87 WeakPolarHBondContact CA-O 3.45Å; E84-F87 HydrophobicContact CB-CD1 3.86Å; E84-F87 HydrophobicContact CB-CE1 3.72Å; E84-F87 HydrophobicContact CB-CG 4.37Å; E84-F87 HydrophobicContact CB-CZ 4.14Å; E84-F87 VanDerWaalsContact CB-O 3.26Å; E84-F87 WeakPolarHBondContact CB-O 3.21Å; E84-F87 HydrophobicContact CG-CD1 4.34Å; E84-F87 HydrophobicContact CG-CE1 3.72Å; E84-F87 HydrophobicContact CG-CE2 4.31Å; E84-F87 HydrophobicContact CG-CZ 3.7Å; E84-F87 PolarHBondContact N-O 3.49Å; F87-V89 HydrophobicContact CD2-CG2 3.92Å; F87-V89 HydrophobicContact CE2-CG2 4.02Å; F87-S101 CarbonylContact C-O 3.51Å; F87-S101 WeakPolarHBondContact CA-O 3.18Å; F87-W102 HydrophobicContact CB-CD2 4.19Å; F87-W102 HydrophobicContact CB-CE3 3.83Å; F87-W102 HydrophobicContact CB-CZ3 4.22Å; F87-W102 HydrophobicContact CG-CZ3 4.47Å
88	S	69.2	Low	65	Low	7 Å²	7	80.5 Å²	80.5	5%	0.049	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154.3	165.9	59.2	0	0	0	0	110.3	L82 E83 A100 S101	L82-S88 CarbonylContact O-C 3.4Å; L82-S88 WeakPolarHBondContact O-CA 3.46Å; L82-S88 VanDerWaalsContact O-CB 3.28Å; L82-S88 WeakPolarHBondContact O-CB 3.32Å; E83-S88 WeakPolarHBondContact OE1-CB 3.02Å; E83-S88 PolarHBondContact OE1-OG 2.92Å; E83-S88 VanDerWaalsContact OE2-CB 3.31Å; E83-S88 WeakPolarHBondContact OE2-CB 3.5Å; S88-A100 CarbonylContact O-C 3.3Å; S88-A100 WeakPolarHBondContact O-CA 3.22Å; S88-S101 PolarHBondContact N-O 3.09Å; S88-S101 PolarHBondContact O-N 2.68Å
89	V	64.3	Low	65.2	Low	40 Å²	40	79 Å²	79	24%	0.242	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	123.8	175.2	-173.7	0	0	0	0	108.4	R81 L82 F87 T99 A100	R81-V89 WeakPolarHBondContact CA-O 3.49Å; L82-V89 HydrophobicContact CB-CB 4.29Å; L82-V89 PolarHBondContact N-O 3.26Å; L82-V89 PolarHBondContact O-N 3.4Å; F87-V89 HydrophobicContact CD2-CG2 3.92Å; F87-V89 HydrophobicContact CE2-CG2 4.02Å; V89-T99 CarbonylContact C-O 3.4Å; V89-T99 WeakPolarHBondContact CA-O 3.26Å; V89-A100 HydrophobicContact CG2-CB 4.13Å
90	V	71.6	Confident	65.2	Low	54 Å²	54	74.2 Å²	74.2	33%	0.327	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.6	178.4	-176.4	0	0	0	0	108.3	I80 R81 W98 T99	I80-V90 WeakPolarHBondContact O-CA 3.24Å; R81-V90 HydrophobicContact CG-CG2 4.08Å; V90-W98 CarbonylContact O-C 3.47Å; V90-W98 VanDerWaalsContact O-CA 3.25Å; V90-W98 WeakPolarHBondContact O-CA 3.24Å; V90-T99 PolarHBondContact N-O 3Å; V90-T99 PolarHBondContact O-N 3.41Å
91	L	64.2	Low	65.2	Low	26 Å²	26	72.7 Å²	72.7	14%	0.136	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	115.5	168.8	180	67.8	0	0	0	110.3	I80 R93 W98	I80-L91 HydrophobicContact CB-CB 3.9Å; I80-L91 HydrophobicContact CB-CD2 4.47Å; I80-L91 HydrophobicContact CD1-CD2 3.67Å; I80-L91 HydrophobicContact CG1-CB 4.44Å; I80-L91 HydrophobicContact CG1-CD2 4.11Å; I80-L91 PolarHBondContact O-N 3.22Å; L91-R93 HydrophobicContact CD2-CG 4.14Å; L91-R93 HydrophobicContact CG-CG 4.38Å; L91-R93 PolarHBondContact O-N 3.5Å; L91-W98 HydrophobicContact CD1-CB 4.19Å
92	N	69.3	Low	64.9	Low	67 Å²	67	67.8 Å²	67.8	36%	0.358	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	100.8	165.7	-173.4	-47.1	0	0	0	109.5	A94 K95 R96 H97	N92-A94 PolarHBondContact O-N 2.95Å; N92-A94 PolarHBondContact OD1-N 2.91Å; N92-K95 HydrophobicContact CB-CB 4.49Å; N92-K95 PolarHBondContact O-N 2.89Å; N92-K95 PolarHBondContact OD1-N 3.19Å; N92-R96 WeakPolarHBondContact O-CA 3.3Å; N92-R96 PolarHBondContact O-N 3.5Å; N92-H97 WeakPolarHBondContact CA-O 3.27Å; N92-H97 PolarHBondContact N-O 3.05Å; N92-H97 PolarHBondContact O-N 2.8Å; N92-H97 VanDerWaalsContact O-N 3.14Å
93	R	64.2	Low	64.7	Low	94 Å²	94	68.1 Å²	68.1	36%	0.355	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-42.3	-179.1	-77.5	-169.5	173.8	162	8.5	113.5	E77 A78 L91 K95 R96	E77-R93 PolarHBondContact O-NH2 3.25Å; A78-R93 VanDerWaalsContact O-CD 3.26Å; A78-R93 WeakPolarHBondContact O-CD 3.43Å; A78-R93 PolarHBondContact O-NE 3.2Å; A78-R93 VanDerWaalsContact O-NE 3.13Å; A78-R93 PolarHBondContact O-NH1 3.14Å; A78-R93 VanDerWaalsContact O-NH1 3.13Å; L91-R93 HydrophobicContact CD2-CG 4.14Å; L91-R93 HydrophobicContact CG-CG 4.38Å; L91-R93 PolarHBondContact O-N 3.5Å; R93-K95 PolarHBondContact O-N 2.89Å; R93-R96 PolarHBondContact O-N 3.04Å
94	A	71	Confident	64.1	Low	101 Å²	101	69.3 Å²	69.3	84%	0.835	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-36.4	-178.2	0	0	0	0	0	112.1	N92	N92-A94 PolarHBondContact O-N 2.95Å; N92-A94 PolarHBondContact OD1-N 2.91Å
95	K	70.7	Confident	63.5	Low	139 Å²	139	77.5 Å²	77.5	60%	0.604	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-8.9	177.3	-61.6	-176.4	-179.8	-178.6	0	113.3	N92 R93 H97	N92-K95 HydrophobicContact CB-CB 4.49Å; N92-K95 PolarHBondContact O-N 2.89Å; N92-K95 PolarHBondContact OD1-N 3.19Å; R93-K95 PolarHBondContact O-N 2.89Å; K95-H97 HydrophobicContact CB-CB 4.22Å; K95-H97 PolarHBondContact O-CD2 3.13Å; K95-H97 PolarHBondContact O-N 3.01Å; K95-H97 PolarHBondContact O-NE2 2.83Å
96	R	63	Low	63.1	Low	189 Å²	189	75.9 Å²	75.9	71%	0.713	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	36.8	-166.7	-60.8	-155.6	-70.2	-168.8	-5	113	N92 R93	N92-R96 WeakPolarHBondContact O-CA 3.3Å; N92-R96 PolarHBondContact O-N 3.5Å; R93-R96 PolarHBondContact O-N 3.04Å
97	H	60.7	Low	62.5	Low	62 Å²	62	78 Å²	78	29%	0.287	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	141.3	179.3	-64.9	174.9	0	0	0	109.1	N92 K95 G118 T119	N92-H97 WeakPolarHBondContact CA-O 3.27Å; N92-H97 PolarHBondContact N-O 3.05Å; N92-H97 PolarHBondContact O-N 2.8Å; N92-H97 VanDerWaalsContact O-N 3.14Å; K95-H97 HydrophobicContact CB-CB 4.22Å; K95-H97 PolarHBondContact O-CD2 3.13Å; K95-H97 PolarHBondContact O-N 3.01Å; K95-H97 PolarHBondContact O-NE2 2.83Å; H97-G118 WeakPolarHBondContact CA-O 3.28Å; H97-G118 WeakPolarHBondContact CB-O 3.06Å; H97-T119 WeakPolarHBondContact CE1-CG2 3.31Å; H97-T119 WeakPolarHBondContact NE2-CB 3.22Å; H97-T119 WeakPolarHBondContact NE2-CG2 3.46Å
98	W	63.6	Low	62	Low	52 Å²	52	83.8 Å²	83.8	20%	0.197	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	149.9	165.9	59.8	-82.1	0	0	0	108.7	V90 L91 A100 E116 G118 G120 P122	V90-W98 CarbonylContact O-C 3.47Å; V90-W98 VanDerWaalsContact O-CA 3.25Å; V90-W98 WeakPolarHBondContact O-CA 3.24Å; L91-W98 HydrophobicContact CD1-CB 4.19Å; W98-A100 HydrophobicContact CE3-CB 3.92Å; W98-A100 HydrophobicContact CZ3-CB 3.52Å; W98-E116 HydrophobicContact CH2-CB 4.41Å; W98-E116 HydrophobicContact CZ3-CB 4.46Å; W98-G118 PolarHBondContact N-O 2.84Å; W98-G118 PolarHBondContact O-N 3.19Å; W98-G120 PolarHBondContact NE1-O 3.12Å; W98-P122 HydrophobicContact CH2-CB 3.58Å; W98-P122 HydrophobicContact CH2-CG 3.75Å; W98-P122 HydrophobicContact CZ2-CB 3.24Å; W98-P122 HydrophobicContact CZ2-CG 3.25Å
99	T	63.4	Low	61	Low	26 Å²	26	87 Å²	87	16%	0.16	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	115.5	175.1	-57.3	0	0	0	0	106.7	V89 V90 E115 E116 R117	V89-T99 CarbonylContact C-O 3.4Å; V89-T99 WeakPolarHBondContact CA-O 3.26Å; V90-T99 PolarHBondContact N-O 3Å; V90-T99 PolarHBondContact O-N 3.41Å; T99-E115 HydrophobicContact CG2-CG 3.44Å; T99-E115 VanDerWaalsContact CG2-CG 3.44Å; T99-E116 WeakPolarHBondContact CA-O 3.39Å; T99-R117 HydrophobicContact CG2-CG 4.14Å
100	A	61.8	Low	60.1	Low	10 Å²	10	86.5 Å²	86.5	8%	0.083	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.4	168.3	0	0	0	0	0	109.2	S88 V89 W98 E116	S88-A100 CarbonylContact O-C 3.3Å; S88-A100 WeakPolarHBondContact O-CA 3.22Å; V89-A100 HydrophobicContact CG2-CB 4.13Å; W98-A100 HydrophobicContact CE3-CB 3.92Å; W98-A100 HydrophobicContact CZ3-CB 3.52Å; A100-E116 PolarHBondContact N-O 2.81Å; A100-E116 PolarHBondContact O-N 3.1Å
101	S	61.8	Low	58.9	Low	23 Å²	23	89.1 Å²	89.1	16%	0.161	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	116.1	178.6	-57.5	0	0	0	0	108.8	F87 S88 L114	F87-S101 CarbonylContact C-O 3.51Å; F87-S101 WeakPolarHBondContact CA-O 3.18Å; S88-S101 PolarHBondContact N-O 3.09Å; S88-S101 PolarHBondContact O-N 2.68Å; S101-L114 CarbonylContact C-O 3.5Å; S101-L114 VanDerWaalsContact CA-O 3.31Å; S101-L114 WeakPolarHBondContact CA-O 3.22Å
102	W	59.1	Low	58.1	Low	82 Å²	82	97.2 Å²	97.2	31%	0.311	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.2	176.4	-60.8	85.2	0	0	0	109.8	F87 W104 S113 L114	F87-W102 HydrophobicContact CB-CD2 4.19Å; F87-W102 HydrophobicContact CB-CE3 3.83Å; F87-W102 HydrophobicContact CB-CZ3 4.22Å; F87-W102 HydrophobicContact CG-CZ3 4.47Å; W102-W104 HydrophobicContact CB-CD2 4.41Å; W102-W104 VanDerWaalsContact CB-CE2 3.48Å; W102-W104 HydrophobicContact CB-CH2 4.39Å; W102-W104 HydrophobicContact CB-CZ2 3.48Å; W102-W104 VanDerWaalsContact CB-CZ2 3.48Å; W102-W104 HydrophobicContact CD2-CH2 4.17Å; W102-W104 AromaticContact CD2-CZ2 3.88Å; W102-W104 HydrophobicContact CD2-CZ2 3.88Å; W102-W104 AromaticContact CE3-CH2 3.71Å; W102-W104 HydrophobicContact CE3-CH2 3.71Å; W102-W104 AromaticContact CE3-CZ2 3.88Å; W102-W104 HydrophobicContact CE3-CZ2 3.88Å; W102-W104 HydrophobicContact CG-CH2 4.47Å; W102-W104 AromaticContact CG-CZ2 3.73Å; W102-W104 HydrophobicContact CG-CZ2 3.73Å; W102-W104 HydrophobicContact CZ3-CH2 4.38Å; W102-S113 VanDerWaalsContact O-CA 3.25Å; W102-S113 WeakPolarHBondContact O-CA 3.4Å; W102-L114 PolarHBondContact N-O 3.44Å; W102-L114 PolarHBondContact O-N 2.64Å
103	K	62	Low	56.9	Low	80 Å²	80	98.9 Å²	98.9	35%	0.348	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	94.6	-179.5	-59.3	174.1	-169.2	163.7	0	108.7	E83 E84 H86	E83-K103 IonicContact OE2-NZ 2.64Å; E83-K103 PolarHBondContact OE2-NZ 2.68Å; E84-K103 PolarHBondContact O-NZ 2.72Å; H86-K103 PolarHBondContact O-N 3.19Å
104	W	59.1	Low	55.8	Low	119 Å²	119	97.8 Å²	97.8	45%	0.451	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.2	176	-42.8	99.3	0	0	0	109	W102 S111 R112	W102-W104 HydrophobicContact CB-CD2 4.41Å; W102-W104 VanDerWaalsContact CB-CE2 3.48Å; W102-W104 HydrophobicContact CB-CH2 4.39Å; W102-W104 HydrophobicContact CB-CZ2 3.48Å; W102-W104 VanDerWaalsContact CB-CZ2 3.48Å; W102-W104 HydrophobicContact CD2-CH2 4.17Å; W102-W104 AromaticContact CD2-CZ2 3.88Å; W102-W104 HydrophobicContact CD2-CZ2 3.88Å; W102-W104 AromaticContact CE3-CH2 3.71Å; W102-W104 HydrophobicContact CE3-CH2 3.71Å; W102-W104 AromaticContact CE3-CZ2 3.88Å; W102-W104 HydrophobicContact CE3-CZ2 3.88Å; W102-W104 HydrophobicContact CG-CH2 4.47Å; W102-W104 AromaticContact CG-CZ2 3.73Å; W102-W104 HydrophobicContact CG-CZ2 3.73Å; W102-W104 HydrophobicContact CZ3-CH2 4.38Å; W104-S111 WeakPolarHBondContact O-CA 3.11Å; W104-R112 PolarHBondContact N-O 2.9Å; W104-R112 PolarHBondContact O-N 3.31Å; W104-R112 VanDerWaalsContact O-N 3.12Å
105	R	53.5	Low	54.8	Low	223 Å²	223	97.5 Å²	97.5	84%	0.842	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.5	157.8	-73.3	-176.3	-178	157.9	1.1	106.4
106	N	49.8	Very low	53.6	Low	62 Å²	62	94.2 Å²	94.2	33%	0.332	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-68.7	156.3	165.8	89	6.6	0	0	0	108.6	M108 G109 G110	N106-M108 PolarHBondContact O-N 3.44Å; N106-M108 VanDerWaalsContact O-N 3.16Å; N106-M108 WeakPolarHBondContact OD1-CA 3.3Å; N106-M108 WeakPolarHBondContact OD1-CB 3.44Å; N106-M108 PolarHBondContact OD1-N 2.7Å; N106-G109 PolarHBondContact O-N 2.8Å; N106-G109 PolarHBondContact OD1-N 3.09Å; N106-G110 PolarHBondContact N-O 2.93Å; N106-G110 PolarHBondContact OD1-N 3.47Å
107	S	50.1	Low	52.9	Low	134 Å²	134	94 Å²	94	94%	0.937	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-16.5	176.6	49.5	0	0	0	0	113.7
108	M	49.5	Very low	52.4	Low	170 Å²	170	91.2 Å²	91.2	84%	0.837	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	18.4	176	-69.5	-159.4	-78.4	0	0	114.1	N106 G110	N106-M108 PolarHBondContact O-N 3.44Å; N106-M108 VanDerWaalsContact O-N 3.16Å; N106-M108 WeakPolarHBondContact OD1-CA 3.3Å; N106-M108 WeakPolarHBondContact OD1-CB 3.44Å; N106-M108 PolarHBondContact OD1-N 2.7Å; M108-G110 VanDerWaalsContact C-N 3.29Å; M108-G110 PolarHBondContact O-N 2.92Å
109	G	48.8	Very low	51.6	Low	74 Å²	74	93.8 Å²	93.8	76%	0.763	49%	0.489	S	S	*	.	S	Bend	trans	76.3	4	175	0	0	0	0	0	116.2	N106	N106-G109 PolarHBondContact O-N 2.8Å; N106-G109 PolarHBondContact OD1-N 3.09Å
110	G	44	Very low	50.7	Low	29 Å²	29	95 Å²	95	30%	0.299	51%	0.506	S	S	.	.			trans	-86.1	128.4	173	0	0	0	0	0	112.1	N106 M108	N106-G110 PolarHBondContact N-O 2.93Å; N106-G110 PolarHBondContact OD1-N 3.47Å; M108-G110 VanDerWaalsContact C-N 3.29Å; M108-G110 PolarHBondContact O-N 2.92Å
111	S	47.1	Very low	49.6	Very low	109 Å²	109	98.6 Å²	98.6	76%	0.762	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.7	169.8	55.8	0	0	0	0	110.5	W104	W104-S111 WeakPolarHBondContact O-CA 3.11Å
112	R	47	Very low	48.3	Very low	196 Å²	196	100.1 Å²	100.1	74%	0.74	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.4	167.3	-71.5	-174.5	179.3	179.3	-0.5	109.2	W104	W104-R112 PolarHBondContact N-O 2.9Å; W104-R112 PolarHBondContact O-N 3.31Å; W104-R112 VanDerWaalsContact O-N 3.12Å
113	S	45.6	Very low	46.9	Very low	102 Å²	102	101.3 Å²	101.3	71%	0.713	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.7	130.2	175	56.3	0	0	0	0	110.4	W102	W102-S113 VanDerWaalsContact O-CA 3.25Å; W102-S113 WeakPolarHBondContact O-CA 3.4Å
114	L	39.5	Very low	45.8	Very low	72 Å²	72	101.3 Å²	101.3	38%	0.377	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	123.2	166	179	65.9	0	0	0	108	S101 W102 L127	S101-L114 CarbonylContact C-O 3.5Å; S101-L114 VanDerWaalsContact CA-O 3.31Å; S101-L114 WeakPolarHBondContact CA-O 3.22Å; W102-L114 PolarHBondContact N-O 3.44Å; W102-L114 PolarHBondContact O-N 2.64Å; L114-L127 HydrophobicContact CD2-CD2 4.35Å
115	E	50.2	Low	44.3	Very low	94 Å²	94	103.5 Å²	103.5	44%	0.439	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108	114.8	179.3	-171	176.8	135	0	0	109.7	T99 R117	T99-E115 HydrophobicContact CG2-CG 3.44Å; T99-E115 VanDerWaalsContact CG2-CG 3.44Å; E115-R117 HydrophobicContact CG-CG 4.46Å; E115-R117 IonicContact OE1-CZ 3.08Å; E115-R117 IonicContact OE1-NE 2.65Å; E115-R117 PolarHBondContact OE1-NE 3.07Å; E115-R117 IonicContact OE1-NH2 2.69Å; E115-R117 PolarHBondContact OE1-NH2 2.81Å
116	E	45	Very low	43	Very low	70 Å²	70	101.7 Å²	101.7	33%	0.327	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.2	122	175.2	-70.9	-67.6	148.9	0	0	108.4	W98 T99 A100	W98-E116 HydrophobicContact CH2-CB 4.41Å; W98-E116 HydrophobicContact CZ3-CB 4.46Å; T99-E116 WeakPolarHBondContact CA-O 3.39Å; A100-E116 PolarHBondContact N-O 2.81Å; A100-E116 PolarHBondContact O-N 3.1Å
117	R	50.4	Low	42.1	Very low	184 Å²	184	104.1 Å²	104.1	69%	0.694	59%	0.591	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.6	117.9	174.5	-68.1	-174.2	-179.2	-172.3	3.1	109.3	T99 E115	T99-R117 HydrophobicContact CG2-CG 4.14Å; E115-R117 HydrophobicContact CG-CG 4.46Å; E115-R117 IonicContact OE1-CZ 3.08Å; E115-R117 IonicContact OE1-NE 2.65Å; E115-R117 PolarHBondContact OE1-NE 3.07Å; E115-R117 IonicContact OE1-NH2 2.69Å; E115-R117 PolarHBondContact OE1-NH2 2.81Å
118	G	49.2	Very low	41.2	Very low	5 Å²	5	106.5 Å²	106.5	5%	0.052	59%	0.587	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.1	138.5	176.5	0	0	0	0	0	112.2	H97 W98	H97-G118 WeakPolarHBondContact CA-O 3.28Å; H97-G118 WeakPolarHBondContact CB-O 3.06Å; W98-G118 PolarHBondContact N-O 2.84Å; W98-G118 PolarHBondContact O-N 3.19Å
119	T	46.7	Very low	40.3	Very low	106 Å²	106	102 Å²	102	65%	0.65	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.2	121.1	158.8	76.4	0	0	0	0	106.6	H97	H97-T119 WeakPolarHBondContact CE1-CG2 3.31Å; H97-T119 WeakPolarHBondContact NE2-CB 3.22Å; H97-T119 WeakPolarHBondContact NE2-CG2 3.46Å
120	G	45.5	Very low	39.4	Very low	50 Å²	50	104.6 Å²	104.6	52%	0.515	57%	0.574	S	S	.	*	S	Bend	trans	67.4	-153.3	-168.7	0	0	0	0	0	113.7	W98	W98-G120 PolarHBondContact NE1-O 3.12Å
121	V	38	Very low	38.9	Very low	86 Å²	86	114.9 Å²	114.9	52%	0.521	62%	0.62	S	S	.	*	S	Bend	trans	-68.5	136.7	-171.7	-172.2	0	0	0	0	111	V55	V55-V121 WeakPolarHBondContact O-CG2 3.34Å
122	P	33.5	Very low	38.5	Very low	55 Å²	55	115.2 Å²	115.2	36%	0.357	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-52.5	132	176.2	-7.5	4.1	0	0	0	113.2	W98 S124	W98-P122 HydrophobicContact CH2-CB 3.58Å; W98-P122 HydrophobicContact CH2-CG 3.75Å; W98-P122 HydrophobicContact CZ2-CB 3.24Å; W98-P122 HydrophobicContact CZ2-CG 3.25Å; P122-S124 PolarHBondContact O-N 3.46Å
123	P	29.8	Very low	38.1	Very low	108 Å²	108	110.9 Å²	110.9	70%	0.701	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-63	138	172.5	2.4	3.7	0	0	0	110.9	E125	P123-E125 VanDerWaalsContact C-N 3.29Å; P123-E125 PolarHBondContact O-N 2.91Å
124	S	39.6	Very low	37.7	Very low	79 Å²	79	111.4 Å²	111.4	55%	0.552	60%	0.6	S	S	*	*			trans	-84.5	13.4	-170	-84.5	0	0	0	0	115	K50 P122	K50-S124 WeakPolarHBondContact CE-OG 3.09Å; P122-S124 PolarHBondContact O-N 3.46Å
125	E	27.4	Very low	37.6	Very low	165 Å²	165	113.7 Å²	113.7	77%	0.771	61%	0.613	S	S	*	*	S	Bend	trans	-118.8	123.2	-168.3	-133.7	178.2	146	0	0	112	P123	P123-E125 VanDerWaalsContact C-N 3.29Å; P123-E125 PolarHBondContact O-N 2.91Å
126	K	26.7	Very low	36.8	Very low	186 Å²	186	114.9 Å²	114.9	81%	0.809	62%	0.624	S	S	*	*			trans	73	66.3	171.8	-54.3	-158.3	-178.5	-167.3	0	118.1
127	L	31.2	Very low	36.2	Very low	112 Å²	112	117.9 Å²	117.9	59%	0.586	64%	0.643	S	S	*	*			trans	-129	74.2	155.2	-68.2	173	0	0	0	109.8	L114	L114-L127 HydrophobicContact CD2-CD2 4.35Å
128	Q	29.9	Very low	35.2	Very low	184 Å²	184	113.2 Å²	113.2	86%	0.86	64%	0.64	S	S	*	*			trans	-90.7	115.1	153.5	-82.8	-179.5	-14.3	0	0	106.4
129	P	31	Very low	34.1	Very low	77 Å²	77	121.5 Å²	121.5	50%	0.5	69%	0.685	S	S	.	*			trans	-59	135.5	166.1	24.4	-29.4	0	0	0	107.8	I131	P129-I131 PolarHBondContact O-N 2.99Å
130	P	29.7	Very low	33.1	Very low	128 Å²	128	122.8 Å²	122.8	83%	0.831	69%	0.688	S	S	*	*			trans	-60.7	141.6	174.9	17.9	-18	0	0	0	109.1
131	I	34.7	Very low	32	Very low	244 Å²	244	129.5 Å²	129.5	100%	1.251	70%	0.704	S	S	*	*			trans	-44.5	0	-171.5	-59.8	165.2	0	0	0	112.4	P129	P129-I131 PolarHBondContact O-N 2.99Å

Retrieved 131 of 131 residues in 806.4 ms (Link to these results)

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