A0A077YWA5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YWA5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 119 aa.

						>A0A077YWA5_TRITR|A0A077YWA5
MIFVSTFVAIAIIFSNDTNPSQACYNLSHIVYGSVIASIAVLLLRLAGGNCCCTIVAADPAGTICISRMRCAFATTRCTDFGWCTRWPIFVAQQVCGGILPIDIYQRRYEQYKHRQVAQ
					

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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	28.3	Very low	29.8	Very low	207 Å²	207	98.4 Å²	98.4	100%	1.02	56%	0.556	S	S	*	*				0	108.3	0	-164.3	171.2	166.3	0	0	106.9	F3	M1-F3 HydrophobicContact CE-CE1 4.18Å; M1-F3 HydrophobicContact CE-CZ 4.39Å; M1-F3 PolarHBondContact O-N 3.42Å; M1-F3 HydrophobicContact SD-CZ 4.39Å
2	I	23	Very low	30.2	Very low	158 Å²	158	92.9 Å²	92.9	81%	0.81	52%	0.524	S	S	*	.			trans	-78	115.5	-179.2	-62.9	170.9	0	0	0	106.8	V4	I2-V4 HydrophobicContact CG2-CG2 4.22Å; I2-V4 PolarHBondContact O-N 2.73Å
3	F	26.7	Very low	30.1	Very low	115 Å²	115	96.9 Å²	96.9	50%	0.504	54%	0.541	S	S	.	.			trans	-86.8	103.8	175.5	-79.6	-62	0	0	0	108.7	M1 I36	M1-F3 HydrophobicContact CE-CE1 4.18Å; M1-F3 HydrophobicContact CE-CZ 4.39Å; M1-F3 PolarHBondContact O-N 3.42Å; M1-F3 HydrophobicContact SD-CZ 4.39Å; F3-I36 HydrophobicContact CB-CD1 4.24Å; F3-I36 HydrophobicContact CD1-CD1 3.08Å; F3-I36 HydrophobicContact CD1-CG1 3.95Å; F3-I36 HydrophobicContact CE1-CD1 3.58Å; F3-I36 HydrophobicContact CE1-CG1 4.07Å; F3-I36 HydrophobicContact CG-CD1 4.01Å
4	V	25.5	Very low	30.4	Very low	104 Å²	104	92.6 Å²	92.6	63%	0.63	51%	0.514	S	S	*	.			trans	-84	109.4	170.5	-178.4	0	0	0	0	107.2	I2	I2-V4 HydrophobicContact CG2-CG2 4.22Å; I2-V4 PolarHBondContact O-N 2.73Å
5	S	31.7	Very low	30.2	Very low	58 Å²	58	93.6 Å²	93.6	41%	0.406	53%	0.529	S	S	.	.			trans	-90.1	107.6	176	-55	0	0	0	0	109
6	T	31	Very low	30.3	Very low	76 Å²	76	95.9 Å²	95.9	47%	0.466	54%	0.54	S	S	.	.			trans	-87.4	110.6	174.5	-9	0	0	0	0	109.2	V8	T6-V8 PolarHBondContact O-N 3.21Å
7	F	32.7	Very low	30.4	Very low	116 Å²	116	97.8 Å²	97.8	51%	0.509	55%	0.548	S	S	.	.			trans	-81.8	112.5	177.1	-59.3	-84.7	0	0	0	110	I39	F7-I39 HydrophobicContact CD1-CD1 3.92Å; F7-I39 HydrophobicContact CE1-CD1 3.89Å
8	V	31	Very low	30.7	Very low	58 Å²	58	99.4 Å²	99.4	35%	0.352	56%	0.561	S	S	.	*			trans	-100.3	106.4	172.3	-179.6	0	0	0	0	108.7	T6 I10 I30	T6-V8 PolarHBondContact O-N 3.21Å; V8-I10 HydrophobicContact CG1-CG1 4.16Å; V8-I10 PolarHBondContact O-N 3.48Å; V8-I30 HydrophobicContact CB-CD1 3.8Å; V8-I30 HydrophobicContact CG1-CD1 3.79Å; V8-I30 HydrophobicContact CG2-CD1 4.35Å; V8-I30 HydrophobicContact CG2-CG2 4.29Å
9	A	33.7	Very low	30.9	Very low	78 Å²	78	99.9 Å²	99.9	65%	0.645	56%	0.562	S	S	*	*			trans	-81.2	106.6	173.3	0	0	0	0	0	110
10	I	33.2	Very low	31.2	Very low	48 Å²	48	96.8 Å²	96.8	25%	0.246	55%	0.546	C	S	.	.			trans	-90.1	107.7	171.8	-60.1	175.8	0	0	0	108.9	V8 I12 L27 I30 V41	V8-I10 HydrophobicContact CG1-CG1 4.16Å; V8-I10 PolarHBondContact O-N 3.48Å; I10-I12 HydrophobicContact CG2-CG1 3.95Å; I10-I12 PolarHBondContact O-N 3.18Å; I10-L27 HydrophobicContact CD1-CD2 3.86Å; I10-I30 HydrophobicContact CD1-CD1 3.72Å; I10-I30 HydrophobicContact CD1-CG1 3.93Å; I10-I30 HydrophobicContact CG1-CD1 4.35Å; I10-V41 CarbonylContact O-C 3.54Å
11	A	31.3	Very low	31.4	Very low	64 Å²	64	95 Å²	95	53%	0.529	54%	0.54	S	S	.	.			trans	-81.7	107.3	170.8	0	0	0	0	0	110.4	L43	A11-L43 HydrophobicContact CB-CD1 4.22Å
12	I	33.9	Very low	31.8	Very low	33 Å²	33	93 Å²	93	17%	0.169	53%	0.528	C	S	.	.			trans	-92.3	113.8	170.8	-56.1	180	0	0	0	108	I10 F14 Y25 L27 L42 L43	I10-I12 HydrophobicContact CG2-CG1 3.95Å; I10-I12 PolarHBondContact O-N 3.18Å; I12-F14 HydrophobicContact CG2-CE2 4.34Å; I12-Y25 HydrophobicContact CG2-CD1 4.32Å; I12-Y25 HydrophobicContact CG2-CE1 4.41Å; I12-L27 HydrophobicContact CD1-CD2 4.44Å; I12-L42 HydrophobicContact CB-CD2 3.91Å; I12-L42 HydrophobicContact CB-CG 4.28Å; I12-L42 HydrophobicContact CD1-CD1 4.11Å; I12-L42 HydrophobicContact CD1-CD2 4.12Å; I12-L42 HydrophobicContact CD1-CG 4.01Å; I12-L42 HydrophobicContact CG1-CD2 4.44Å; I12-L42 HydrophobicContact CG1-CG 4.38Å; I12-L42 HydrophobicContact CG2-CD2 4.34Å; I12-L43 VanDerWaalsContact O-O 3.1Å
13	I	29.8	Very low	32.5	Very low	145 Å²	145	86.5 Å²	86.5	74%	0.744	50%	0.499	S	S	*	.			trans	-92.1	118.7	177.8	-58	175.6	0	0	0	108.6	S15	I13-S15 PolarHBondContact O-N 3.18Å
14	F	34.1	Very low	33.1	Very low	37 Å²	37	84.8 Å²	84.8	16%	0.162	50%	0.5	C	S	.	.			trans	-81.4	104.9	176.7	-64.6	-104.2	0	0	0	109.9	I12 N16 Y25 L42 L44 I66	I12-F14 HydrophobicContact CG2-CE2 4.34Å; F14-N16 PolarHBondContact O-N 3.42Å; F14-N16 VanDerWaalsContact O-N 3.15Å; F14-Y25 HydrophobicContact CD1-CE2 4.2Å; F14-Y25 AromaticContact CD1-CZ 3.69Å; F14-Y25 WeakPolarHBondContact CD1-OH 3.34Å; F14-Y25 HydrophobicContact CE1-CD2 4.28Å; F14-Y25 HydrophobicContact CE1-CE1 4.17Å; F14-Y25 AromaticContact CE1-CE2 3.24Å; F14-Y25 HydrophobicContact CE1-CE2 3.24Å; F14-Y25 AromaticContact CE1-CZ 3.17Å; F14-Y25 WeakPolarHBondContact CE1-OH 3.35Å; F14-Y25 HydrophobicContact CZ-CD2 4.44Å; F14-Y25 AromaticContact CZ-CE2 3.77Å; F14-Y25 HydrophobicContact CZ-CE2 3.77Å; F14-Y25 AromaticContact CZ-CZ 3.95Å; F14-L42 HydrophobicContact CE2-CD2 3.32Å; F14-L42 HydrophobicContact CZ-CD2 3.24Å; F14-L44 HydrophobicContact CD1-CD2 3.87Å; F14-L44 HydrophobicContact CD2-CB 4.4Å; F14-L44 HydrophobicContact CD2-CD2 3.7Å; F14-L44 HydrophobicContact CD2-CG 3.9Å; F14-L44 HydrophobicContact CE1-CD2 3.55Å; F14-L44 HydrophobicContact CE1-CG 4.36Å; F14-L44 HydrophobicContact CE2-CB 4.27Å; F14-L44 HydrophobicContact CE2-CD1 4.5Å; F14-L44 HydrophobicContact CE2-CD2 3.44Å; F14-L44 VanDerWaalsContact CE2-CD2 3.44Å; F14-L44 HydrophobicContact CE2-CG 3.4Å; F14-L44 HydrophobicContact CG-CD2 3.93Å; F14-L44 HydrophobicContact CZ-CD1 4.49Å; F14-L44 HydrophobicContact CZ-CD2 3.38Å; F14-L44 HydrophobicContact CZ-CG 3.69Å; F14-I66 HydrophobicContact CZ-CD1 4.11Å
15	S	27.2	Very low	33.9	Very low	107 Å²	107	82.9 Å²	82.9	75%	0.748	48%	0.482	S	S	*	.			trans	-75.8	95.5	171.8	159.6	0	0	0	0	109.8	I13 D17	I13-S15 PolarHBondContact O-N 3.18Å; S15-D17 VanDerWaalsContact C-N 3.3Å; S15-D17 PolarHBondContact O-N 2.99Å
16	N	32.2	Very low	34.2	Very low	131 Å²	131	85.5 Å²	85.5	70%	0.701	49%	0.491	S	S	*	.			trans	47.7	35.1	149.7	-121.8	14.9	0	0	0	118.5	F14 T18	F14-N16 PolarHBondContact O-N 3.42Å; F14-N16 VanDerWaalsContact O-N 3.15Å; N16-T18 PolarHBondContact O-N 3.45Å
17	D	31.9	Very low	34.7	Very low	127 Å²	127	83 Å²	83	68%	0.679	47%	0.474	S	S	*	.			trans	-82.6	112.8	174.3	-139	-31.1	0	0	0	109.7	S15 N19	S15-D17 VanDerWaalsContact C-N 3.3Å; S15-D17 PolarHBondContact O-N 2.99Å; D17-N19 PolarHBondContact O-N 3.42Å; D17-N19 VanDerWaalsContact O-N 3.09Å
18	T	35.1	Very low	34.6	Very low	127 Å²	127	81.7 Å²	81.7	78%	0.779	48%	0.48	S	S	*	.	S	Bend	trans	-70.1	-1.1	-175.8	42.5	0	0	0	0	113.2	N16	N16-T18 PolarHBondContact O-N 3.45Å
19	N	34.8	Very low	34.4	Very low	110 Å²	110	87 Å²	87	59%	0.588	50%	0.501	S	S	*	.			trans	-130.2	77.8	176.8	-119	-19	0	0	0	113.6	D17 S21	D17-N19 PolarHBondContact O-N 3.42Å; D17-N19 VanDerWaalsContact O-N 3.09Å; N19-S21 PolarHBondContact O-N 3.41Å
20	P	37	Very low	34.1	Very low	36 Å²	36	85.1 Å²	85.1	23%	0.234	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	15.2	174.6	-7.1	21.7	0	0	0	115.2	Q22 R68	P20-Q22 PolarHBondContact O-N 3.44Å; P20-R68 HydrophobicContact CB-CG 3.86Å; P20-R68 VanDerWaalsContact CD-NE 3.29Å; P20-R68 HydrophobicContact CG-CG 4.47Å; P20-R68 VanDerWaalsContact CG-NH2 3.28Å
21	S	34.7	Very low	33.8	Very low	61 Å²	61	88.5 Å²	88.5	43%	0.427	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-35.9	-172.5	46.5	0	0	0	0	111.9	N19 S67	N19-S21 PolarHBondContact O-N 3.41Å; S21-S67 PolarHBondContact O-OG 3.48Å; S21-S67 VanDerWaalsContact O-OG 3.04Å
22	Q	37.7	Very low	33.4	Very low	163 Å²	163	96.7 Å²	96.7	76%	0.762	52%	0.521	S	S	*	.			trans	-154.2	109.8	173.8	-66.1	178.9	-15.9	0	0	109.2	P20	P20-Q22 PolarHBondContact O-N 3.44Å
23	A	37.7	Very low	32.9	Very low	23 Å²	23	97.8 Å²	97.8	19%	0.19	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	114.9	169.8	0	0	0	0	0	109	Y25 C65 I66	A23-Y25 HydrophobicContact CB-CD2 4.44Å; A23-Y25 HydrophobicContact CB-CE2 3.39Å; A23-Y25 WeakPolarHBondContact CB-OH 3.25Å; A23-C65 WeakPolarHBondContact O-CA 3.1Å; A23-I66 PolarHBondContact N-O 3.04Å; A23-I66 VanDerWaalsContact N-O 3.11Å; A23-I66 PolarHBondContact O-N 3.4Å
24	C	38.9	Very low	32.6	Very low	78 Å²	78	96.5 Å²	96.5	53%	0.527	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123	177.2	-67.4	0	0	0	0	109.4	T63 I64 C65	C24-T63 HydrophobicContact CB-CG2 4.12Å; C24-I64 CarbonylContact C-O 3.23Å; C24-I64 WeakPolarHBondContact CA-O 3.36Å; C24-C65 HydrophobicContact CB-CB 4.22Å; C24-C65 WeakPolarHBondContact CB-SG 3.36Å; C24-C65 WeakPolarHBondContact SG-CB 2.96Å; C24-C65 CovalentContact SG-SG 2.06Å; C24-C65 PolarHBondContact SG-SG 3.48Å
25	Y	43.1	Very low	32.3	Very low	65 Å²	65	97.2 Å²	97.2	26%	0.255	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.2	128.2	-179.3	-61.6	-85.5	0	0	0	109.4	I12 F14 A23 T63 I64	I12-Y25 HydrophobicContact CG2-CD1 4.32Å; I12-Y25 HydrophobicContact CG2-CE1 4.41Å; F14-Y25 HydrophobicContact CD1-CE2 4.2Å; F14-Y25 AromaticContact CD1-CZ 3.69Å; F14-Y25 WeakPolarHBondContact CD1-OH 3.34Å; F14-Y25 HydrophobicContact CE1-CD2 4.28Å; F14-Y25 HydrophobicContact CE1-CE1 4.17Å; F14-Y25 AromaticContact CE1-CE2 3.24Å; F14-Y25 HydrophobicContact CE1-CE2 3.24Å; F14-Y25 AromaticContact CE1-CZ 3.17Å; F14-Y25 WeakPolarHBondContact CE1-OH 3.35Å; F14-Y25 HydrophobicContact CZ-CD2 4.44Å; F14-Y25 AromaticContact CZ-CE2 3.77Å; F14-Y25 HydrophobicContact CZ-CE2 3.77Å; F14-Y25 AromaticContact CZ-CZ 3.95Å; A23-Y25 HydrophobicContact CB-CD2 4.44Å; A23-Y25 HydrophobicContact CB-CE2 3.39Å; A23-Y25 WeakPolarHBondContact CB-OH 3.25Å; Y25-T63 CarbonylContact O-C 3.22Å; Y25-T63 WeakPolarHBondContact O-CA 3.4Å; Y25-I64 PolarHBondContact N-O 3.32Å; Y25-I64 PolarHBondContact O-N 3.43Å
26	N	37.5	Very low	32.4	Very low	113 Å²	113	94.3 Å²	94.3	60%	0.604	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	114.6	172.9	-165.6	-7.4	0	0	0	108.5	S28	N26-S28 VanDerWaalsContact C-N 3.31Å; N26-S28 PolarHBondContact O-N 2.63Å; N26-S28 VanDerWaalsContact O-N 3.09Å
27	L	41.2	Very low	32.4	Very low	22 Å²	22	88.9 Å²	88.9	12%	0.115	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	86.5	170.3	-77.9	163.3	0	0	0	107.9	I10 I12 A40 A58 G62 I64	I10-L27 HydrophobicContact CD1-CD2 3.86Å; I12-L27 HydrophobicContact CD1-CD2 4.44Å; L27-A40 HydrophobicContact CD1-CB 3.98Å; L27-A40 HydrophobicContact CD2-CB 4.3Å; L27-A58 HydrophobicContact CD1-CB 4.21Å; L27-G62 PolarHBondContact N-O 3.45Å; L27-G62 VanDerWaalsContact N-O 3.14Å; L27-I64 HydrophobicContact CD1-CD1 3.34Å; L27-I64 HydrophobicContact CD1-CG1 4.01Å; L27-I64 HydrophobicContact CG-CD1 4.24Å
28	S	31.3	Very low	32.5	Very low	89 Å²	89	83.2 Å²	83.2	62%	0.622	47%	0.471	S	S	*	.			trans	-107.8	61	178.8	64.9	0	0	0	0	111.3	N26	N26-S28 VanDerWaalsContact C-N 3.31Å; N26-S28 PolarHBondContact O-N 2.63Å; N26-S28 VanDerWaalsContact O-N 3.09Å
29	H	26.9	Very low	32.5	Very low	170 Å²	170	78.9 Å²	78.9	79%	0.787	44%	0.442	S	S	*	.			trans	174.2	110.7	156	-118.2	-127.3	0	0	0	111.4
30	I	27.5	Very low	32.8	Very low	39 Å²	39	73.9 Å²	73.9	20%	0.2	42%	0.416	C	S	.	.			trans	-146.2	106.1	139.9	-56.6	-176	0	0	0	109.8	V8 I10	V8-I30 HydrophobicContact CB-CD1 3.8Å; V8-I30 HydrophobicContact CG1-CD1 3.79Å; V8-I30 HydrophobicContact CG2-CD1 4.35Å; V8-I30 HydrophobicContact CG2-CG2 4.29Å; I10-I30 HydrophobicContact CD1-CD1 3.72Å; I10-I30 HydrophobicContact CD1-CG1 3.93Å; I10-I30 HydrophobicContact CG1-CD1 4.35Å
31	V	25.2	Very low	32.7	Very low	118 Å²	118	74 Å²	74	72%	0.715	42%	0.416	S	S	*	.			trans	27.3	118.5	146	-162.5	0	0	0	0	119.8
32	Y	23.4	Very low	33	Very low	237 Å²	237	71.1 Å²	71.1	93%	0.929	40%	0.396	S	S	*	.	S	Bend	trans	-52.5	134	163.7	-80.7	-99.3	0	0	0	112.9
33	G	24.2	Very low	32.9	Very low	55 Å²	55	67.1 Å²	67.1	57%	0.567	38%	0.379	S	S	*	.	S	Bend	trans	115.1	97.3	168.8	0	0	0	0	0	113.2	V35	G33-V35 PolarHBondContact O-N 3.04Å
34	S	23.8	Very low	32.9	Very low	119 Å²	119	67.4 Å²	67.4	83%	0.832	38%	0.378	S	S	*	.			trans	40.9	71.2	162.5	61	0	0	0	0	116.2
35	V	27.3	Very low	32.6	Very low	51 Å²	51	72 Å²	72	31%	0.309	38%	0.384	S	S	.	.			trans	-130.5	126.5	165.4	-173	0	0	0	0	109.8	G33	G33-V35 PolarHBondContact O-N 3.04Å
36	I	29	Very low	32.1	Very low	46 Å²	46	72.7 Å²	72.7	24%	0.236	39%	0.392	C	S	.	.			trans	-88.4	119.7	171.5	-64.8	108.3	0	0	0	107.2	F3	F3-I36 HydrophobicContact CB-CD1 4.24Å; F3-I36 HydrophobicContact CD1-CD1 3.08Å; F3-I36 HydrophobicContact CD1-CG1 3.95Å; F3-I36 HydrophobicContact CE1-CD1 3.58Å; F3-I36 HydrophobicContact CE1-CG1 4.07Å; F3-I36 HydrophobicContact CG-CD1 4.01Å
37	A	31.4	Very low	31.9	Very low	18 Å²	18	71.6 Å²	71.6	15%	0.149	40%	0.398	C	S	.	.			trans	56.2	95.4	170.2	0	0	0	0	0	116	Y109	A37-Y109 HydrophobicContact CB-CE1 4.46Å; A37-Y109 HydrophobicContact CB-CE2 4Å; A37-Y109 VanDerWaalsContact CB-OH 3.27Å; A37-Y109 WeakPolarHBondContact CB-OH 3.34Å
38	S	34.2	Very low	31.4	Very low	8 Å²	8	74.5 Å²	74.5	6%	0.056	43%	0.434	C	S	.	.			trans	-67.9	132.3	162.3	-52.9	0	0	0	0	110.4	A58	S38-A58 CarbonylContact C-O 3.57Å; S38-A58 CarbonylContact O-C 3.42Å; S38-A58 PolarHBondContact O-N 2.76Å
39	I	36.4	Very low	31.3	Very low	36 Å²	36	73 Å²	73	19%	0.185	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	109.3	171.7	-59.9	-179.9	0	0	0	107.8	F7 V41 I55 A57	F7-I39 HydrophobicContact CD1-CD1 3.92Å; F7-I39 HydrophobicContact CE1-CD1 3.89Å; I39-V41 HydrophobicContact CG2-CG2 4.31Å; I39-V41 PolarHBondContact O-N 2.9Å; I39-I55 HydrophobicContact CG2-CG2 3.83Å; I39-A57 HydrophobicContact CG1-CB 4.18Å; I39-A57 HydrophobicContact CG2-CB 4.21Å
40	A	39.5	Very low	31.6	Very low	4 Å²	4	70 Å²	70	3%	0.033	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.2	174.2	0	0	0	0	0	110.2	L27 L42 V56	L27-A40 HydrophobicContact CD1-CB 3.98Å; L27-A40 HydrophobicContact CD2-CB 4.3Å; A40-L42 PolarHBondContact O-N 3.46Å; A40-V56 CarbonylContact C-O 3.57Å; A40-V56 WeakPolarHBondContact CA-O 3.29Å; A40-V56 WeakPolarHBondContact CB-O 3.42Å; A40-V56 PolarHBondContact N-O 3.22Å; A40-V56 CarbonylContact O-C 3.37Å; A40-V56 VanDerWaalsContact O-C 3.23Å; A40-V56 WeakPolarHBondContact O-CA 3.24Å; A40-V56 PolarHBondContact O-N 2.94Å
41	V	36.2	Very low	32	Very low	40 Å²	40	71.1 Å²	71.1	24%	0.242	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	97.9	176.8	176.4	0	0	0	0	109.2	I10 I39 I55	I10-V41 CarbonylContact O-C 3.54Å; I39-V41 HydrophobicContact CG2-CG2 4.31Å; I39-V41 PolarHBondContact O-N 2.9Å; V41-I55 HydrophobicContact CG1-CG1 3.93Å; V41-I55 HydrophobicContact CG2-CG1 4.27Å; V41-I55 HydrophobicContact CG2-CG2 4.15Å
42	L	41.2	Very low	32.4	Very low	0 Å²	0	67 Å²	67	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	117.1	-177.6	-110.2	138.1	0	0	0	111.2	I12 F14 A40 T54 V56 I64 I66	I12-L42 HydrophobicContact CB-CD2 3.91Å; I12-L42 HydrophobicContact CB-CG 4.28Å; I12-L42 HydrophobicContact CD1-CD1 4.11Å; I12-L42 HydrophobicContact CD1-CD2 4.12Å; I12-L42 HydrophobicContact CD1-CG 4.01Å; I12-L42 HydrophobicContact CG1-CD2 4.44Å; I12-L42 HydrophobicContact CG1-CG 4.38Å; I12-L42 HydrophobicContact CG2-CD2 4.34Å; F14-L42 HydrophobicContact CE2-CD2 3.32Å; F14-L42 HydrophobicContact CZ-CD2 3.24Å; A40-L42 PolarHBondContact O-N 3.46Å; L42-T54 CarbonylContact C-O 3.49Å; L42-T54 WeakPolarHBondContact CA-O 3.45Å; L42-T54 WeakPolarHBondContact CB-O 3.41Å; L42-T54 PolarHBondContact N-O 2.96Å; L42-T54 VanDerWaalsContact N-O 3.08Å; L42-T54 CarbonylContact O-C 3.55Å; L42-T54 PolarHBondContact O-N 3.05Å; L42-V56 HydrophobicContact CB-CG2 4.48Å; L42-V56 HydrophobicContact CD1-CB 4.43Å; L42-V56 HydrophobicContact CD1-CG2 4.21Å; L42-I64 HydrophobicContact CD1-CD1 3.82Å; L42-I64 HydrophobicContact CD1-CG2 4.35Å; L42-I66 HydrophobicContact CD1-CD1 4.32Å; L42-I66 HydrophobicContact CD2-CD1 3.89Å
43	L	35.6	Very low	33.1	Very low	78 Å²	78	57.1 Å²	57.1	41%	0.408	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	96.7	176.8	-71.9	163.1	0	0	0	109.3	A11 I12 R45 C53	A11-L43 HydrophobicContact CB-CD1 4.22Å; I12-L43 VanDerWaalsContact O-O 3.1Å; L43-R45 PolarHBondContact O-N 3.34Å; L43-C53 HydrophobicContact CD2-CB 3.74Å; L43-C53 VanDerWaalsContact CD2-SG 3.56Å
44	L	36.7	Very low	33.7	Very low	30 Å²	30	55.2 Å²	55.2	16%	0.157	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	112.9	174.5	-81	140.6	0	0	0	110.1	F14 C52 I66	F14-L44 HydrophobicContact CD1-CD2 3.87Å; F14-L44 HydrophobicContact CD2-CB 4.4Å; F14-L44 HydrophobicContact CD2-CD2 3.7Å; F14-L44 HydrophobicContact CD2-CG 3.9Å; F14-L44 HydrophobicContact CE1-CD2 3.55Å; F14-L44 HydrophobicContact CE1-CG 4.36Å; F14-L44 HydrophobicContact CE2-CB 4.27Å; F14-L44 HydrophobicContact CE2-CD1 4.5Å; F14-L44 HydrophobicContact CE2-CD2 3.44Å; F14-L44 VanDerWaalsContact CE2-CD2 3.44Å; F14-L44 HydrophobicContact CE2-CG 3.4Å; F14-L44 HydrophobicContact CG-CD2 3.93Å; F14-L44 HydrophobicContact CZ-CD1 4.49Å; F14-L44 HydrophobicContact CZ-CD2 3.38Å; F14-L44 HydrophobicContact CZ-CG 3.69Å; L44-C52 VanDerWaalsContact CB-O 3.27Å; L44-C52 WeakPolarHBondContact CB-O 3.46Å; L44-C52 PolarHBondContact N-O 3.22Å; L44-C52 CarbonylContact O-C 3.43Å; L44-C52 PolarHBondContact O-N 3.46Å; L44-I66 HydrophobicContact CD1-CD1 3.93Å; L44-I66 HydrophobicContact CD1-CG2 4.23Å
45	R	33	Very low	34.4	Very low	174 Å²	174	50.8 Å²	50.8	66%	0.657	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.7	166.3	-166.5	169.1	-172.5	163.6	1.1	108.4	L43	L43-R45 PolarHBondContact O-N 3.34Å
46	L	33.5	Very low	35.2	Very low	80 Å²	80	48.4 Å²	48.4	42%	0.419	30%	0.303	S	S	.	.			trans	-81.5	136.8	173.4	-71.2	159.6	0	0	0	109.1	G48 G49 N50	L46-G48 PolarHBondContact O-N 3.47Å; L46-G48 VanDerWaalsContact O-N 3.14Å; L46-G49 PolarHBondContact O-N 2.94Å; L46-N50 PolarHBondContact N-O 3.49Å
47	A	32.2	Very low	35.7	Very low	89 Å²	89	48.3 Å²	48.3	74%	0.736	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	116.3	170.8	0	0	0	0	0	108.7
48	G	31.7	Very low	36.1	Very low	84 Å²	84	47.9 Å²	47.9	87%	0.866	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	130.1	0.3	-170.9	0	0	0	0	0	115.4	L46	L46-G48 PolarHBondContact O-N 3.47Å; L46-G48 VanDerWaalsContact O-N 3.14Å
49	G	28.8	Very low	36.4	Very low	58 Å²	58	51.6 Å²	51.6	60%	0.598	33%	0.325	S	S	*	.	S	Bend	trans	93.1	-8.3	167.7	0	0	0	0	0	115.8	L46	L46-G49 PolarHBondContact O-N 2.94Å
50	N	32.5	Very low	36.6	Very low	107 Å²	107	52.6 Å²	52.6	57%	0.572	33%	0.334	S	S	*	.			trans	-95.1	111.7	172.2	-90.5	-20.1	0	0	0	111.2	L46	L46-N50 PolarHBondContact N-O 3.49Å
51	C	35.3	Very low	36.5	Very low	62 Å²	62	54.8 Å²	54.8	42%	0.419	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	117	170.8	-54.3	0	0	0	0	108.8	C96	C51-C96 PolarHBondContact O-SG 3.38Å
52	C	34.3	Very low	36.7	Very low	30 Å²	30	53.2 Å²	53.2	20%	0.203	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	102.6	168	-79.3	0	0	0	0	107.8	L44	L44-C52 VanDerWaalsContact CB-O 3.27Å; L44-C52 WeakPolarHBondContact CB-O 3.46Å; L44-C52 PolarHBondContact N-O 3.22Å; L44-C52 CarbonylContact O-C 3.43Å; L44-C52 PolarHBondContact O-N 3.46Å
53	C	37.5	Very low	36.6	Very low	31 Å²	31	55.6 Å²	55.6	21%	0.209	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	131.7	172.4	-39.8	0	0	0	0	108.4	L43 Q94	L43-C53 HydrophobicContact CD2-CB 3.74Å; L43-C53 VanDerWaalsContact CD2-SG 3.56Å; C53-Q94 HydrophobicContact CB-CB 4.35Å; C53-Q94 VanDerWaalsContact O-CB 3.24Å; C53-Q94 WeakPolarHBondContact O-CB 3.42Å; C53-Q94 PolarHBondContact O-N 3.32Å
54	T	38.2	Very low	37	Very low	15 Å²	15	51.9 Å²	51.9	9%	0.092	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	110.6	176.5	-59.4	0	0	0	0	108.8	L42 V56 V91	L42-T54 CarbonylContact C-O 3.49Å; L42-T54 WeakPolarHBondContact CA-O 3.45Å; L42-T54 WeakPolarHBondContact CB-O 3.41Å; L42-T54 PolarHBondContact N-O 2.96Å; L42-T54 VanDerWaalsContact N-O 3.08Å; L42-T54 CarbonylContact O-C 3.55Å; L42-T54 PolarHBondContact O-N 3.05Å; T54-V56 HydrophobicContact CG2-CG2 4.21Å; T54-V91 HydrophobicContact CG2-CG1 3.43Å; T54-V91 VanDerWaalsContact CG2-CG1 3.43Å
55	I	39	Very low	37	Very low	26 Å²	26	52.7 Å²	52.7	13%	0.133	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125.3	178.3	-62.2	164.7	0	0	0	108.4	I39 V41 Y105	I39-I55 HydrophobicContact CG2-CG2 3.83Å; V41-I55 HydrophobicContact CG1-CG1 3.93Å; V41-I55 HydrophobicContact CG2-CG1 4.27Å; V41-I55 HydrophobicContact CG2-CG2 4.15Å; I55-Y105 HydrophobicContact CD1-CD2 4.3Å; I55-Y105 HydrophobicContact CD1-CE1 4.44Å; I55-Y105 HydrophobicContact CD1-CE2 3.72Å
56	V	43.8	Very low	37.4	Very low	0 Å²	0	45.6 Å²	45.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	98	178.1	-176	0	0	0	0	108.9	A40 L42 T54 A58 I64 A72 I89	A40-V56 CarbonylContact C-O 3.57Å; A40-V56 WeakPolarHBondContact CA-O 3.29Å; A40-V56 WeakPolarHBondContact CB-O 3.42Å; A40-V56 PolarHBondContact N-O 3.22Å; A40-V56 CarbonylContact O-C 3.37Å; A40-V56 VanDerWaalsContact O-C 3.23Å; A40-V56 WeakPolarHBondContact O-CA 3.24Å; A40-V56 PolarHBondContact O-N 2.94Å; L42-V56 HydrophobicContact CB-CG2 4.48Å; L42-V56 HydrophobicContact CD1-CB 4.43Å; L42-V56 HydrophobicContact CD1-CG2 4.21Å; T54-V56 HydrophobicContact CG2-CG2 4.21Å; V56-A58 PolarHBondContact O-N 3.04Å; V56-I64 HydrophobicContact CB-CD1 4.08Å; V56-I64 HydrophobicContact CG1-CD1 3.6Å; V56-I64 HydrophobicContact CG1-CG1 4.13Å; V56-I64 HydrophobicContact CG1-CG2 4.26Å; V56-A72 HydrophobicContact CG2-CB 4.5Å; V56-I89 HydrophobicContact CG1-CG2 3.76Å
57	A	39.3	Very low	37.4	Very low	45 Å²	45	44.5 Å²	44.5	37%	0.372	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	117	171.8	0	0	0	0	0	109.6	I39	I39-A57 HydrophobicContact CG1-CB 4.18Å; I39-A57 HydrophobicContact CG2-CB 4.21Å
58	A	38.7	Very low	37.5	Very low	8 Å²	8	48 Å²	48	7%	0.066	32%	0.315	C	S	.	.			trans	-143.2	120.9	178.4	0	0	0	0	0	110	L27 S38 V56 I64	L27-A58 HydrophobicContact CD1-CB 4.21Å; S38-A58 CarbonylContact C-O 3.57Å; S38-A58 CarbonylContact O-C 3.42Å; S38-A58 PolarHBondContact O-N 2.76Å; V56-A58 PolarHBondContact O-N 3.04Å; A58-I64 HydrophobicContact CB-CD1 4.36Å
59	D	40.3	Very low	37.3	Very low	86 Å²	86	51.5 Å²	51.5	46%	0.46	31%	0.311	S	S	.	.			trans	-58	154.7	171.3	-152.4	37.8	0	0	0	110.8	A61	D59-A61 PolarHBondContact O-N 3.07Å
60	P	41.4	Very low	37.6	Very low	57 Å²	57	57.7 Å²	57.7	37%	0.37	32%	0.316	S	S	.	.	S	Bend	trans	-72.6	13.6	-145.2	28.4	-35	0	0	0	117.4
61	A	37.8	Very low	37.4	Very low	51 Å²	51	56 Å²	56	42%	0.421	31%	0.312	S	S	.	.	S	Bend	trans	-142.5	101.4	172.1	0	0	0	0	0	110.6	D59	D59-A61 PolarHBondContact O-N 3.07Å
62	G	40.4	Very low	37.4	Very low	7 Å²	7	53.3 Å²	53.3	7%	0.072	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	153.2	178.8	0	0	0	0	0	114.3	L27	L27-G62 PolarHBondContact N-O 3.45Å; L27-G62 VanDerWaalsContact N-O 3.14Å
63	T	38.5	Very low	37.1	Very low	50 Å²	50	59.8 Å²	59.8	31%	0.307	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.2	171	-47.4	0	0	0	0	108.6	C24 Y25	C24-T63 HydrophobicContact CB-CG2 4.12Å; Y25-T63 CarbonylContact O-C 3.22Å; Y25-T63 WeakPolarHBondContact O-CA 3.4Å
64	I	44.6	Very low	37	Very low	0 Å²	0	59 Å²	59	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.5	174.7	-59.8	171	0	0	0	108.3	C24 Y25 L27 L42 V56 A58 I66 A72 A74	C24-I64 CarbonylContact C-O 3.23Å; C24-I64 WeakPolarHBondContact CA-O 3.36Å; Y25-I64 PolarHBondContact N-O 3.32Å; Y25-I64 PolarHBondContact O-N 3.43Å; L27-I64 HydrophobicContact CD1-CD1 3.34Å; L27-I64 HydrophobicContact CD1-CG1 4.01Å; L27-I64 HydrophobicContact CG-CD1 4.24Å; L42-I64 HydrophobicContact CD1-CD1 3.82Å; L42-I64 HydrophobicContact CD1-CG2 4.35Å; V56-I64 HydrophobicContact CB-CD1 4.08Å; V56-I64 HydrophobicContact CG1-CD1 3.6Å; V56-I64 HydrophobicContact CG1-CG1 4.13Å; V56-I64 HydrophobicContact CG1-CG2 4.26Å; A58-I64 HydrophobicContact CB-CD1 4.36Å; I64-I66 HydrophobicContact CG2-CD1 4.38Å; I64-I66 HydrophobicContact CG2-CG1 3.94Å; I64-A72 HydrophobicContact CG2-CB 4.42Å; I64-A74 HydrophobicContact CB-CB 4.22Å; I64-A74 HydrophobicContact CG1-CB 3.73Å; I64-A74 HydrophobicContact CG2-CB 4.44Å
65	C	37.4	Very low	36.6	Very low	47 Å²	47	63.2 Å²	63.2	32%	0.318	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.7	172	-64.1	0	0	0	0	110	A23 C24	A23-C65 WeakPolarHBondContact O-CA 3.1Å; C24-C65 HydrophobicContact CB-CB 4.22Å; C24-C65 WeakPolarHBondContact CB-SG 3.36Å; C24-C65 WeakPolarHBondContact SG-CB 2.96Å; C24-C65 CovalentContact SG-SG 2.06Å; C24-C65 PolarHBondContact SG-SG 3.48Å
66	I	40	Very low	36.2	Very low	24 Å²	24	64.3 Å²	64.3	12%	0.123	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.7	179.2	-49.1	-177.6	0	0	0	107.9	F14 A23 L42 L44 I64 A72	F14-I66 HydrophobicContact CZ-CD1 4.11Å; A23-I66 PolarHBondContact N-O 3.04Å; A23-I66 VanDerWaalsContact N-O 3.11Å; A23-I66 PolarHBondContact O-N 3.4Å; L42-I66 HydrophobicContact CD1-CD1 4.32Å; L42-I66 HydrophobicContact CD2-CD1 3.89Å; L44-I66 HydrophobicContact CD1-CD1 3.93Å; L44-I66 HydrophobicContact CD1-CG2 4.23Å; I64-I66 HydrophobicContact CG2-CD1 4.38Å; I64-I66 HydrophobicContact CG2-CG1 3.94Å; I66-A72 HydrophobicContact CG1-CB 4.13Å
67	S	34.1	Very low	35.4	Very low	57 Å²	57	74.7 Å²	74.7	40%	0.399	39%	0.388	S	S	.	.			trans	-113.9	152.6	171.9	-174.4	0	0	0	0	109.5	S21 M69	S21-S67 PolarHBondContact O-OG 3.48Å; S21-S67 VanDerWaalsContact O-OG 3.04Å; S67-M69 PolarHBondContact O-N 3.36Å
68	R	34.2	Very low	34.9	Very low	163 Å²	163	75.3 Å²	75.3	62%	0.615	39%	0.388	S	S	*	.	S	Bend	trans	-56.3	4.2	-175.4	-87.5	-178.5	162.9	-179.9	-2.2	116.6	P20	P20-R68 HydrophobicContact CB-CG 3.86Å; P20-R68 VanDerWaalsContact CD-NE 3.29Å; P20-R68 HydrophobicContact CG-CG 4.47Å; P20-R68 VanDerWaalsContact CG-NH2 3.28Å
69	M	27.3	Very low	34.3	Very low	158 Å²	158	80.1 Å²	80.1	78%	0.778	42%	0.417	S	S	*	.	S	Bend	trans	-114.3	86.1	175.9	-65.4	-170.4	-154.5	0	0	111.1	S67 C71	S67-M69 PolarHBondContact O-N 3.36Å; M69-C71 PolarHBondContact O-N 3.03Å
70	R	35.2	Very low	33.5	Very low	188 Å²	188	83.2 Å²	83.2	71%	0.709	43%	0.434	S	S	*	.	S	Bend	trans	49.6	-0.8	149.7	-61.1	-171.6	172.2	176.5	-5.1	120.1	Q93	R70-Q93 VanDerWaalsContact CG-OE1 3.27Å
71	C	29.3	Very low	32.7	Very low	71 Å²	71	89.4 Å²	89.4	48%	0.48	46%	0.455	S	S	.	.			trans	-151.7	116.4	-173.1	-64.3	0	0	0	0	109.1	M69 F73	M69-C71 PolarHBondContact O-N 3.03Å; C71-F73 HydrophobicContact CB-CE2 4.41Å
72	A	33.6	Very low	32.1	Very low	5 Å²	5	90.5 Å²	90.5	4%	0.041	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-83.9	129.2	164.1	0	0	0	0	0	110.6	V56 I64 I66 V91	V56-A72 HydrophobicContact CG2-CB 4.5Å; I64-A72 HydrophobicContact CG2-CB 4.42Å; I66-A72 HydrophobicContact CG1-CB 4.13Å; A72-V91 HydrophobicContact CB-CG1 4.49Å; A72-V91 HydrophobicContact CB-CG2 3.89Å; A72-V91 WeakPolarHBondContact O-CG2 3.43Å
73	F	29.4	Very low	31.5	Very low	167 Å²	167	100.9 Å²	100.9	73%	0.732	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.7	164.7	-67.5	-92.1	0	0	0	106.3	C71	C71-F73 HydrophobicContact CB-CE2 4.41Å
74	A	34.5	Very low	31	Very low	15 Å²	15	103 Å²	103	12%	0.124	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.2	164.6	0	0	0	0	0	109.9	I64 I89	I64-A74 HydrophobicContact CB-CB 4.22Å; I64-A74 HydrophobicContact CG1-CB 3.73Å; I64-A74 HydrophobicContact CG2-CB 4.44Å; A74-I89 VanDerWaalsContact CA-CD1 3.46Å; A74-I89 HydrophobicContact CB-CD1 3.01Å; A74-I89 HydrophobicContact CB-CG1 4.48Å; A74-I89 WeakPolarHBondContact O-CD1 3.27Å
75	T	29.8	Very low	30.4	Very low	103 Å²	103	106.1 Å²	106.1	63%	0.632	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.9	175.9	55.2	0	0	0	0	105.9
76	T	31.2	Very low	30.2	Very low	49 Å²	49	115.4 Å²	115.4	30%	0.301	57%	0.572	S	S	.	*			trans	-78.2	133	172.9	49.3	0	0	0	0	108.7
77	R	27.8	Very low	29.9	Very low	218 Å²	218	118.5 Å²	118.5	82%	0.823	58%	0.582	S	S	*	*			trans	-112.8	102.7	171.7	-162.1	-179.5	-169.1	-175.2	2.8	105.9
78	C	27.4	Very low	29.9	Very low	57 Å²	57	118.7 Å²	118.7	39%	0.385	58%	0.582	S	S	.	*			trans	-72.8	136	179.8	-58.8	0	0	0	0	110	C84	C78-C84 WeakPolarHBondContact CB-SG 3.27Å
79	T	26.2	Very low	30.1	Very low	109 Å²	109	112.8 Å²	112.8	67%	0.669	56%	0.562	S	S	*	*			trans	-106.5	134.1	166.9	44.8	0	0	0	0	110	F81	T79-F81 PolarHBondContact O-N 3.25Å; T79-F81 VanDerWaalsContact O-N 3.13Å
80	D	24.1	Very low	30.5	Very low	151 Å²	151	109.5 Å²	109.5	81%	0.807	54%	0.544	S	S	*	.	S	Bend	trans	62.6	-6.5	161.9	-52	-17.8	0	0	0	122.4
81	F	24.7	Very low	30.6	Very low	187 Å²	187	102.2 Å²	102.2	82%	0.82	52%	0.52	S	S	*	.	S	Bend	trans	-131.4	62.1	173.1	-67.2	-81.4	0	0	0	114.6	T79 W83	T79-F81 PolarHBondContact O-N 3.25Å; T79-F81 VanDerWaalsContact O-N 3.13Å; F81-W83 PolarHBondContact O-N 2.92Å
82	G	24.6	Very low	30.7	Very low	74 Å²	74	100 Å²	100	76%	0.763	51%	0.507	S	S	*	.	S	Bend	trans	69.3	-9.3	139.9	0	0	0	0	0	122.2
83	W	27.2	Very low	30.7	Very low	226 Å²	226	103.8 Å²	103.8	86%	0.856	52%	0.524	S	S	*	.			trans	-140.6	103.9	-176.6	-48.6	78	0	0	0	111.8	F81	F81-W83 PolarHBondContact O-N 2.92Å
84	C	29.4	Very low	30.9	Very low	93 Å²	93	97.5 Å²	97.5	63%	0.628	50%	0.497	S	S	*	.			trans	-97.1	98.2	173.4	-65.3	0	0	0	0	110.2	C78	C78-C84 WeakPolarHBondContact CB-SG 3.27Å
85	T	31.2	Very low	30.7	Very low	67 Å²	67	102.5 Å²	102.5	41%	0.411	53%	0.525	S	S	.	.			trans	-83.1	116.7	166	30.3	0	0	0	0	110.3	W87	T85-W87 VanDerWaalsContact O-CD1 3.25Å; T85-W87 PolarHBondContact O-N 3.21Å; T85-W87 PolarHBondContact OG1-NE1 3.31Å
86	R	34.1	Very low	30.5	Very low	241 Å²	241	100.9 Å²	100.9	91%	0.909	52%	0.518	S	S	*	.			trans	-68.6	107.8	165.1	-78.7	-177.7	-178.7	175.2	1	108.2
87	W	33.8	Very low	30.3	Very low	89 Å²	89	102.8 Å²	102.8	34%	0.337	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-98.7	132.6	174.2	-72.1	93.3	0	0	0	110.9	T85 I89 Y112 Q116	T85-W87 VanDerWaalsContact O-CD1 3.25Å; T85-W87 PolarHBondContact O-N 3.21Å; T85-W87 PolarHBondContact OG1-NE1 3.31Å; W87-I89 PolarHBondContact O-N 3.16Å; W87-Y112 HydrophobicContact CE3-CD1 4.26Å; W87-Y112 HydrophobicContact CZ3-CD1 4.02Å; W87-Q116 HydrophobicContact CH2-CB 4.21Å; W87-Q116 HydrophobicContact CH2-CG 3.79Å; W87-Q116 HydrophobicContact CZ2-CG 4.47Å; W87-Q116 HydrophobicContact CZ3-CG 4.02Å
88	P	33.2	Very low	30.4	Very low	62 Å²	62	94.3 Å²	94.3	40%	0.403	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-69.1	124.4	167.7	25.6	-26.8	0	0	0	108.8	F90 Y112	P88-F90 HydrophobicContact CG-CE2 4.4Å; P88-Y112 HydrophobicContact CG-CD1 4.3Å; P88-Y112 HydrophobicContact CG-CE1 3.38Å; P88-Y112 HydrophobicContact CG-CE2 4.41Å; P88-Y112 VanDerWaalsContact CG-CZ 3.44Å; P88-Y112 VanDerWaalsContact CG-OH 3.29Å; P88-Y112 WeakPolarHBondContact CG-OH 3.45Å
89	I	38.3	Very low	30.6	Very low	38 Å²	38	99 Å²	99	20%	0.195	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-90.2	122.7	178.1	-72	167.6	0	0	0	108.3	V56 A74 W87 V91	V56-I89 HydrophobicContact CG1-CG2 3.76Å; A74-I89 VanDerWaalsContact CA-CD1 3.46Å; A74-I89 HydrophobicContact CB-CD1 3.01Å; A74-I89 HydrophobicContact CB-CG1 4.48Å; A74-I89 WeakPolarHBondContact O-CD1 3.27Å; W87-I89 PolarHBondContact O-N 3.16Å; I89-V91 HydrophobicContact CG2-CG2 4.15Å; I89-V91 PolarHBondContact O-N 3.02Å
90	F	35.3	Very low	31	Very low	89 Å²	89	97.1 Å²	97.1	39%	0.39	53%	0.533	S	S	.	.			trans	-88	104.5	176.3	-71.7	-80.1	0	0	0	109.4	P88 A92 Y112	P88-F90 HydrophobicContact CG-CE2 4.4Å; F90-A92 PolarHBondContact O-N 3.47Å; F90-Y112 AromaticContact CE2-CD2 3.67Å; F90-Y112 HydrophobicContact CE2-CD2 3.67Å; F90-Y112 AromaticContact CE2-CE2 3.51Å; F90-Y112 HydrophobicContact CE2-CE2 3.51Å; F90-Y112 HydrophobicContact CE2-CG 4.4Å; F90-Y112 AromaticContact CZ-CD2 3.95Å; F90-Y112 HydrophobicContact CZ-CD2 3.95Å; F90-Y112 AromaticContact CZ-CE2 3.4Å; F90-Y112 HydrophobicContact CZ-CE2 3.4Å; F90-Y112 VanDerWaalsContact CZ-CE2 3.4Å
91	V	36.8	Very low	31.6	Very low	35 Å²	35	92.9 Å²	92.9	21%	0.212	51%	0.514	C	S	.	.			trans	-88.6	101.5	174.6	-170.9	0	0	0	0	106.3	T54 A72 I89 Q93	T54-V91 HydrophobicContact CG2-CG1 3.43Å; T54-V91 VanDerWaalsContact CG2-CG1 3.43Å; A72-V91 HydrophobicContact CB-CG1 4.49Å; A72-V91 HydrophobicContact CB-CG2 3.89Å; A72-V91 WeakPolarHBondContact O-CG2 3.43Å; I89-V91 HydrophobicContact CG2-CG2 4.15Å; I89-V91 PolarHBondContact O-N 3.02Å; V91-Q93 PolarHBondContact O-N 2.91Å
92	A	32.4	Very low	32.3	Very low	26 Å²	26	89.8 Å²	89.8	22%	0.215	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	110.7	167.5	0	0	0	0	0	108.1	F90 Q94 Y105	F90-A92 PolarHBondContact O-N 3.47Å; A92-Q94 PolarHBondContact O-N 3.44Å; A92-Y105 HydrophobicContact CB-CE1 3.46Å; A92-Y105 VanDerWaalsContact CB-CE1 3.46Å; A92-Y105 WeakPolarHBondContact CB-OH 3.01Å
93	Q	34.2	Very low	33.1	Very low	83 Å²	83	90.8 Å²	90.8	39%	0.388	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	108.3	168.1	-165.7	-179.8	-8	0	0	107.6	R70 V91 V95	R70-Q93 VanDerWaalsContact CG-OE1 3.27Å; V91-Q93 PolarHBondContact O-N 2.91Å; Q93-V95 PolarHBondContact O-N 3.13Å
94	Q	32.9	Very low	33.8	Very low	35 Å²	35	83.6 Å²	83.6	16%	0.164	47%	0.47	C	S	.	.			trans	-73.4	108.8	170.7	-155.9	175	-11.9	0	0	107.4	C53 A92 C96 G98	C53-Q94 HydrophobicContact CB-CB 4.35Å; C53-Q94 VanDerWaalsContact O-CB 3.24Å; C53-Q94 WeakPolarHBondContact O-CB 3.42Å; C53-Q94 PolarHBondContact O-N 3.32Å; A92-Q94 PolarHBondContact O-N 3.44Å; Q94-C96 PolarHBondContact O-N 3.2Å; Q94-G98 VanDerWaalsContact CG-O 3.25Å; Q94-G98 WeakPolarHBondContact CG-O 3.21Å; Q94-G98 PolarHBondContact NE2-O 3.26Å
95	V	29.3	Very low	34.5	Very low	120 Å²	120	81.1 Å²	81.1	73%	0.727	45%	0.447	S	S	*	.			trans	-66.3	127	170.1	-163.3	0	0	0	0	106.4	Q93 G97	Q93-V95 PolarHBondContact O-N 3.13Å; V95-G97 PolarHBondContact O-N 2.85Å
96	C	26.8	Very low	35.2	Very low	70 Å²	70	81.6 Å²	81.6	47%	0.473	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46	114	179.5	-73.7	0	0	0	0	110.4	C51 Q94	C51-C96 PolarHBondContact O-SG 3.38Å; Q94-C96 PolarHBondContact O-N 3.2Å
97	G	26.7	Very low	35.9	Very low	89 Å²	89	78.7 Å²	78.7	92%	0.918	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.6	-6.7	173.9	0	0	0	0	0	117.4	V95	V95-G97 PolarHBondContact O-N 2.85Å
98	G	29	Very low	36.5	Very low	40 Å²	40	81.3 Å²	81.3	41%	0.412	44%	0.444	S	S	.	.			trans	-136.7	119.1	179.1	0	0	0	0	0	113.3	Q94 L100	Q94-G98 VanDerWaalsContact CG-O 3.25Å; Q94-G98 WeakPolarHBondContact CG-O 3.21Å; Q94-G98 PolarHBondContact NE2-O 3.26Å; G98-L100 PolarHBondContact O-N 2.91Å
99	I	32.9	Very low	37.1	Very low	155 Å²	155	82.5 Å²	82.5	80%	0.795	44%	0.441	S	S	*	.			trans	-66.7	110.5	164.9	-61.7	169.7	0	0	0	106.8	P101	I99-P101 WeakPolarHBondContact O-CD 3.36Å
100	L	35	Very low	37.5	Very low	69 Å²	69	85.5 Å²	85.5	36%	0.361	45%	0.454	S	S	.	.			trans	-72.9	118.5	163.8	-90.2	149.6	0	0	0	106.9	G98 I102 I104 Y105	G98-L100 PolarHBondContact O-N 2.91Å; L100-I102 PolarHBondContact O-N 3.45Å; L100-I104 HydrophobicContact CD2-CD1 3.68Å; L100-Y105 HydrophobicContact CB-CE2 3.8Å
101	P	36.1	Very low	38.1	Very low	63 Å²	63	86.9 Å²	86.9	41%	0.409	46%	0.462	S	S	.	.			trans	-60.6	138.1	179.4	21.9	-30.2	0	0	0	110	I99 D103 I104	I99-P101 WeakPolarHBondContact O-CD 3.36Å; P101-D103 PolarHBondContact O-N 3.11Å; P101-I104 HydrophobicContact CG-CD1 4.04Å; P101-I104 HydrophobicContact CG-CG1 4.36Å; P101-I104 PolarHBondContact O-N 3.28Å
102	I	38.9	Very low	38.4	Very low	121 Å²	121	89 Å²	89	62%	0.621	47%	0.466	S	S	*	.	H	α-helix	trans	-47.3	-30.6	178.2	-105.2	164.7	0	0	0	112	L100 I104 Y105 Q106	L100-I102 PolarHBondContact O-N 3.45Å; I102-I104 VanDerWaalsContact C-N 3.29Å; I102-I104 PolarHBondContact O-N 2.97Å; I102-Y105 WeakPolarHBondContact O-CB 2.92Å; I102-Y105 PolarHBondContact O-N 3.44Å; I102-Q106 PolarHBondContact O-N 3.14Å
103	D	40.5	Very low	38.9	Very low	96 Å²	96	91.6 Å²	91.6	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-55.7	-34.7	179	-61.7	-29.5	0	0	0	114.6	P101 Y105 Q106 R107	P101-D103 PolarHBondContact O-N 3.11Å; D103-Y105 VanDerWaalsContact C-N 3.32Å; D103-Q106 PolarHBondContact O-N 2.91Å; D103-R107 WeakPolarHBondContact O-CG 3.11Å; D103-R107 PolarHBondContact O-N 3.22Å
104	I	42.5	Very low	39.2	Very low	74 Å²	74	94.3 Å²	94.3	38%	0.379	49%	0.485	S	S	.	.	H	α-helix	trans	-70	-36.3	-180	-66.7	170.6	0	0	0	110.3	L100 P101 I102 R108	L100-I104 HydrophobicContact CD2-CD1 3.68Å; P101-I104 HydrophobicContact CG-CD1 4.04Å; P101-I104 HydrophobicContact CG-CG1 4.36Å; P101-I104 PolarHBondContact O-N 3.28Å; I102-I104 VanDerWaalsContact C-N 3.29Å; I102-I104 PolarHBondContact O-N 2.97Å; I104-R108 PolarHBondContact O-N 3.15Å; I104-R108 VanDerWaalsContact O-N 3.13Å
105	Y	44.7	Very low	39.6	Very low	41 Å²	41	100.6 Å²	100.6	16%	0.161	51%	0.508	C	S	.	.	H	α-helix	trans	-70.6	-42.1	176.6	-61.2	-79.2	0	0	0	111	I55 A92 L100 I102 D103 R107 R108 Y109	I55-Y105 HydrophobicContact CD1-CD2 4.3Å; I55-Y105 HydrophobicContact CD1-CE1 4.44Å; I55-Y105 HydrophobicContact CD1-CE2 3.72Å; A92-Y105 HydrophobicContact CB-CE1 3.46Å; A92-Y105 VanDerWaalsContact CB-CE1 3.46Å; A92-Y105 WeakPolarHBondContact CB-OH 3.01Å; L100-Y105 HydrophobicContact CB-CE2 3.8Å; I102-Y105 WeakPolarHBondContact O-CB 2.92Å; I102-Y105 PolarHBondContact O-N 3.44Å; D103-Y105 VanDerWaalsContact C-N 3.32Å; Y105-R107 PolarHBondContact O-N 3.08Å; Y105-R108 PolarHBondContact O-N 2.06Å; Y105-Y109 WeakPolarHBondContact O-CB 3.46Å; Y105-Y109 PolarHBondContact O-N 2.8Å
106	Q	45.5	Very low	40	Very low	77 Å²	77	98.2 Å²	98.2	36%	0.36	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-43.6	176.5	-165.8	162.7	-16.9	0	0	111.4	I102 D103 R108 Y109 E110	I102-Q106 PolarHBondContact O-N 3.14Å; D103-Q106 PolarHBondContact O-N 2.91Å; Q106-R108 PolarHBondContact O-N 2.86Å; Q106-Y109 PolarHBondContact O-N 3.44Å; Q106-E110 WeakPolarHBondContact O-CG 3.32Å; Q106-E110 PolarHBondContact O-N 2.91Å
107	R	48.6	Very low	40.6	Very low	181 Å²	181	100.8 Å²	100.8	68%	0.683	50%	0.502	S	S	*	.	H	α-helix	trans	-61.3	-43.9	174.8	-76.7	-173.4	-149.9	-163.3	5.6	113.3	D103 Y105 E110 Q111	D103-R107 WeakPolarHBondContact O-CG 3.11Å; D103-R107 PolarHBondContact O-N 3.22Å; Y105-R107 PolarHBondContact O-N 3.08Å; R107-E110 PolarHBondContact O-N 3.44Å; R107-Q111 WeakPolarHBondContact O-CB 3.11Å; R107-Q111 WeakPolarHBondContact O-CG 3.42Å; R107-Q111 PolarHBondContact O-N 2.88Å
108	R	46.9	Very low	41.3	Very low	144 Å²	144	100.5 Å²	100.5	54%	0.543	49%	0.491	S	S	.	.	H	α-helix	trans	-67.6	-38.8	178.4	-82.9	-165.6	-176.6	-175.4	3.8	112	I104 Y105 Q106 Q111 Y112	I104-R108 PolarHBondContact O-N 3.15Å; I104-R108 VanDerWaalsContact O-N 3.13Å; Y105-R108 PolarHBondContact O-N 2.06Å; Q106-R108 PolarHBondContact O-N 2.86Å; R108-Q111 PolarHBondContact O-N 3.09Å; R108-Y112 PolarHBondContact O-N 3.41Å
109	Y	45.9	Very low	41.7	Very low	86 Å²	86	109.6 Å²	109.6	34%	0.337	52%	0.523	S	S	.	.	H	α-helix	trans	-61.4	-47.6	174.6	177.7	-98.6	0	0	0	111.1	A37 Y105 Q106 Q111 Y112 K113	A37-Y109 HydrophobicContact CB-CE1 4.46Å; A37-Y109 HydrophobicContact CB-CE2 4Å; A37-Y109 VanDerWaalsContact CB-OH 3.27Å; A37-Y109 WeakPolarHBondContact CB-OH 3.34Å; Y105-Y109 WeakPolarHBondContact O-CB 3.46Å; Y105-Y109 PolarHBondContact O-N 2.8Å; Q106-Y109 PolarHBondContact O-N 3.44Å; Y109-Q111 PolarHBondContact O-N 2.91Å; Y109-Y112 PolarHBondContact O-N 3.05Å; Y109-Y112 VanDerWaalsContact O-N 3.16Å; Y109-K113 HydrophobicContact CE1-CD 4.36Å; Y109-K113 PolarHBondContact O-N 3.38Å
110	E	46.7	Very low	42.1	Very low	102 Å²	102	107.4 Å²	107.4	48%	0.477	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-41.9	176.7	-73.1	-156	176.1	0	0	112.7	Q106 R107 Y112 K113 H114	Q106-E110 WeakPolarHBondContact O-CG 3.32Å; Q106-E110 PolarHBondContact O-N 2.91Å; R107-E110 PolarHBondContact O-N 3.44Å; E110-Y112 VanDerWaalsContact C-N 3.26Å; E110-Y112 PolarHBondContact O-N 3.34Å; E110-K113 PolarHBondContact O-N 2.78Å; E110-H114 PolarHBondContact O-CD2 3.29Å; E110-H114 PolarHBondContact O-N 2.9Å
111	Q	47.1	Very low	42.5	Very low	118 Å²	118	109.4 Å²	109.4	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-60	-35.5	174	-78.1	-177.4	-10.2	0	0	113	R107 R108 Y109 R115	R107-Q111 WeakPolarHBondContact O-CB 3.11Å; R107-Q111 WeakPolarHBondContact O-CG 3.42Å; R107-Q111 PolarHBondContact O-N 2.88Å; R108-Q111 PolarHBondContact O-N 3.09Å; Y109-Q111 PolarHBondContact O-N 2.91Å; Q111-R115 PolarHBondContact O-N 3.38Å
112	Y	44.4	Very low	42.9	Very low	78 Å²	78	111.9 Å²	111.9	31%	0.306	52%	0.523	S	S	.	.	H	α-helix	trans	-73.4	-41.4	176.7	-122.5	-89.6	0	0	0	112.2	W87 P88 F90 R108 Y109 E110 H114 R115 Q116	W87-Y112 HydrophobicContact CE3-CD1 4.26Å; W87-Y112 HydrophobicContact CZ3-CD1 4.02Å; P88-Y112 HydrophobicContact CG-CD1 4.3Å; P88-Y112 HydrophobicContact CG-CE1 3.38Å; P88-Y112 HydrophobicContact CG-CE2 4.41Å; P88-Y112 VanDerWaalsContact CG-CZ 3.44Å; P88-Y112 VanDerWaalsContact CG-OH 3.29Å; P88-Y112 WeakPolarHBondContact CG-OH 3.45Å; F90-Y112 AromaticContact CE2-CD2 3.67Å; F90-Y112 HydrophobicContact CE2-CD2 3.67Å; F90-Y112 AromaticContact CE2-CE2 3.51Å; F90-Y112 HydrophobicContact CE2-CE2 3.51Å; F90-Y112 HydrophobicContact CE2-CG 4.4Å; F90-Y112 AromaticContact CZ-CD2 3.95Å; F90-Y112 HydrophobicContact CZ-CD2 3.95Å; F90-Y112 AromaticContact CZ-CE2 3.4Å; F90-Y112 HydrophobicContact CZ-CE2 3.4Å; F90-Y112 VanDerWaalsContact CZ-CE2 3.4Å; R108-Y112 PolarHBondContact O-N 3.41Å; Y109-Y112 PolarHBondContact O-N 3.05Å; Y109-Y112 VanDerWaalsContact O-N 3.16Å; E110-Y112 VanDerWaalsContact C-N 3.26Å; E110-Y112 PolarHBondContact O-N 3.34Å; Y112-H114 VanDerWaalsContact C-N 3.26Å; Y112-H114 PolarHBondContact O-N 3.14Å; Y112-R115 PolarHBondContact O-N 3.42Å; Y112-Q116 PolarHBondContact O-N 3.45Å
113	K	42.5	Very low	43.1	Very low	82 Å²	82	111.4 Å²	111.4	36%	0.357	52%	0.517	S	S	.	.	H	α-helix	trans	-56.8	-42.7	175.7	-165.5	178.3	-178.7	-178.9	0	110.9	Y109 E110 R115 Q116 V117	Y109-K113 HydrophobicContact CE1-CD 4.36Å; Y109-K113 PolarHBondContact O-N 3.38Å; E110-K113 PolarHBondContact O-N 2.78Å; K113-R115 VanDerWaalsContact C-N 3.33Å; K113-R115 PolarHBondContact O-N 3.41Å; K113-Q116 PolarHBondContact O-N 3.42Å; K113-V117 WeakPolarHBondContact O-CG2 3.36Å; K113-V117 PolarHBondContact O-N 3.44Å
114	H	39.5	Very low	43.3	Very low	140 Å²	140	112.4 Å²	112.4	65%	0.648	52%	0.518	S	S	*	.	H	α-helix	trans	-65.7	-29	176	-82.4	-72.6	0	0	0	114.3	E110 Y112	E110-H114 PolarHBondContact O-CD2 3.29Å; E110-H114 PolarHBondContact O-N 2.9Å; Y112-H114 VanDerWaalsContact C-N 3.26Å; Y112-H114 PolarHBondContact O-N 3.14Å
115	R	41.5	Very low	43.3	Very low	167 Å²	167	114.9 Å²	114.9	63%	0.63	53%	0.527	S	S	*	.	H	α-helix	trans	-77.7	-32.9	178.1	-71.6	-173.1	-154.5	-159.1	5.1	113.7	Q111 Y112 K113 V117 A118	Q111-R115 PolarHBondContact O-N 3.38Å; Y112-R115 PolarHBondContact O-N 3.42Å; K113-R115 VanDerWaalsContact C-N 3.33Å; K113-R115 PolarHBondContact O-N 3.41Å; R115-V117 VanDerWaalsContact C-N 3.33Å; R115-A118 PolarHBondContact O-N 3.13Å
116	Q	38.8	Very low	43.2	Very low	69 Å²	69	120.2 Å²	120.2	32%	0.322	55%	0.553	S	S	.	*	H	α-helix	trans	-73.4	-24.8	177	-83	-152.5	-1.5	0	0	113.6	W87 Y112 K113 A118	W87-Q116 HydrophobicContact CH2-CB 4.21Å; W87-Q116 HydrophobicContact CH2-CG 3.79Å; W87-Q116 HydrophobicContact CZ2-CG 4.47Å; W87-Q116 HydrophobicContact CZ3-CG 4.02Å; Y112-Q116 PolarHBondContact O-N 3.45Å; K113-Q116 PolarHBondContact O-N 3.42Å; Q116-A118 PolarHBondContact O-N 3.09Å
117	V	38.4	Very low	43	Very low	124 Å²	124	123.5 Å²	123.5	75%	0.752	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-10.9	175	-176.7	0	0	0	0	111.6	K113 R115	K113-V117 WeakPolarHBondContact O-CG2 3.36Å; K113-V117 PolarHBondContact O-N 3.44Å; R115-V117 VanDerWaalsContact C-N 3.33Å
118	A	42	Very low	42.6	Very low	84 Å²	84	118.8 Å²	118.8	69%	0.694	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	4.9	-177.3	0	0	0	0	0	114.4	R115 Q116	R115-A118 PolarHBondContact O-N 3.13Å; Q116-A118 PolarHBondContact O-N 3.09Å
119	Q	37.4	Very low	42.2	Very low	231 Å²	231	116.5 Å²	116.5	100%	1.079	56%	0.559	S	S	*	*			trans	-116.4	0	173.9	-68.8	-169.7	-37.3	0	0	110.2

Retrieved 119 of 119 residues in 66.8 ms (Link to these results)

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