A0A077ZBI1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZBI1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 108 aa.

						>A0A077ZBI1_TRITR|A0A077ZBI1
MTVSGDSHFSAWHARRTNEDTGLIAFSLSLSLFHATLGNGAMSKLADACSSQWRVLSPSPLPSCDSVAGSSSFDILVVFSSSSTLSLRLFFSFIIIIYTFPFSPNPTK
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	47.5	Very low	242 Å²	242	117.2 Å²	117.2	100%	1.192	68%	0.683	S	S	*	*				0	88.4	0	-83.8	175.4	177.4	0	0	107.7
2	T	43.6	Very low	47.5	Very low	142 Å²	142	116.8 Å²	116.8	87%	0.871	66%	0.662	S	S	*	*			trans	-99.7	116.3	171.7	19.7	0	0	0	0	106.6	S4	T2-S4 PolarHBondContact O-N 3.28Å
3	V	42.2	Very low	47.3	Very low	125 Å²	125	114.9 Å²	114.9	76%	0.758	64%	0.644	S	S	*	*			trans	-64.6	120.2	-170.1	179	0	0	0	0	109.2	G5	V3-G5 PolarHBondContact O-N 3.09Å
4	S	53.9	Low	47.4	Very low	108 Å²	108	110 Å²	110	76%	0.755	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	29.1	175.7	-55.3	0	0	0	0	114.1	T2	T2-S4 PolarHBondContact O-N 3.28Å
5	G	51.3	Low	46.9	Very low	32 Å²	32	114.3 Å²	114.3	33%	0.33	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87	-24	-175.4	0	0	0	0	0	114.7	V3 F9	V3-G5 PolarHBondContact O-N 3.09Å; G5-F9 PolarHBondContact O-N 3.24Å
6	D	47.4	Very low	46.3	Very low	142 Å²	142	115 Å²	115	76%	0.759	62%	0.618	S	S	*	*	H	α-helix	trans	-73.4	-32.5	-172.6	-66.9	-24.9	0	0	0	113.1	S10	D6-S10 WeakPolarHBondContact O-CB 3.23Å; D6-S10 PolarHBondContact O-N 3.35Å
7	S	51.7	Low	46.1	Very low	89 Å²	89	112.6 Å²	112.6	62%	0.622	61%	0.608	S	S	*	*	H	α-helix	trans	-72	-34	178.5	53.2	0	0	0	0	112.6	A11	S7-A11 WeakPolarHBondContact O-CB 3.27Å; S7-A11 PolarHBondContact O-N 3.19Å; S7-A11 VanDerWaalsContact O-N 3.16Å
8	H	46.4	Very low	45.9	Very low	149 Å²	149	112.9 Å²	112.9	69%	0.69	61%	0.61	S	S	*	*	H	α-helix	trans	-75.7	-39.4	-179.9	-159.1	-104.8	0	0	0	111.8	A11 W12	H8-A11 PolarHBondContact O-N 3.24Å; H8-W12 WeakPolarHBondContact O-CB 3.44Å; H8-W12 PolarHBondContact O-N 3.32Å
9	F	43.8	Very low	45.4	Very low	131 Å²	131	112.3 Å²	112.3	58%	0.575	60%	0.602	S	S	*	*	H	α-helix	trans	-65.1	-43.1	175.4	-171.9	-101.6	0	0	0	111.7	G5 A11 W12 H13	G5-F9 PolarHBondContact O-N 3.24Å; F9-A11 PolarHBondContact O-N 3.25Å; F9-W12 PolarHBondContact O-N 3.26Å; F9-H13 AromaticContact CE1-CD2 3.68Å; F9-H13 AromaticContact CZ-CD2 3.61Å; F9-H13 WeakPolarHBondContact O-CB 3.34Å; F9-H13 PolarHBondContact O-N 2.9Å
10	S	48.2	Very low	45	Very low	80 Å²	80	110.9 Å²	110.9	56%	0.559	60%	0.595	S	S	*	*	H	α-helix	trans	-64.4	-40.2	177.8	-168.4	0	0	0	0	112.6	D6 H13 A14	D6-S10 WeakPolarHBondContact O-CB 3.23Å; D6-S10 PolarHBondContact O-N 3.35Å; S10-H13 PolarHBondContact O-N 3.5Å; S10-A14 VanDerWaalsContact O-CB 3.28Å; S10-A14 WeakPolarHBondContact O-CB 3.46Å; S10-A14 PolarHBondContact O-N 3.5Å
11	A	52.8	Low	44.7	Very low	49 Å²	49	109.5 Å²	109.5	41%	0.405	59%	0.59	S	S	.	*	H	α-helix	trans	-67.7	-39.6	175.3	0	0	0	0	0	112.7	S7 H8 F9 R15	S7-A11 WeakPolarHBondContact O-CB 3.27Å; S7-A11 PolarHBondContact O-N 3.19Å; S7-A11 VanDerWaalsContact O-N 3.16Å; H8-A11 PolarHBondContact O-N 3.24Å; F9-A11 PolarHBondContact O-N 3.25Å; A11-R15 WeakPolarHBondContact O-CB 3.48Å; A11-R15 VanDerWaalsContact O-CG 3.3Å; A11-R15 WeakPolarHBondContact O-CG 3.41Å; A11-R15 PolarHBondContact O-N 3.48Å
12	W	47.7	Very low	44.5	Very low	113 Å²	113	100 Å²	100	43%	0.428	55%	0.554	S	S	.	*	H	α-helix	trans	-64.9	-44.1	174.7	-180	86.6	0	0	0	111.6	H8 F9 R15 R16	H8-W12 WeakPolarHBondContact O-CB 3.44Å; H8-W12 PolarHBondContact O-N 3.32Å; F9-W12 PolarHBondContact O-N 3.26Å; W12-R15 PolarHBondContact O-N 3.48Å; W12-R16 HydrophobicContact CH2-CG 4.36Å; W12-R16 HydrophobicContact CZ2-CG 4.23Å; W12-R16 VanDerWaalsContact CZ2-CZ 3.43Å; W12-R16 PolarHBondContact O-N 2.94Å
13	H	44.3	Very low	44.4	Very low	92 Å²	92	98.4 Å²	98.4	43%	0.426	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-46.7	178.3	-133.4	-65.5	0	0	0	110.8	F9 S10 R15 R16 T17	F9-H13 AromaticContact CE1-CD2 3.68Å; F9-H13 AromaticContact CZ-CD2 3.61Å; F9-H13 WeakPolarHBondContact O-CB 3.34Å; F9-H13 PolarHBondContact O-N 2.9Å; S10-H13 PolarHBondContact O-N 3.5Å; H13-R15 VanDerWaalsContact C-N 3.29Å; H13-R15 PolarHBondContact O-N 2.98Å; H13-R16 WeakPolarHBondContact O-CB 3.19Å; H13-R16 PolarHBondContact O-N 3.46Å; H13-R16 VanDerWaalsContact O-N 3.14Å; H13-T17 PolarHBondContact O-N 2.73Å; H13-T17 PolarHBondContact O-OG1 3.05Å
14	A	48.6	Very low	44.3	Very low	46 Å²	46	97.3 Å²	97.3	38%	0.38	53%	0.528	S	S	.	.	H	α-helix	trans	-61.8	-34.7	176.2	0	0	0	0	0	112.9	S10 N18	S10-A14 VanDerWaalsContact O-CB 3.28Å; S10-A14 WeakPolarHBondContact O-CB 3.46Å; S10-A14 PolarHBondContact O-N 3.5Å; A14-N18 WeakPolarHBondContact O-CB 3.38Å; A14-N18 PolarHBondContact O-N 2.82Å; A14-N18 PolarHBondContact O-ND2 2.83Å; A14-N18 VanDerWaalsContact O-ND2 3.11Å
15	R	40.2	Very low	44	Very low	174 Å²	174	94.5 Å²	94.5	66%	0.657	51%	0.512	S	S	*	.	H	α-helix	trans	-63.9	-48.6	171.5	-79.9	-179.8	-179.8	-137.9	1.9	111.1	A11 W12 H13 T17 N18 E19	A11-R15 WeakPolarHBondContact O-CB 3.48Å; A11-R15 VanDerWaalsContact O-CG 3.3Å; A11-R15 WeakPolarHBondContact O-CG 3.41Å; A11-R15 PolarHBondContact O-N 3.48Å; W12-R15 PolarHBondContact O-N 3.48Å; H13-R15 VanDerWaalsContact C-N 3.29Å; H13-R15 PolarHBondContact O-N 2.98Å; R15-T17 PolarHBondContact O-N 2.96Å; R15-N18 PolarHBondContact O-N 3.32Å; R15-E19 WeakPolarHBondContact O-CB 3.38Å; R15-E19 VanDerWaalsContact O-CG 3.26Å; R15-E19 WeakPolarHBondContact O-CG 3.37Å; R15-E19 PolarHBondContact O-N 2.89Å
16	R	37.8	Very low	43.7	Very low	126 Å²	126	97 Å²	97	48%	0.475	51%	0.514	S	S	.	.	H	α-helix	trans	-58.7	-45.4	174.1	-92.3	-147.8	-173.7	177.2	5.8	112.8	W12 H13 N18 E19 D20	W12-R16 HydrophobicContact CH2-CG 4.36Å; W12-R16 HydrophobicContact CZ2-CG 4.23Å; W12-R16 VanDerWaalsContact CZ2-CZ 3.43Å; W12-R16 PolarHBondContact O-N 2.94Å; H13-R16 WeakPolarHBondContact O-CB 3.19Å; H13-R16 PolarHBondContact O-N 3.46Å; H13-R16 VanDerWaalsContact O-N 3.14Å; R16-N18 VanDerWaalsContact C-N 3.29Å; R16-N18 PolarHBondContact O-N 3.33Å; R16-E19 WeakPolarHBondContact O-CB 3.24Å; R16-E19 PolarHBondContact O-N 3.28Å; R16-D20 WeakPolarHBondContact O-CB 3.33Å; R16-D20 VanDerWaalsContact O-CG 3.3Å; R16-D20 PolarHBondContact O-N 3.13Å
17	T	43.5	Very low	43.6	Very low	74 Å²	74	93 Å²	93	45%	0.454	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-37.4	-179.9	-17.6	0	0	0	0	111.4	H13 R15 T21	H13-T17 PolarHBondContact O-N 2.73Å; H13-T17 PolarHBondContact O-OG1 3.05Å; R15-T17 PolarHBondContact O-N 2.96Å; T17-T21 VanDerWaalsContact O-CB 3.27Å; T17-T21 WeakPolarHBondContact O-CB 3.15Å; T17-T21 PolarHBondContact O-N 2.86Å; T17-T21 PolarHBondContact O-OG1 3.44Å
18	N	41.2	Very low	43.5	Very low	119 Å²	119	93.7 Å²	93.7	64%	0.636	49%	0.493	S	S	*	.	H	α-helix	trans	-69.7	-36.4	175.2	-78.8	-36.6	0	0	0	112.3	A14 R15 R16 G22	A14-N18 WeakPolarHBondContact O-CB 3.38Å; A14-N18 PolarHBondContact O-N 2.82Å; A14-N18 PolarHBondContact O-ND2 2.83Å; A14-N18 VanDerWaalsContact O-ND2 3.11Å; R15-N18 PolarHBondContact O-N 3.32Å; R16-N18 VanDerWaalsContact C-N 3.29Å; R16-N18 PolarHBondContact O-N 3.33Å; N18-G22 PolarHBondContact O-N 3.37Å
19	E	36.7	Very low	43.5	Very low	101 Å²	101	90 Å²	90	47%	0.472	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-47.4	173.1	-73.5	165.8	-169.2	0	0	111.2	R15 R16 T21 G22 L23	R15-E19 WeakPolarHBondContact O-CB 3.38Å; R15-E19 VanDerWaalsContact O-CG 3.26Å; R15-E19 WeakPolarHBondContact O-CG 3.37Å; R15-E19 PolarHBondContact O-N 2.89Å; R16-E19 WeakPolarHBondContact O-CB 3.24Å; R16-E19 PolarHBondContact O-N 3.28Å; E19-T21 PolarHBondContact O-N 3.26Å; E19-G22 PolarHBondContact O-N 3.35Å; E19-L23 WeakPolarHBondContact O-CB 3.43Å; E19-L23 WeakPolarHBondContact O-CG 3.5Å; E19-L23 PolarHBondContact O-N 3.23Å
20	D	37.7	Very low	43.8	Very low	84 Å²	84	87.2 Å²	87.2	45%	0.449	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-41	176.9	-69.7	-30	0	0	0	111.2	R16 G22 L23 I24	R16-D20 WeakPolarHBondContact O-CB 3.33Å; R16-D20 VanDerWaalsContact O-CG 3.3Å; R16-D20 PolarHBondContact O-N 3.13Å; D20-G22 VanDerWaalsContact C-N 3.34Å; D20-L23 PolarHBondContact O-N 3.48Å; D20-I24 WeakPolarHBondContact O-CB 3.3Å; D20-I24 WeakPolarHBondContact O-CD1 3.27Å; D20-I24 VanDerWaalsContact O-CG1 3.22Å; D20-I24 WeakPolarHBondContact O-CG1 3.41Å; D20-I24 PolarHBondContact O-N 3.48Å
21	T	38.2	Very low	43.9	Very low	82 Å²	82	87.1 Å²	87.1	50%	0.503	47%	0.474	S	S	.	.	H	α-helix	trans	-65.4	-40	175.8	-54.4	0	0	0	0	111.1	T17 E19 I24 A25	T17-T21 VanDerWaalsContact O-CB 3.27Å; T17-T21 WeakPolarHBondContact O-CB 3.15Å; T17-T21 PolarHBondContact O-N 2.86Å; T17-T21 PolarHBondContact O-OG1 3.44Å; E19-T21 PolarHBondContact O-N 3.26Å; T21-I24 PolarHBondContact O-N 3.38Å; T21-A25 VanDerWaalsContact O-CB 3.3Å; T21-A25 WeakPolarHBondContact O-CB 3.35Å; T21-A25 PolarHBondContact O-N 2.82Å
22	G	36.8	Very low	43.8	Very low	42 Å²	42	89.8 Å²	89.8	43%	0.433	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-43.4	174.5	0	0	0	0	0	112.2	N18 E19 D20 F26	N18-G22 PolarHBondContact O-N 3.37Å; E19-G22 PolarHBondContact O-N 3.35Å; D20-G22 VanDerWaalsContact C-N 3.34Å; G22-F26 WeakPolarHBondContact O-CB 3.28Å; G22-F26 PolarHBondContact O-N 2.88Å
23	L	41.3	Very low	43.9	Very low	108 Å²	108	86.5 Å²	86.5	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-65.8	-39.2	175.9	-76.5	166.5	0	0	0	112.7	E19 D20 F26 S27	E19-L23 WeakPolarHBondContact O-CB 3.43Å; E19-L23 WeakPolarHBondContact O-CG 3.5Å; E19-L23 PolarHBondContact O-N 3.23Å; D20-L23 PolarHBondContact O-N 3.48Å; L23-F26 WeakPolarHBondContact O-CB 3.13Å; L23-F26 PolarHBondContact O-N 3.46Å; L23-S27 WeakPolarHBondContact O-CB 3.12Å; L23-S27 PolarHBondContact O-N 3.5Å
24	I	41.8	Very low	44.1	Very low	102 Å²	102	86 Å²	86	52%	0.523	47%	0.468	S	S	.	.	H	α-helix	trans	-69.9	-46.3	176.7	-67.6	164.4	0	0	0	110.7	D20 T21 F26 S27 L28	D20-I24 WeakPolarHBondContact O-CB 3.3Å; D20-I24 WeakPolarHBondContact O-CD1 3.27Å; D20-I24 VanDerWaalsContact O-CG1 3.22Å; D20-I24 WeakPolarHBondContact O-CG1 3.41Å; D20-I24 PolarHBondContact O-N 3.48Å; T21-I24 PolarHBondContact O-N 3.38Å; I24-F26 PolarHBondContact O-N 3.42Å; I24-S27 PolarHBondContact O-N 3.29Å; I24-S27 PolarHBondContact O-OG 3.32Å; I24-L28 HydrophobicContact CG2-CD1 4.29Å; I24-L28 PolarHBondContact O-N 3.31Å
25	A	46.6	Very low	44.2	Very low	50 Å²	50	87.8 Å²	87.8	41%	0.413	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-35	175.3	0	0	0	0	0	111.3	T21 S29	T21-A25 VanDerWaalsContact O-CB 3.3Å; T21-A25 WeakPolarHBondContact O-CB 3.35Å; T21-A25 PolarHBondContact O-N 2.82Å; A25-S29 VanDerWaalsContact O-CB 3.3Å; A25-S29 WeakPolarHBondContact O-CB 3.05Å; A25-S29 PolarHBondContact O-N 2.87Å; A25-S29 PolarHBondContact O-OG 3.06Å
26	F	46	Very low	44.6	Very low	85 Å²	85	85 Å²	85	37%	0.373	49%	0.485	S	S	.	.	H	α-helix	trans	-66.3	-46.3	173.4	174.7	-99.8	0	0	0	112.2	G22 L23 I24 L28 S29 L30	G22-F26 WeakPolarHBondContact O-CB 3.28Å; G22-F26 PolarHBondContact O-N 2.88Å; L23-F26 WeakPolarHBondContact O-CB 3.13Å; L23-F26 PolarHBondContact O-N 3.46Å; I24-F26 PolarHBondContact O-N 3.42Å; F26-L28 VanDerWaalsContact C-N 3.31Å; F26-L28 PolarHBondContact O-N 2.94Å; F26-S29 CarbonylContact O-C 3.6Å; F26-S29 PolarHBondContact O-N 2.91Å; F26-L30 HydrophobicContact CE1-CD2 4.35Å; F26-L30 WeakPolarHBondContact O-CB 3.47Å; F26-L30 PolarHBondContact O-N 3.15Å
27	S	43.6	Very low	45.1	Very low	58 Å²	58	82.3 Å²	82.3	41%	0.406	48%	0.479	S	S	.	.	H	α-helix	trans	-65	-36.6	179.3	76.6	0	0	0	0	111.9	L23 I24 S31	L23-S27 WeakPolarHBondContact O-CB 3.12Å; L23-S27 PolarHBondContact O-N 3.5Å; I24-S27 PolarHBondContact O-N 3.29Å; I24-S27 PolarHBondContact O-OG 3.32Å; S27-S31 VanDerWaalsContact O-CB 3.26Å; S27-S31 WeakPolarHBondContact O-CB 3.45Å; S27-S31 PolarHBondContact O-N 2.8Å; S27-S31 PolarHBondContact O-OG 3.14Å
28	L	49.6	Very low	45.1	Very low	103 Å²	103	80.2 Å²	80.2	54%	0.539	47%	0.472	S	S	.	.	H	α-helix	trans	-64.3	-45.3	171.1	-108.8	137	0	0	0	111.6	I24 F26 S31 L32	I24-L28 HydrophobicContact CG2-CD1 4.29Å; I24-L28 PolarHBondContact O-N 3.31Å; F26-L28 VanDerWaalsContact C-N 3.31Å; F26-L28 PolarHBondContact O-N 2.94Å; L28-S31 PolarHBondContact O-N 2.98Å; L28-L32 WeakPolarHBondContact O-CB 3.33Å; L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.39Å; L28-L32 PolarHBondContact O-N 3.04Å
29	S	46.9	Very low	45.3	Very low	72 Å²	72	80.8 Å²	80.8	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-66.3	-38.4	178.4	-59.3	0	0	0	0	112	A25 F26 L32 F33	A25-S29 VanDerWaalsContact O-CB 3.3Å; A25-S29 WeakPolarHBondContact O-CB 3.05Å; A25-S29 PolarHBondContact O-N 2.87Å; A25-S29 PolarHBondContact O-OG 3.06Å; F26-S29 CarbonylContact O-C 3.6Å; F26-S29 PolarHBondContact O-N 2.91Å; S29-L32 PolarHBondContact O-N 2.71Å; S29-F33 WeakPolarHBondContact O-CB 3.49Å; S29-F33 PolarHBondContact O-N 3.34Å
30	L	51.5	Low	45.6	Very low	72 Å²	72	78.5 Å²	78.5	38%	0.377	48%	0.479	S	S	.	.	H	α-helix	trans	-68.8	-40.1	175.2	-169.4	72	0	0	0	110.9	F26 F33 H34	F26-L30 HydrophobicContact CE1-CD2 4.35Å; F26-L30 WeakPolarHBondContact O-CB 3.47Å; F26-L30 PolarHBondContact O-N 3.15Å; L30-F33 PolarHBondContact O-N 2.95Å; L30-H34 VanDerWaalsContact O-CB 3.22Å; L30-H34 WeakPolarHBondContact O-CB 3.4Å; L30-H34 PolarHBondContact O-N 3.19Å
31	S	49	Very low	45.7	Very low	77 Å²	77	75.9 Å²	75.9	54%	0.538	47%	0.469	S	S	.	.	H	α-helix	trans	-65	-41.1	174.7	-61.6	0	0	0	0	111.4	S27 L28 H34 A35	S27-S31 VanDerWaalsContact O-CB 3.26Å; S27-S31 WeakPolarHBondContact O-CB 3.45Å; S27-S31 PolarHBondContact O-N 2.8Å; S27-S31 PolarHBondContact O-OG 3.14Å; L28-S31 PolarHBondContact O-N 2.98Å; S31-H34 PolarHBondContact O-N 3.03Å; S31-A35 VanDerWaalsContact O-CB 3.29Å; S31-A35 WeakPolarHBondContact O-CB 3.04Å; S31-A35 PolarHBondContact O-N 2.86Å
32	L	51	Low	46	Very low	105 Å²	105	75.1 Å²	75.1	55%	0.55	46%	0.461	S	S	.	.	H	α-helix	trans	-66.9	-40.6	173.9	-76.9	163.8	0	0	0	111.6	L28 S29 A35 T36	L28-L32 WeakPolarHBondContact O-CB 3.33Å; L28-L32 VanDerWaalsContact O-CG 3.29Å; L28-L32 WeakPolarHBondContact O-CG 3.39Å; L28-L32 PolarHBondContact O-N 3.04Å; S29-L32 PolarHBondContact O-N 2.71Å; L32-A35 PolarHBondContact O-N 3.49Å; L32-T36 VanDerWaalsContact O-CB 3.26Å; L32-T36 WeakPolarHBondContact O-CB 3.27Å; L32-T36 PolarHBondContact O-N 3.24Å; L32-T36 PolarHBondContact O-OG1 2.91Å
33	F	50.6	Low	46.2	Very low	44 Å²	44	76.4 Å²	76.4	19%	0.193	46%	0.463	C	S	.	.	H	α-helix	trans	-63.8	-43.5	174.5	-172.2	-102.5	0	0	0	110.7	S29 L30 A35 T36 L37 M42 L45	S29-F33 WeakPolarHBondContact O-CB 3.49Å; S29-F33 PolarHBondContact O-N 3.34Å; L30-F33 PolarHBondContact O-N 2.95Å; F33-A35 PolarHBondContact O-N 3.29Å; F33-T36 PolarHBondContact O-N 2.99Å; F33-L37 HydrophobicContact CD1-CD1 3.48Å; F33-L37 VanDerWaalsContact CD1-CD1 3.48Å; F33-L37 HydrophobicContact CD2-CD1 3.57Å; F33-L37 HydrophobicContact CE1-CD1 3.11Å; F33-L37 HydrophobicContact CE2-CD1 3.2Å; F33-L37 HydrophobicContact CG-CD1 3.72Å; F33-L37 HydrophobicContact CZ-CD1 2.98Å; F33-L37 HydrophobicContact CZ-CG 4.46Å; F33-L37 VanDerWaalsContact O-CB 3.32Å; F33-L37 WeakPolarHBondContact O-CB 3.19Å; F33-L37 PolarHBondContact O-N 3.44Å; F33-M42 HydrophobicContact CE1-SD 4.46Å; F33-L45 HydrophobicContact CE1-CD2 4.31Å
34	H	47.7	Very low	46.4	Very low	83 Å²	83	78.8 Å²	78.8	38%	0.384	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-42.6	175.1	-166.3	-142.8	0	0	0	111.8	L30 S31 G38	L30-H34 VanDerWaalsContact O-CB 3.22Å; L30-H34 WeakPolarHBondContact O-CB 3.4Å; L30-H34 PolarHBondContact O-N 3.19Å; S31-H34 PolarHBondContact O-N 3.03Å; H34-G38 PolarHBondContact O-N 3.5Å; H34-G38 VanDerWaalsContact O-N 3.08Å
35	A	50.6	Low	46.6	Very low	82 Å²	82	76.1 Å²	76.1	68%	0.678	46%	0.455	S	S	*	.	H	α-helix	trans	-65.9	-37	174.2	0	0	0	0	0	112.7	S31 L32 F33	S31-A35 VanDerWaalsContact O-CB 3.29Å; S31-A35 WeakPolarHBondContact O-CB 3.04Å; S31-A35 PolarHBondContact O-N 2.86Å; L32-A35 PolarHBondContact O-N 3.49Å; F33-A35 PolarHBondContact O-N 3.29Å
36	T	49.1	Very low	46.7	Very low	117 Å²	117	76.6 Å²	76.6	72%	0.718	46%	0.459	S	S	*	.	H	α-helix	trans	-77.1	-37.7	-177.3	-56.4	0	0	0	0	112.2	L32 F33	L32-T36 VanDerWaalsContact O-CB 3.26Å; L32-T36 WeakPolarHBondContact O-CB 3.27Å; L32-T36 PolarHBondContact O-N 3.24Å; L32-T36 PolarHBondContact O-OG1 2.91Å; F33-T36 PolarHBondContact O-N 2.99Å
37	L	47.8	Very low	46.9	Very low	68 Å²	68	77.4 Å²	77.4	36%	0.356	47%	0.467	S	S	.	.	H	α-helix	trans	-86.7	-18.8	-177.7	-87.2	155	0	0	0	112.9	F33 A41	F33-L37 HydrophobicContact CD1-CD1 3.48Å; F33-L37 VanDerWaalsContact CD1-CD1 3.48Å; F33-L37 HydrophobicContact CD2-CD1 3.57Å; F33-L37 HydrophobicContact CE1-CD1 3.11Å; F33-L37 HydrophobicContact CE2-CD1 3.2Å; F33-L37 HydrophobicContact CG-CD1 3.72Å; F33-L37 HydrophobicContact CZ-CD1 2.98Å; F33-L37 HydrophobicContact CZ-CG 4.46Å; F33-L37 VanDerWaalsContact O-CB 3.32Å; F33-L37 WeakPolarHBondContact O-CB 3.19Å; F33-L37 PolarHBondContact O-N 3.44Å; L37-A41 HydrophobicContact CB-CB 3.87Å; L37-A41 HydrophobicContact CD2-CB 3.45Å; L37-A41 VanDerWaalsContact CD2-CB 3.45Å; L37-A41 HydrophobicContact CG-CB 4.26Å; L37-A41 WeakPolarHBondContact O-CB 3.23Å
38	G	43.8	Very low	46.9	Very low	30 Å²	30	76.5 Å²	76.5	31%	0.309	46%	0.463	S	S	.	.	H	α-helix	trans	64.7	157.8	-175.7	0	0	0	0	0	112.1	H34 G40 A41	H34-G38 PolarHBondContact O-N 3.5Å; H34-G38 VanDerWaalsContact O-N 3.08Å; G38-G40 PolarHBondContact O-N 2.9Å; G38-A41 PolarHBondContact O-N 3.25Å
39	N	46	Very low	46.7	Very low	132 Å²	132	73.9 Å²	73.9	71%	0.706	45%	0.453	S	S	*	.	H	α-helix	trans	-50.9	-28.5	-179.2	-81.1	19.5	0	0	0	113.5
40	G	41.9	Very low	46.5	Very low	52 Å²	52	73 Å²	73	54%	0.536	45%	0.447	S	S	.	.	H	α-helix	trans	-72.1	-32.2	-178.9	0	0	0	0	0	115.2	G38 K44	G38-G40 PolarHBondContact O-N 2.9Å; G40-K44 PolarHBondContact O-N 2.93Å
41	A	41	Very low	46.1	Very low	29 Å²	29	72.7 Å²	72.7	24%	0.24	45%	0.451	C	S	.	.	H	α-helix	trans	-87.4	-23.3	-177.7	0	0	0	0	0	112.9	L37 G38 K44 L45	L37-A41 HydrophobicContact CB-CB 3.87Å; L37-A41 HydrophobicContact CD2-CB 3.45Å; L37-A41 VanDerWaalsContact CD2-CB 3.45Å; L37-A41 HydrophobicContact CG-CB 4.26Å; L37-A41 WeakPolarHBondContact O-CB 3.23Å; G38-A41 PolarHBondContact O-N 3.25Å; A41-K44 PolarHBondContact O-N 3.31Å; A41-L45 WeakPolarHBondContact O-CB 3.33Å; A41-L45 PolarHBondContact O-N 3.22Å
42	M	42.9	Very low	45.7	Very low	67 Å²	67	74.9 Å²	74.9	33%	0.33	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-40.6	168.6	-79.4	-68.2	-92.1	0	0	112.3	F33 K44 L45 A46	F33-M42 HydrophobicContact CE1-SD 4.46Å; M42-K44 VanDerWaalsContact C-N 3.32Å; M42-K44 PolarHBondContact O-N 2.98Å; M42-L45 PolarHBondContact O-N 2.97Å; M42-A46 WeakPolarHBondContact O-CB 3.22Å; M42-A46 PolarHBondContact O-N 3.47Å
43	S	42.2	Very low	44.9	Very low	69 Å²	69	78 Å²	78	48%	0.483	46%	0.457	S	S	.	.	H	α-helix	trans	-60.8	-44	175.1	-171.4	0	0	0	0	111.1	L45 A46 D47	S43-L45 VanDerWaalsContact C-N 3.34Å; S43-L45 PolarHBondContact O-N 3.3Å; S43-A46 PolarHBondContact O-N 2.92Å; S43-D47 PolarHBondContact O-N 2.96Å
44	K	44.7	Very low	44.3	Very low	158 Å²	158	85.5 Å²	85.5	69%	0.687	48%	0.484	S	S	*	.	H	α-helix	trans	-67.5	-33.9	176.9	-69.7	-178	179.3	-178.2	0	112.6	G40 A41 M42 A48	G40-K44 PolarHBondContact O-N 2.93Å; A41-K44 PolarHBondContact O-N 3.31Å; M42-K44 VanDerWaalsContact C-N 3.32Å; M42-K44 PolarHBondContact O-N 2.98Å; K44-A48 VanDerWaalsContact O-CB 3.24Å; K44-A48 WeakPolarHBondContact O-CB 3.32Å; K44-A48 PolarHBondContact O-N 3.42Å
45	L	46.9	Very low	44	Very low	45 Å²	45	87.5 Å²	87.5	24%	0.236	50%	0.502	C	S	.	.	H	α-helix	trans	-71.2	-39.9	175.8	-162	78	0	0	0	111.2	F33 A41 M42 S43 A48 C49 L87	F33-L45 HydrophobicContact CE1-CD2 4.31Å; A41-L45 WeakPolarHBondContact O-CB 3.33Å; A41-L45 PolarHBondContact O-N 3.22Å; M42-L45 PolarHBondContact O-N 2.97Å; S43-L45 VanDerWaalsContact C-N 3.34Å; S43-L45 PolarHBondContact O-N 3.3Å; L45-A48 PolarHBondContact O-N 3.23Å; L45-C49 WeakPolarHBondContact O-CB 3.31Å; L45-C49 PolarHBondContact O-N 3.23Å; L45-C49 PolarHBondContact O-SG 3.43Å; L45-L87 HydrophobicContact CD1-CD2 3.74Å
46	A	48.9	Very low	43.5	Very low	60 Å²	60	89.8 Å²	89.8	50%	0.496	50%	0.502	S	S	.	.	H	α-helix	trans	-63.2	-41.3	173.8	0	0	0	0	0	111.5	M42 S43 S50	M42-A46 WeakPolarHBondContact O-CB 3.22Å; M42-A46 PolarHBondContact O-N 3.47Å; S43-A46 PolarHBondContact O-N 2.92Å; A46-S50 WeakPolarHBondContact O-CB 3.26Å; A46-S50 PolarHBondContact O-N 3.34Å
47	D	48.6	Very low	42.9	Very low	103 Å²	103	86.3 Å²	86.3	55%	0.551	48%	0.483	S	S	*	.	H	α-helix	trans	-67.1	-39.1	173.9	-74.8	-27.6	0	0	0	112.4	S43 S50 S51	S43-D47 PolarHBondContact O-N 2.96Å; D47-S50 PolarHBondContact O-N 3.25Å; D47-S51 WeakPolarHBondContact O-CB 3.48Å; D47-S51 PolarHBondContact O-N 2.78Å; D47-S51 PolarHBondContact O-OG 2.87Å
48	A	45.1	Very low	42.6	Very low	39 Å²	39	89.1 Å²	89.1	32%	0.322	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-43.4	175.5	0	0	0	0	0	111.8	K44 L45 S51 Q52	K44-A48 VanDerWaalsContact O-CB 3.24Å; K44-A48 WeakPolarHBondContact O-CB 3.32Å; K44-A48 PolarHBondContact O-N 3.42Å; L45-A48 PolarHBondContact O-N 3.23Å; A48-S51 WeakPolarHBondContact CA-OG 3.38Å; A48-S51 PolarHBondContact O-N 3.43Å; A48-S51 PolarHBondContact O-OG 3.49Å; A48-S51 VanDerWaalsContact O-OG 3.05Å; A48-Q52 WeakPolarHBondContact O-CB 3.22Å; A48-Q52 WeakPolarHBondContact O-CG 3.4Å; A48-Q52 PolarHBondContact O-N 3.35Å
49	C	44.5	Very low	42.4	Very low	47 Å²	47	91.7 Å²	91.7	32%	0.318	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-43.2	174	-72.3	0	0	0	0	111.1	L45 S51 Q52 W53	L45-C49 WeakPolarHBondContact O-CB 3.31Å; L45-C49 PolarHBondContact O-N 3.23Å; L45-C49 PolarHBondContact O-SG 3.43Å; C49-S51 PolarHBondContact O-N 3.21Å; C49-Q52 PolarHBondContact O-N 3.08Å; C49-W53 WeakPolarHBondContact O-CB 3.48Å; C49-W53 PolarHBondContact O-N 3.37Å
50	S	43.2	Very low	42.3	Very low	55 Å²	55	91.1 Å²	91.1	39%	0.385	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-43.4	176.7	168.9	0	0	0	0	112.7	A46 D47 R54	A46-S50 WeakPolarHBondContact O-CB 3.26Å; A46-S50 PolarHBondContact O-N 3.34Å; D47-S50 PolarHBondContact O-N 3.25Å; S50-R54 WeakPolarHBondContact O-CG 3.48Å; S50-R54 PolarHBondContact O-N 3Å
51	S	42.6	Very low	42.4	Very low	65 Å²	65	95 Å²	95	46%	0.455	53%	0.53	S	S	.	.	H	α-helix	trans	-74.5	-38.1	-179.6	53.4	0	0	0	0	113	D47 A48 C49 V55	D47-S51 WeakPolarHBondContact O-CB 3.48Å; D47-S51 PolarHBondContact O-N 2.78Å; D47-S51 PolarHBondContact O-OG 2.87Å; A48-S51 WeakPolarHBondContact CA-OG 3.38Å; A48-S51 PolarHBondContact O-N 3.43Å; A48-S51 PolarHBondContact O-OG 3.49Å; A48-S51 VanDerWaalsContact O-OG 3.05Å; C49-S51 PolarHBondContact O-N 3.21Å; S51-V55 WeakPolarHBondContact O-CG2 3.46Å
52	Q	40.6	Very low	42.2	Very low	122 Å²	122	97.4 Å²	97.4	57%	0.57	54%	0.543	S	S	*	.	H	α-helix	trans	-74.9	-33.2	177	-71.2	-178.1	-27.7	0	0	112.7	A48 C49 R54 V55 L56	A48-Q52 WeakPolarHBondContact O-CB 3.22Å; A48-Q52 WeakPolarHBondContact O-CG 3.4Å; A48-Q52 PolarHBondContact O-N 3.35Å; C49-Q52 PolarHBondContact O-N 3.08Å; Q52-R54 VanDerWaalsContact C-N 3.33Å; Q52-R54 PolarHBondContact O-N 2.9Å; Q52-V55 PolarHBondContact O-N 3.4Å; Q52-L56 PolarHBondContact O-N 3.05Å
53	W	34.2	Very low	41.9	Very low	171 Å²	171	98.4 Å²	98.4	65%	0.648	56%	0.556	S	S	*	*	H	α-helix	trans	-67.3	-33.5	175.9	-152.9	-95	0	0	0	112.3	C49 V55 S57	C49-W53 WeakPolarHBondContact O-CB 3.48Å; C49-W53 PolarHBondContact O-N 3.37Å; W53-V55 VanDerWaalsContact C-N 3.34Å; W53-V55 PolarHBondContact O-N 2.86Å; W53-S57 WeakPolarHBondContact O-CB 3.48Å; W53-S57 PolarHBondContact O-N 2.94Å
54	R	37.3	Very low	41.7	Very low	201 Å²	201	101.3 Å²	101.3	76%	0.758	58%	0.575	S	S	*	*	H	α-helix	trans	-69.9	-26.8	174.7	-78.5	-174.3	-165.4	178.4	5.5	114	S50 Q52	S50-R54 WeakPolarHBondContact O-CG 3.48Å; S50-R54 PolarHBondContact O-N 3Å; Q52-R54 VanDerWaalsContact C-N 3.33Å; Q52-R54 PolarHBondContact O-N 2.9Å
55	V	42.3	Very low	41.3	Very low	125 Å²	125	101.3 Å²	101.3	76%	0.758	58%	0.582	S	S	*	*	H	α-helix	trans	-82.4	-25.4	179.9	175.5	0	0	0	0	111.7	S51 Q52 W53	S51-V55 WeakPolarHBondContact O-CG2 3.46Å; Q52-V55 PolarHBondContact O-N 3.4Å; W53-V55 VanDerWaalsContact C-N 3.34Å; W53-V55 PolarHBondContact O-N 2.86Å
56	L	40.5	Very low	40.8	Very low	131 Å²	131	103.2 Å²	103.2	69%	0.686	60%	0.599	S	S	*	*	H	α-helix	trans	-95	-6.2	178.4	-73.7	165.3	0	0	0	114.3	Q52 P58	Q52-L56 PolarHBondContact O-N 3.05Å; L56-P58 VanDerWaalsContact C-CD 3.48Å; L56-P58 VanDerWaalsContact O-CD 3.27Å; L56-P58 WeakPolarHBondContact O-CD 3.1Å
57	S	37.1	Very low	40.4	Very low	44 Å²	44	103.8 Å²	103.8	31%	0.308	60%	0.596	S	S	.	*			trans	-117.5	81.4	-179.1	-162.9	0	0	0	0	111.3	W53 S59	W53-S57 WeakPolarHBondContact O-CB 3.48Å; W53-S57 PolarHBondContact O-N 2.94Å; S57-S59 PolarHBondContact O-N 3.02Å; S57-S59 PolarHBondContact OG-O 2.98Å
58	P	39.8	Very low	40	Very low	126 Å²	126	103.7 Å²	103.7	82%	0.818	61%	0.61	S	S	*	*			trans	-77.9	6.9	168.1	31.9	-32	0	0	0	112.9	L56	L56-P58 VanDerWaalsContact C-CD 3.48Å; L56-P58 VanDerWaalsContact O-CD 3.27Å; L56-P58 WeakPolarHBondContact O-CD 3.1Å
59	S	40	Very low	39.4	Very low	84 Å²	84	105.1 Å²	105.1	59%	0.587	63%	0.628	S	S	*	*	S	Bend	trans	-116.5	131.7	-179.7	-77.4	0	0	0	0	111	S57 L61	S57-S59 PolarHBondContact O-N 3.02Å; S57-S59 PolarHBondContact OG-O 2.98Å; S59-L61 PolarHBondContact O-N 2.73Å; S59-L61 VanDerWaalsContact O-N 3.09Å
60	P	45.1	Very low	38.8	Very low	120 Å²	120	107.6 Å²	107.6	78%	0.779	65%	0.646	S	S	*	*			trans	-56.9	119.8	171.9	24.5	-31.4	0	0	0	108.2	P62	P60-P62 VanDerWaalsContact O-CD 3.23Å; P60-P62 WeakPolarHBondContact O-CD 3.29Å
61	L	42.4	Very low	38.2	Very low	135 Å²	135	109.3 Å²	109.3	71%	0.707	66%	0.658	S	S	*	*			trans	-51.3	115.7	173.1	-79.4	159.8	0	0	0	107.8	S59 S63	S59-L61 PolarHBondContact O-N 2.73Å; S59-L61 VanDerWaalsContact O-N 3.09Å; L61-S63 PolarHBondContact O-N 2.88Å
62	P	38.3	Very low	37.8	Very low	79 Å²	79	112.1 Å²	112.1	51%	0.513	68%	0.678	S	S	.	*			trans	-61.6	129.5	169.8	25.2	-30.2	0	0	0	106.8	P60 C64 V67	P60-P62 VanDerWaalsContact O-CD 3.23Å; P60-P62 WeakPolarHBondContact O-CD 3.29Å; P62-C64 PolarHBondContact O-N 3.33Å; P62-V67 HydrophobicContact CG-CG2 3.94Å
63	S	35.5	Very low	37.6	Very low	87 Å²	87	113.4 Å²	113.4	61%	0.608	68%	0.682	S	S	*	*			trans	-32.7	124.5	170.8	35.1	0	0	0	0	111.1	L61 D65 S66	L61-S63 PolarHBondContact O-N 2.88Å; S63-D65 PolarHBondContact O-N 3.5Å; S63-S66 PolarHBondContact O-N 3.26Å; S63-S66 PolarHBondContact O-OG 2.85Å
64	C	37.7	Very low	37.6	Very low	130 Å²	130	113.2 Å²	113.2	88%	0.878	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.8	-4.7	-171.3	-81	0	0	0	0	116.7	P62	P62-C64 PolarHBondContact O-N 3.33Å
65	D	36.6	Very low	37.7	Very low	159 Å²	159	107 Å²	107	85%	0.85	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-3.9	178.8	-66.1	-36.9	0	0	0	114.2	S63	S63-D65 PolarHBondContact O-N 3.5Å
66	S	35.9	Very low	37.5	Very low	85 Å²	85	107.6 Å²	107.6	59%	0.594	67%	0.673	S	S	*	*	S	Bend	trans	-111.9	-8.7	-169	-28.8	0	0	0	0	115.5	S63	S63-S66 PolarHBondContact O-N 3.26Å; S63-S66 PolarHBondContact O-OG 2.85Å
67	V	41.5	Very low	37.6	Very low	71 Å²	71	103.7 Å²	103.7	43%	0.43	65%	0.654	S	S	.	*			trans	-112.7	37.2	-168.7	-168.5	0	0	0	0	111.9	P62 F73	P62-V67 HydrophobicContact CG-CG2 3.94Å; V67-F73 HydrophobicContact CG1-CE2 3.75Å; V67-F73 HydrophobicContact CG1-CZ 4.3Å
68	A	39.1	Very low	37.8	Very low	102 Å²	102	107.2 Å²	107.2	84%	0.843	67%	0.674	S	S	*	*	S	Bend	trans	-93.7	4.7	170.8	0	0	0	0	0	113.1
69	G	32.5	Very low	38	Very low	68 Å²	68	104.1 Å²	104.1	70%	0.701	65%	0.648	S	S	*	*	S	Bend	trans	-127.7	-9.9	-162.7	0	0	0	0	0	118.5
70	S	31.8	Very low	37.9	Very low	100 Å²	100	104.2 Å²	104.2	70%	0.699	65%	0.648	S	S	*	*			trans	-165.8	143	-176.7	-123.5	0	0	0	0	115.7
71	S	32	Very low	37.6	Very low	91 Å²	91	103.7 Å²	103.7	64%	0.636	65%	0.647	S	S	*	*			trans	65.7	105.4	156.3	63.1	0	0	0	0	118.5	F73	S71-F73 PolarHBondContact O-N 3.23Å
72	S	32.7	Very low	37.7	Very low	124 Å²	124	102.8 Å²	102.8	87%	0.867	65%	0.653	S	S	*	*			trans	10.6	94.4	137.9	-46.6	0	0	0	0	115.9	D74	S72-D74 PolarHBondContact O-N 3.35Å
73	F	36.6	Very low	38.1	Very low	149 Å²	149	100.7 Å²	100.7	65%	0.654	64%	0.64	S	S	*	*			trans	-76.2	110.3	162.9	-87	-94.4	0	0	0	108.9	V67 S71 I75	V67-F73 HydrophobicContact CG1-CE2 3.75Å; V67-F73 HydrophobicContact CG1-CZ 4.3Å; S71-F73 PolarHBondContact O-N 3.23Å; F73-I75 HydrophobicContact CB-CG1 4.36Å; F73-I75 PolarHBondContact O-N 3.46Å; F73-I75 VanDerWaalsContact O-N 3.13Å
74	D	35.3	Very low	38.9	Very low	166 Å²	166	100.4 Å²	100.4	89%	0.888	63%	0.634	S	S	*	*			trans	-63.8	103.3	163.4	-91.8	-46.7	0	0	0	108.9	S72	S72-D74 PolarHBondContact O-N 3.35Å
75	I	39.3	Very low	39.5	Very low	70 Å²	70	100.6 Å²	100.6	36%	0.359	63%	0.626	S	S	.	*			trans	-100.1	93.1	172.9	-56.4	175.6	0	0	0	107.9	F73 V77 I95	F73-I75 HydrophobicContact CB-CG1 4.36Å; F73-I75 PolarHBondContact O-N 3.46Å; F73-I75 VanDerWaalsContact O-N 3.13Å; I75-V77 HydrophobicContact CG2-CG2 3.74Å; I75-V77 PolarHBondContact O-N 2.87Å; I75-I95 HydrophobicContact CG2-CG1 4.26Å
76	L	37.4	Very low	40.2	Very low	138 Å²	138	95.6 Å²	95.6	72%	0.723	60%	0.603	S	S	*	*			trans	-78.2	102.6	169.5	-172.1	87.5	0	0	0	109.1	V78	L76-V78 HydrophobicContact CD2-CG2 3.7Å; L76-V78 HydrophobicContact CG-CG2 4.12Å; L76-V78 PolarHBondContact O-N 3.33Å
77	V	43.4	Very low	40.9	Very low	49 Å²	49	93.2 Å²	93.2	30%	0.297	58%	0.584	S	S	.	*			trans	-90.8	103.9	171.6	-174.3	0	0	0	0	110.2	I75 F79 I95	I75-V77 HydrophobicContact CG2-CG2 3.74Å; I75-V77 PolarHBondContact O-N 2.87Å; V77-F79 HydrophobicContact CB-CD2 4.29Å; V77-F79 HydrophobicContact CB-CE2 3.88Å; V77-F79 HydrophobicContact CB-CZ 4.4Å; V77-F79 HydrophobicContact CG1-CD1 4.15Å; V77-F79 HydrophobicContact CG1-CD2 3.54Å; V77-F79 HydrophobicContact CG1-CE1 3.84Å; V77-F79 HydrophobicContact CG1-CE2 3.18Å; V77-F79 HydrophobicContact CG1-CG 4.04Å; V77-F79 HydrophobicContact CG1-CZ 3.38Å; V77-F79 PolarHBondContact O-N 2.76Å; V77-I95 HydrophobicContact CB-CD1 3.81Å; V77-I95 HydrophobicContact CG2-CD1 3.23Å; V77-I95 HydrophobicContact CG2-CG1 3.67Å
78	V	40.6	Very low	41.4	Very low	119 Å²	119	94.6 Å²	94.6	72%	0.721	58%	0.581	S	S	*	*			trans	-84.1	94.7	171.6	-177.8	0	0	0	0	108.5	L76 S80	L76-V78 HydrophobicContact CD2-CG2 3.7Å; L76-V78 HydrophobicContact CG-CG2 4.12Å; L76-V78 PolarHBondContact O-N 3.33Å; V78-S80 PolarHBondContact O-N 2.86Å
79	F	44.4	Very low	42.3	Very low	61 Å²	61	95 Å²	95	27%	0.268	57%	0.569	S	S	.	*			trans	-80.8	111.3	170.8	-68.4	-80.4	0	0	0	110.5	V77 R88 F91	V77-F79 HydrophobicContact CB-CD2 4.29Å; V77-F79 HydrophobicContact CB-CE2 3.88Å; V77-F79 HydrophobicContact CB-CZ 4.4Å; V77-F79 HydrophobicContact CG1-CD1 4.15Å; V77-F79 HydrophobicContact CG1-CD2 3.54Å; V77-F79 HydrophobicContact CG1-CE1 3.84Å; V77-F79 HydrophobicContact CG1-CE2 3.18Å; V77-F79 HydrophobicContact CG1-CG 4.04Å; V77-F79 HydrophobicContact CG1-CZ 3.38Å; V77-F79 PolarHBondContact O-N 2.76Å; F79-R88 HydrophobicContact CD1-CG 4.07Å; F79-R88 HydrophobicContact CE1-CB 4.42Å; F79-R88 HydrophobicContact CE1-CG 4.24Å; F79-R88 HydrophobicContact CG-CG 4.42Å; F79-F91 HydrophobicContact CE1-CB 3.56Å; F79-F91 AromaticContact CE1-CD2 3.75Å; F79-F91 HydrophobicContact CE1-CD2 3.75Å; F79-F91 AromaticContact CE1-CG 3.95Å; F79-F91 HydrophobicContact CE1-CG 3.95Å; F79-F91 HydrophobicContact CE2-CB 4.47Å; F79-F91 HydrophobicContact CZ-CB 3.28Å; F79-F91 HydrophobicContact CZ-CD2 4.38Å; F79-F91 HydrophobicContact CZ-CG 4.13Å
80	S	37.9	Very low	43.5	Very low	85 Å²	85	95.1 Å²	95.1	59%	0.594	55%	0.55	S	S	*	*			trans	-62.7	136.9	164.6	-171.5	0	0	0	0	109.7	V78 S82 S83	V78-S80 PolarHBondContact O-N 2.86Å; S80-S82 PolarHBondContact O-N 3.17Å; S80-S83 PolarHBondContact O-N 2.92Å; S80-S83 PolarHBondContact O-OG 2.83Å
81	S	39.6	Very low	44.7	Very low	109 Å²	109	93 Å²	93	76%	0.762	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-16.3	-169.7	-57.1	0	0	0	0	115.1	R88	S81-R88 PolarHBondContact O-NH2 2.81Å
82	S	44.3	Very low	46	Very low	117 Å²	117	91.1 Å²	91.1	82%	0.818	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	1.1	178.8	-59.4	0	0	0	0	115.5	S80 T84	S80-S82 PolarHBondContact O-N 3.17Å; S82-T84 PolarHBondContact O-N 3.42Å
83	S	46.3	Very low	47.3	Very low	34 Å²	34	90 Å²	90	24%	0.238	50%	0.495	C	S	.	.			trans	-74	124.1	-179.8	-51.3	0	0	0	0	111	S80 R88	S80-S83 PolarHBondContact O-N 2.92Å; S80-S83 PolarHBondContact O-OG 2.83Å; S83-R88 PolarHBondContact O-NE 3.29Å
84	T	52.7	Low	48.4	Very low	82 Å²	82	85.7 Å²	85.7	50%	0.503	48%	0.478	S	S	.	.			trans	-54.7	146.8	174.5	44.3	0	0	0	0	110.9	S82 S86 L87 R88	S82-T84 PolarHBondContact O-N 3.42Å; T84-S86 PolarHBondContact O-N 2.79Å; T84-S86 PolarHBondContact OG1-OG 3Å; T84-L87 PolarHBondContact O-N 2.81Å; T84-R88 PolarHBondContact O-N 2.92Å
85	L	49.2	Very low	49.6	Very low	134 Å²	134	79.7 Å²	79.7	70%	0.702	45%	0.446	S	S	*	.	H	α-helix	trans	-52.9	-32.4	-177.8	-171.9	134.3	0	0	0	112.4	R88 L89	L85-R88 PolarHBondContact O-N 3.14Å; L85-L89 HydrophobicContact CD2-CD1 3.63Å; L85-L89 HydrophobicContact CD2-CG 4.33Å; L85-L89 VanDerWaalsContact O-CG 3.31Å; L85-L89 WeakPolarHBondContact O-CG 3.34Å; L85-L89 PolarHBondContact O-N 2.63Å
86	S	51.2	Low	50.6	Low	53 Å²	53	81 Å²	81	37%	0.371	45%	0.452	S	S	.	.	H	α-helix	trans	-64	-41.6	174.4	53.2	0	0	0	0	113.8	T84 L89 F90	T84-S86 PolarHBondContact O-N 2.79Å; T84-S86 PolarHBondContact OG1-OG 3Å; S86-L89 PolarHBondContact O-N 2.65Å; S86-F90 WeakPolarHBondContact O-CB 3.26Å; S86-F90 PolarHBondContact O-N 2.87Å
87	L	52.2	Low	51.6	Low	36 Å²	36	78.4 Å²	78.4	19%	0.188	44%	0.438	C	S	.	.	H	α-helix	trans	-66.9	-40.1	176.2	-82.9	164.7	0	0	0	111.2	L45 T84 L89 F90 F91	L45-L87 HydrophobicContact CD1-CD2 3.74Å; T84-L87 PolarHBondContact O-N 2.81Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 3.46Å; L87-F90 PolarHBondContact O-N 2.7Å; L87-F91 HydrophobicContact CD2-CD2 4.39Å; L87-F91 HydrophobicContact CD2-CE2 3.96Å; L87-F91 VanDerWaalsContact O-CD2 3.27Å; L87-F91 WeakPolarHBondContact O-CD2 3.3Å; L87-F91 PolarHBondContact O-N 2.83Å
88	R	51.3	Low	52	Low	100 Å²	100	83.7 Å²	83.7	38%	0.377	45%	0.454	S	S	.	.	H	α-helix	trans	-61	-44.7	175.6	-62.8	-176.8	-174.9	-140.2	2	111.1	F79 S81 S83 T84 L85 S92	F79-R88 HydrophobicContact CD1-CG 4.07Å; F79-R88 HydrophobicContact CE1-CB 4.42Å; F79-R88 HydrophobicContact CE1-CG 4.24Å; F79-R88 HydrophobicContact CG-CG 4.42Å; S81-R88 PolarHBondContact O-NH2 2.81Å; S83-R88 PolarHBondContact O-NE 3.29Å; T84-R88 PolarHBondContact O-N 2.92Å; L85-R88 PolarHBondContact O-N 3.14Å; R88-S92 VanDerWaalsContact O-CB 3.23Å; R88-S92 WeakPolarHBondContact O-CB 3.5Å; R88-S92 PolarHBondContact O-N 3.37Å; R88-S92 PolarHBondContact O-OG 2.88Å
89	L	56.8	Low	52.4	Low	110 Å²	110	81.2 Å²	81.2	58%	0.576	44%	0.439	S	S	*	.	H	α-helix	trans	-64.8	-41.8	176.2	-70.3	174.1	0	0	0	112.4	L85 S86 L87 F93	L85-L89 HydrophobicContact CD2-CD1 3.63Å; L85-L89 HydrophobicContact CD2-CG 4.33Å; L85-L89 VanDerWaalsContact O-CG 3.31Å; L85-L89 WeakPolarHBondContact O-CG 3.34Å; L85-L89 PolarHBondContact O-N 2.63Å; S86-L89 PolarHBondContact O-N 2.65Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 3.46Å; L89-F93 WeakPolarHBondContact O-CB 3.48Å; L89-F93 PolarHBondContact O-N 3.42Å
90	F	59.7	Low	52.5	Low	71 Å²	71	85.3 Å²	85.3	31%	0.311	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-52.7	178.6	179.2	-99.3	0	0	0	111.8	S86 L87 F93 I94	S86-F90 WeakPolarHBondContact O-CB 3.26Å; S86-F90 PolarHBondContact O-N 2.87Å; L87-F90 PolarHBondContact O-N 2.7Å; F90-F93 PolarHBondContact O-N 3.46Å; F90-I94 HydrophobicContact CD1-CG1 4.33Å; F90-I94 HydrophobicContact CE1-CD1 4.5Å; F90-I94 HydrophobicContact CE1-CG1 3.97Å; F90-I94 HydrophobicContact CZ-CD1 4.17Å; F90-I94 HydrophobicContact CZ-CG1 4.09Å; F90-I94 WeakPolarHBondContact O-CG1 3.43Å; F90-I94 PolarHBondContact O-N 2.89Å
91	F	57	Low	52.9	Low	54 Å²	54	85.9 Å²	85.9	24%	0.237	46%	0.459	C	S	.	.	H	α-helix	trans	-68.4	-38.2	179.8	-81.9	-72.1	0	0	0	112	F79 L87 F93 I94 I95	F79-F91 HydrophobicContact CE1-CB 3.56Å; F79-F91 AromaticContact CE1-CD2 3.75Å; F79-F91 HydrophobicContact CE1-CD2 3.75Å; F79-F91 AromaticContact CE1-CG 3.95Å; F79-F91 HydrophobicContact CE1-CG 3.95Å; F79-F91 HydrophobicContact CE2-CB 4.47Å; F79-F91 HydrophobicContact CZ-CB 3.28Å; F79-F91 HydrophobicContact CZ-CD2 4.38Å; F79-F91 HydrophobicContact CZ-CG 4.13Å; L87-F91 HydrophobicContact CD2-CD2 4.39Å; L87-F91 HydrophobicContact CD2-CE2 3.96Å; L87-F91 VanDerWaalsContact O-CD2 3.27Å; L87-F91 WeakPolarHBondContact O-CD2 3.3Å; L87-F91 PolarHBondContact O-N 2.83Å; F91-F93 PolarHBondContact O-N 3.19Å; F91-I94 PolarHBondContact O-N 2.97Å; F91-I95 WeakPolarHBondContact O-CD1 3.26Å; F91-I95 WeakPolarHBondContact O-CG1 3.29Å; F91-I95 PolarHBondContact O-N 3.49Å
92	S	59.3	Low	53.2	Low	52 Å²	52	89.5 Å²	89.5	36%	0.364	46%	0.461	S	S	.	.	H	α-helix	trans	-57.1	-39.1	171.8	-72.2	0	0	0	0	112	R88 I95 I96	R88-S92 VanDerWaalsContact O-CB 3.23Å; R88-S92 WeakPolarHBondContact O-CB 3.5Å; R88-S92 PolarHBondContact O-N 3.37Å; R88-S92 PolarHBondContact O-OG 2.88Å; S92-I95 PolarHBondContact O-N 2.95Å; S92-I96 VanDerWaalsContact O-CG1 3.27Å; S92-I96 WeakPolarHBondContact O-CG1 3.37Å; S92-I96 PolarHBondContact O-N 3.03Å
93	F	58.2	Low	53	Low	101 Å²	101	88.6 Å²	88.6	44%	0.443	46%	0.455	S	S	.	.	H	α-helix	trans	-72.7	-38.9	178.3	-170.6	-107.8	0	0	0	112.8	L89 F90 F91 I95 I96 I97	L89-F93 WeakPolarHBondContact O-CB 3.48Å; L89-F93 PolarHBondContact O-N 3.42Å; F90-F93 PolarHBondContact O-N 3.46Å; F91-F93 PolarHBondContact O-N 3.19Å; F93-I95 VanDerWaalsContact C-N 3.33Å; F93-I95 PolarHBondContact O-N 2.88Å; F93-I96 PolarHBondContact O-N 3.11Å; F93-I97 HydrophobicContact CD1-CD1 3.64Å; F93-I97 HydrophobicContact CD1-CG1 4.46Å; F93-I97 HydrophobicContact CE1-CD1 3.2Å; F93-I97 HydrophobicContact CE1-CG1 4.17Å; F93-I97 HydrophobicContact CG-CD1 4.47Å; F93-I97 HydrophobicContact CZ-CD1 3.69Å; F93-I97 HydrophobicContact CZ-CG1 4.29Å; F93-I97 PolarHBondContact O-N 3.27Å
94	I	60.9	Low	52.8	Low	59 Å²	59	92.1 Å²	92.1	30%	0.303	48%	0.477	S	S	.	.	H	α-helix	trans	-59.5	-45.3	171.8	-66.9	-70.4	0	0	0	110.3	F90 F91 I96 I97 Y98	F90-I94 HydrophobicContact CD1-CG1 4.33Å; F90-I94 HydrophobicContact CE1-CD1 4.5Å; F90-I94 HydrophobicContact CE1-CG1 3.97Å; F90-I94 HydrophobicContact CZ-CD1 4.17Å; F90-I94 HydrophobicContact CZ-CG1 4.09Å; F90-I94 WeakPolarHBondContact O-CG1 3.43Å; F90-I94 PolarHBondContact O-N 2.89Å; F91-I94 PolarHBondContact O-N 2.97Å; I94-I96 VanDerWaalsContact C-N 3.34Å; I94-I96 PolarHBondContact O-N 2.88Å; I94-I97 PolarHBondContact O-N 2.86Å; I94-Y98 HydrophobicContact CG2-CD2 3.74Å; I94-Y98 HydrophobicContact CG2-CE2 4.05Å; I94-Y98 WeakPolarHBondContact O-CB 3.3Å; I94-Y98 VanDerWaalsContact O-CD2 3.3Å; I94-Y98 WeakPolarHBondContact O-CD2 3.3Å; I94-Y98 PolarHBondContact O-N 3.49Å
95	I	60	Low	52.3	Low	40 Å²	40	94.4 Å²	94.4	21%	0.205	49%	0.486	C	S	.	.	H	α-helix	trans	-58.3	-47.3	174.7	-62	161	0	0	0	109.7	I75 V77 F91 S92 F93 I97 Y98 T99	I75-I95 HydrophobicContact CG2-CG1 4.26Å; V77-I95 HydrophobicContact CB-CD1 3.81Å; V77-I95 HydrophobicContact CG2-CD1 3.23Å; V77-I95 HydrophobicContact CG2-CG1 3.67Å; F91-I95 WeakPolarHBondContact O-CD1 3.26Å; F91-I95 WeakPolarHBondContact O-CG1 3.29Å; F91-I95 PolarHBondContact O-N 3.49Å; S92-I95 PolarHBondContact O-N 2.95Å; F93-I95 VanDerWaalsContact C-N 3.33Å; F93-I95 PolarHBondContact O-N 2.88Å; I95-I97 VanDerWaalsContact C-N 3.34Å; I95-I97 PolarHBondContact O-N 3.46Å; I95-Y98 PolarHBondContact O-N 3.34Å; I95-T99 VanDerWaalsContact CG2-OG1 3.28Å; I95-T99 WeakPolarHBondContact CG2-OG1 3.38Å; I95-T99 WeakPolarHBondContact O-CA 3.4Å; I95-T99 WeakPolarHBondContact O-CB 3.27Å; I95-T99 PolarHBondContact O-N 3.36Å; I95-T99 PolarHBondContact O-OG1 3.26Å
96	I	59.5	Low	51.7	Low	96 Å²	96	93.3 Å²	93.3	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-59.1	-44	179.8	-67.8	165.2	0	0	0	111.8	S92 F93 I94 F100	S92-I96 VanDerWaalsContact O-CG1 3.27Å; S92-I96 WeakPolarHBondContact O-CG1 3.37Å; S92-I96 PolarHBondContact O-N 3.03Å; F93-I96 PolarHBondContact O-N 3.11Å; I94-I96 VanDerWaalsContact C-N 3.34Å; I94-I96 PolarHBondContact O-N 2.88Å; I96-F100 HydrophobicContact CG2-CD2 4.43Å; I96-F100 WeakPolarHBondContact O-CB 3.4Å; I96-F100 WeakPolarHBondContact O-CD2 3.22Å; I96-F100 PolarHBondContact O-N 2.74Å; I96-F100 VanDerWaalsContact O-N 3.14Å
97	I	58.9	Low	51.4	Low	84 Å²	84	95.4 Å²	95.4	43%	0.431	50%	0.498	S	S	.	.	H	α-helix	trans	-67	-41	178.9	-68	170.9	0	0	0	111.7	F93 I94 I95 F100	F93-I97 HydrophobicContact CD1-CD1 3.64Å; F93-I97 HydrophobicContact CD1-CG1 4.46Å; F93-I97 HydrophobicContact CE1-CD1 3.2Å; F93-I97 HydrophobicContact CE1-CG1 4.17Å; F93-I97 HydrophobicContact CG-CD1 4.47Å; F93-I97 HydrophobicContact CZ-CD1 3.69Å; F93-I97 HydrophobicContact CZ-CG1 4.29Å; F93-I97 PolarHBondContact O-N 3.27Å; I94-I97 PolarHBondContact O-N 2.86Å; I95-I97 VanDerWaalsContact C-N 3.34Å; I95-I97 PolarHBondContact O-N 3.46Å; I97-F100 CarbonylContact O-C 3.52Å
98	Y	52.6	Low	50.6	Low	161 Å²	161	107.2 Å²	107.2	63%	0.631	55%	0.548	S	S	*	.	H	α-helix	trans	-84.1	-29.3	-176.1	-84.1	-94.5	0	0	0	113.6	I94 I95 P101	I94-Y98 HydrophobicContact CG2-CD2 3.74Å; I94-Y98 HydrophobicContact CG2-CE2 4.05Å; I94-Y98 WeakPolarHBondContact O-CB 3.3Å; I94-Y98 VanDerWaalsContact O-CD2 3.3Å; I94-Y98 WeakPolarHBondContact O-CD2 3.3Å; I94-Y98 PolarHBondContact O-N 3.49Å; I95-Y98 PolarHBondContact O-N 3.34Å; Y98-P101 WeakPolarHBondContact O-CD 3.48Å
99	T	49.3	Very low	50.6	Low	67 Å²	67	107.6 Å²	107.6	41%	0.411	56%	0.556	S	S	.	*	H	α-helix	trans	-78.4	-26.1	176.4	-59.7	0	0	0	0	111.7	I95 P101	I95-T99 VanDerWaalsContact CG2-OG1 3.28Å; I95-T99 WeakPolarHBondContact CG2-OG1 3.38Å; I95-T99 WeakPolarHBondContact O-CA 3.4Å; I95-T99 WeakPolarHBondContact O-CB 3.27Å; I95-T99 PolarHBondContact O-N 3.36Å; I95-T99 PolarHBondContact O-OG1 3.26Å; T99-P101 WeakPolarHBondContact O-CD 3.42Å
100	F	45.5	Very low	50.2	Low	146 Å²	146	107.5 Å²	107.5	64%	0.64	56%	0.555	S	S	*	*	S	Bend	trans	-106.9	72.7	167.4	-67.8	-86	0	0	0	109.8	I96 I97 F102	I96-F100 HydrophobicContact CG2-CD2 4.43Å; I96-F100 WeakPolarHBondContact O-CB 3.4Å; I96-F100 WeakPolarHBondContact O-CD2 3.22Å; I96-F100 PolarHBondContact O-N 2.74Å; I96-F100 VanDerWaalsContact O-N 3.14Å; I97-F100 CarbonylContact O-C 3.52Å; F100-F102 PolarHBondContact O-N 2.84Å
101	P	46.2	Very low	49.7	Very low	98 Å²	98	109.5 Å²	109.5	64%	0.636	57%	0.569	S	S	*	*			trans	-60.7	115.8	163.3	28.2	-29.5	0	0	0	105.4	Y98 T99 S103	Y98-P101 WeakPolarHBondContact O-CD 3.48Å; T99-P101 WeakPolarHBondContact O-CD 3.42Å; P101-S103 PolarHBondContact O-N 3.37Å
102	F	46.4	Very low	49.3	Very low	184 Å²	184	112.8 Å²	112.8	81%	0.807	59%	0.588	S	S	*	*			trans	-47.6	107	173.1	-80.3	-92.6	0	0	0	107.6	F100 P104	F100-F102 PolarHBondContact O-N 2.84Å; F102-P104 WeakPolarHBondContact O-CD 3.44Å
103	S	39.9	Very low	48.7	Very low	99 Å²	99	116.6 Å²	116.6	69%	0.692	60%	0.602	S	S	*	*			trans	-54.2	117.6	178.5	-178.2	0	0	0	0	106.9	P101 N105	P101-S103 PolarHBondContact O-N 3.37Å; S103-N105 PolarHBondContact O-N 3.16Å
104	P	42.7	Very low	48	Very low	107 Å²	107	117.6 Å²	117.6	70%	0.695	61%	0.613	S	S	*	*			trans	-62	111.7	175.2	24.3	-30.1	0	0	0	106	F102 P106	F102-P104 WeakPolarHBondContact O-CD 3.44Å; P104-P106 WeakPolarHBondContact O-CD 3.28Å
105	N	42	Very low	47.1	Very low	130 Å²	130	121.8 Å²	121.8	70%	0.695	64%	0.635	S	S	*	*			trans	-46.1	110.6	-179.5	-176	5.2	0	0	0	109.8	S103 T107	S103-N105 PolarHBondContact O-N 3.16Å; N105-T107 VanDerWaalsContact C-N 3.33Å; N105-T107 PolarHBondContact O-N 3.2Å; N105-T107 VanDerWaalsContact O-N 3.15Å; N105-T107 PolarHBondContact OD1-OG1 2.9Å
106	P	35.7	Very low	46.1	Very low	112 Å²	112	128.1 Å²	128.1	73%	0.727	67%	0.668	S	S	*	*			trans	-91.1	71	-176.5	35.1	-29.9	0	0	0	109.4	P104	P104-P106 WeakPolarHBondContact O-CD 3.28Å
107	T	44.7	Very low	45	Very low	97 Å²	97	130.8 Å²	130.8	60%	0.595	68%	0.683	S	S	*	*			trans	-153.2	109.9	167.9	36.9	0	0	0	0	105.9	N105	N105-T107 VanDerWaalsContact C-N 3.33Å; N105-T107 PolarHBondContact O-N 3.2Å; N105-T107 VanDerWaalsContact O-N 3.15Å; N105-T107 PolarHBondContact OD1-OG1 2.9Å
108	K	36	Very low	43.7	Very low	284 Å²	284	135 Å²	135	100%	1.235	71%	0.706	S	S	*	*				37	0	53.9	-85	-161.9	-177.5	-179.1	0	113.7

Retrieved 108 of 108 residues in 147 ms (Link to these results)

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