A0A077Z7D4_TRITR Loading...

PGM PMM I domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7D4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 74 aa.

						>A0A077Z7D4_TRITR|A0A077Z7D4
MQEHYAVNFIQCILGAGLKEKKKGAALIIGGDGRNLSDIVFQRIFGIAGANGVEFFNFLLRSGSYRAALFVLVI
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61.9	Low	84.4	Confident	200 Å²	200	100.8 Å²	100.8	99%	0.985	48%	0.483	S	S	*	.				0	125.8	0	-178.8	175.5	-90.8	0	0	106.8	E3	M1-E3 PolarHBondContact O-N 3.12Å
2	Q	77.7	Confident	85.1	Confident	146 Å²	146	99.6 Å²	99.6	68%	0.682	49%	0.491	S	S	*	.			trans	-64.3	132.2	178.3	-79.1	168.9	40.9	0	0	109.7	H4 Y5	Q2-H4 PolarHBondContact O-N 2.94Å; Q2-Y5 PolarHBondContact O-N 3.38Å
3	E	78.5	Confident	85.6	Confident	163 Å²	163	95.9 Å²	95.9	76%	0.762	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	130.2	175.6	-157.2	175.4	-177.4	0	0	108.6	M1 Y5	M1-E3 PolarHBondContact O-N 3.12Å; E3-Y5 VanDerWaalsContact C-N 3.3Å; E3-Y5 PolarHBondContact O-N 3.4Å
4	H	87.4	Confident	85.9	Confident	109 Å²	109	89.1 Å²	89.1	51%	0.505	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	6.6	-176.5	-43.4	-62	0	0	0	118.1	Q2 A6 V7 N8	Q2-H4 PolarHBondContact O-N 2.94Å; H4-A6 PolarHBondContact O-N 3.33Å; H4-V7 HydrophobicContact CB-CB 4.48Å; H4-V7 PolarHBondContact O-N 3.46Å; H4-V7 VanDerWaalsContact O-N 3.13Å; H4-N8 WeakPolarHBondContact O-CB 3.26Å; H4-N8 VanDerWaalsContact O-CG 3.29Å; H4-N8 PolarHBondContact O-N 3.04Å
5	Y	86.6	Confident	86.2	Confident	139 Å²	139	85 Å²	85	55%	0.545	43%	0.43	S	S	.	.	H	α-helix	trans	-53.5	-52.5	-179.8	-178.5	-92.8	0	0	0	113.4	Q2 E3 V7 N8 F9	Q2-Y5 PolarHBondContact O-N 3.38Å; E3-Y5 VanDerWaalsContact C-N 3.3Å; E3-Y5 PolarHBondContact O-N 3.4Å; Y5-V7 VanDerWaalsContact C-N 3.3Å; Y5-V7 PolarHBondContact O-N 2.97Å; Y5-N8 PolarHBondContact O-N 3.05Å; Y5-F9 WeakPolarHBondContact O-CB 3.24Å; Y5-F9 PolarHBondContact O-N 3.18Å
6	A	84.9	Confident	86.5	Confident	23 Å²	23	84.2 Å²	84.2	19%	0.19	44%	0.44	C	S	.	.	H	α-helix	trans	-62.6	-39.3	-179.7	0	0	0	0	0	111.9	H4 F9 I10	H4-A6 PolarHBondContact O-N 3.33Å; A6-F9 PolarHBondContact O-N 3.37Å; A6-I10 VanDerWaalsContact O-CD1 3.3Å; A6-I10 WeakPolarHBondContact O-CD1 3.47Å; A6-I10 WeakPolarHBondContact O-CG1 3.42Å; A6-I10 PolarHBondContact O-N 2.99Å
7	V	88.8	Confident	86.7	Confident	47 Å²	47	81.8 Å²	81.8	29%	0.285	44%	0.441	S	S	.	.	H	α-helix	trans	-65.4	-48.7	-179.3	175	0	0	0	0	110.3	H4 Y5 F9 I10 Q11 I47	H4-V7 HydrophobicContact CB-CB 4.48Å; H4-V7 PolarHBondContact O-N 3.46Å; H4-V7 VanDerWaalsContact O-N 3.13Å; Y5-V7 VanDerWaalsContact C-N 3.3Å; Y5-V7 PolarHBondContact O-N 2.97Å; V7-F9 VanDerWaalsContact C-N 3.32Å; V7-F9 PolarHBondContact O-N 3.24Å; V7-I10 PolarHBondContact O-N 3.22Å; V7-Q11 WeakPolarHBondContact O-CB 3.34Å; V7-Q11 PolarHBondContact O-N 3.44Å; V7-I47 HydrophobicContact CB-CD1 3.89Å; V7-I47 HydrophobicContact CG1-CD1 3.59Å; V7-I47 HydrophobicContact CG1-CG1 4.14Å; V7-I47 HydrophobicContact CG2-CD1 4.06Å
8	N	91.8	Very high	86.8	Confident	96 Å²	96	78.2 Å²	78.2	51%	0.513	42%	0.421	S	S	.	.	H	α-helix	trans	-63	-41.3	178.3	-68.2	-9.1	0	0	0	111.1	H4 Y5 Q11 C12	H4-N8 WeakPolarHBondContact O-CB 3.26Å; H4-N8 VanDerWaalsContact O-CG 3.29Å; H4-N8 PolarHBondContact O-N 3.04Å; Y5-N8 PolarHBondContact O-N 3.05Å; N8-Q11 PolarHBondContact O-N 2.83Å; N8-C12 WeakPolarHBondContact O-CB 3.47Å; N8-C12 PolarHBondContact O-N 3.29Å; N8-C12 PolarHBondContact O-SG 3.25Å
9	F	90.1	Very high	86.9	Confident	101 Å²	101	81.5 Å²	81.5	44%	0.443	43%	0.431	S	S	.	.	H	α-helix	trans	-59.3	-50.1	175.7	-179.1	-102.8	0	0	0	111.6	Y5 A6 V7 Q11 C12 I13	Y5-F9 WeakPolarHBondContact O-CB 3.24Å; Y5-F9 PolarHBondContact O-N 3.18Å; A6-F9 PolarHBondContact O-N 3.37Å; V7-F9 VanDerWaalsContact C-N 3.32Å; V7-F9 PolarHBondContact O-N 3.24Å; F9-Q11 VanDerWaalsContact C-N 3.3Å; F9-Q11 PolarHBondContact O-N 3.22Å; F9-C12 PolarHBondContact O-N 3.25Å; F9-I13 HydrophobicContact CD1-CG1 4.24Å; F9-I13 HydrophobicContact CD2-CG1 4.48Å; F9-I13 HydrophobicContact CE1-CD1 4.44Å; F9-I13 HydrophobicContact CE1-CG1 3.87Å; F9-I13 HydrophobicContact CE2-CD1 4.19Å; F9-I13 HydrophobicContact CE2-CG1 4.13Å; F9-I13 HydrophobicContact CZ-CD1 3.92Å; F9-I13 HydrophobicContact CZ-CG1 3.81Å; F9-I13 VanDerWaalsContact O-CG1 3.27Å; F9-I13 WeakPolarHBondContact O-CG1 3.4Å; F9-I13 PolarHBondContact O-N 2.79Å
10	I	90	Very high	87	Confident	10 Å²	10	86.5 Å²	86.5	5%	0.051	45%	0.452	C	S	.	.	H	α-helix	trans	-59.1	-43.6	177.5	-65.6	159.7	0	0	0	110.5	A6 V7 C12 I13 L14 R43 I44 I47	A6-I10 VanDerWaalsContact O-CD1 3.3Å; A6-I10 WeakPolarHBondContact O-CD1 3.47Å; A6-I10 WeakPolarHBondContact O-CG1 3.42Å; A6-I10 PolarHBondContact O-N 2.99Å; V7-I10 PolarHBondContact O-N 3.22Å; I10-C12 PolarHBondContact O-N 3.22Å; I10-I13 PolarHBondContact O-N 3.23Å; I10-L14 HydrophobicContact CG2-CD1 3.94Å; I10-L14 HydrophobicContact CG2-CG 4.37Å; I10-L14 WeakPolarHBondContact O-CG 3.4Å; I10-L14 PolarHBondContact O-N 2.99Å; I10-R43 HydrophobicContact CD1-CB 4.04Å; I10-I44 HydrophobicContact CD1-CB 4.4Å; I10-I44 HydrophobicContact CD1-CG1 3.5Å; I10-I44 HydrophobicContact CG1-CG1 3.87Å; I10-I44 HydrophobicContact CG2-CG1 4.42Å; I10-I47 HydrophobicContact CB-CD1 3.85Å; I10-I47 HydrophobicContact CD1-CD1 3.83Å; I10-I47 HydrophobicContact CG1-CD1 4.46Å; I10-I47 HydrophobicContact CG2-CB 3.97Å; I10-I47 HydrophobicContact CG2-CD1 3.93Å; I10-I47 HydrophobicContact CG2-CG2 3.89Å
11	Q	91	Very high	87.1	Confident	75 Å²	75	90.6 Å²	90.6	35%	0.35	47%	0.466	S	S	.	.	H	α-helix	trans	-63	-42.1	178.7	-170.5	65.3	5.9	0	0	112.3	V7 N8 F9 L14 G15 I47 N51	V7-Q11 WeakPolarHBondContact O-CB 3.34Å; V7-Q11 PolarHBondContact O-N 3.44Å; N8-Q11 PolarHBondContact O-N 2.83Å; F9-Q11 VanDerWaalsContact C-N 3.3Å; F9-Q11 PolarHBondContact O-N 3.22Å; Q11-L14 PolarHBondContact O-N 2.82Å; Q11-G15 PolarHBondContact O-N 2.91Å; Q11-I47 HydrophobicContact CB-CG2 4.47Å; Q11-N51 PolarHBondContact NE2-OD1 2.98Å; Q11-N51 PolarHBondContact OE1-ND2 3.25Å
12	C	92.4	Very high	88.3	Confident	86 Å²	86	82.9 Å²	82.9	58%	0.581	43%	0.427	S	S	*	.	H	α-helix	trans	-62.1	-43.6	174.8	-73	0	0	0	0	111.4	N8 F9 I10 G15 A16	N8-C12 WeakPolarHBondContact O-CB 3.47Å; N8-C12 PolarHBondContact O-N 3.29Å; N8-C12 PolarHBondContact O-SG 3.25Å; F9-C12 PolarHBondContact O-N 3.25Å; I10-C12 PolarHBondContact O-N 3.22Å; C12-G15 PolarHBondContact O-N 3.41Å; C12-A16 VanDerWaalsContact O-CB 3.32Å; C12-A16 WeakPolarHBondContact O-CB 3.18Å; C12-A16 PolarHBondContact O-N 2.99Å
13	I	91.3	Very high	88.9	Confident	52 Å²	52	84.2 Å²	84.2	27%	0.267	43%	0.431	S	S	.	.	H	α-helix	trans	-64	-46.3	179	-68.4	-66.1	0	0	0	111	F9 I10 G15 A16 G17 L69 V71	F9-I13 HydrophobicContact CD1-CG1 4.24Å; F9-I13 HydrophobicContact CD2-CG1 4.48Å; F9-I13 HydrophobicContact CE1-CD1 4.44Å; F9-I13 HydrophobicContact CE1-CG1 3.87Å; F9-I13 HydrophobicContact CE2-CD1 4.19Å; F9-I13 HydrophobicContact CE2-CG1 4.13Å; F9-I13 HydrophobicContact CZ-CD1 3.92Å; F9-I13 HydrophobicContact CZ-CG1 3.81Å; F9-I13 VanDerWaalsContact O-CG1 3.27Å; F9-I13 WeakPolarHBondContact O-CG1 3.4Å; F9-I13 PolarHBondContact O-N 2.79Å; I10-I13 PolarHBondContact O-N 3.23Å; I13-G15 PolarHBondContact O-N 3.24Å; I13-A16 PolarHBondContact O-N 2.79Å; I13-G17 PolarHBondContact O-N 3.47Å; I13-L69 HydrophobicContact CG2-CD1 4.43Å; I13-L69 HydrophobicContact CG2-CD2 3.65Å; I13-L69 HydrophobicContact CG2-CG 4.24Å; I13-V71 HydrophobicContact CG2-CG2 3.85Å
14	L	90.7	Very high	89.5	Confident	1 Å²	1	78 Å²	78	1%	0.005	41%	0.411	C	S	.	.	H	α-helix	trans	-63.6	-40.8	175.2	-67.5	171.2	0	0	0	111.9	I10 Q11 L18 K19 K22 L27 I47 A48 N51 V53 L69	I10-L14 HydrophobicContact CG2-CD1 3.94Å; I10-L14 HydrophobicContact CG2-CG 4.37Å; I10-L14 WeakPolarHBondContact O-CG 3.4Å; I10-L14 PolarHBondContact O-N 2.99Å; Q11-L14 PolarHBondContact O-N 2.82Å; L14-L18 HydrophobicContact CD2-CD1 4.01Å; L14-L18 WeakPolarHBondContact O-CB 3.31Å; L14-L18 PolarHBondContact O-N 3.04Å; L14-K19 PolarHBondContact O-N 3.01Å; L14-K22 WeakPolarHBondContact O-CE 3.2Å; L14-L27 HydrophobicContact CD2-CD1 4.31Å; L14-L27 HydrophobicContact CD2-CD2 4.39Å; L14-I47 HydrophobicContact CD1-CG2 3.91Å; L14-A48 HydrophobicContact CD1-CB 4.03Å; L14-A48 HydrophobicContact CD2-CB 4.36Å; L14-N51 HydrophobicContact CD1-CB 4.48Å; L14-V53 HydrophobicContact CD2-CG2 4.43Å; L14-L69 HydrophobicContact CD2-CD2 4.29Å
15	G	90.7	Very high	89.6	Confident	27 Å²	27	73.4 Å²	73.4	28%	0.278	39%	0.391	S	S	.	.	H	α-helix	trans	-62.8	-46.8	177.1	0	0	0	0	0	112.8	Q11 C12 I13 K19	Q11-G15 PolarHBondContact O-N 2.91Å; C12-G15 PolarHBondContact O-N 3.41Å; I13-G15 PolarHBondContact O-N 3.24Å; G15-K19 WeakPolarHBondContact O-CA 3.31Å; G15-K19 VanDerWaalsContact O-CG 3.26Å; G15-K19 WeakPolarHBondContact O-CG 2.9Å; G15-K19 PolarHBondContact O-N 3.44Å
16	A	91.1	Very high	89.8	Confident	72 Å²	72	68 Å²	68	60%	0.595	38%	0.376	S	S	*	.	H	α-helix	trans	-73.2	-43.5	-179.5	0	0	0	0	0	112.5	C12 I13	C12-A16 VanDerWaalsContact O-CB 3.32Å; C12-A16 WeakPolarHBondContact O-CB 3.18Å; C12-A16 PolarHBondContact O-N 2.99Å; I13-A16 PolarHBondContact O-N 2.79Å
17	G	89.1	Confident	90	Very high	44 Å²	44	67 Å²	67	45%	0.454	37%	0.367	S	S	.	.	H	α-helix	trans	-78.5	-47.5	-173.2	0	0	0	0	0	114.1	I13	I13-G17 PolarHBondContact O-N 3.47Å
18	L	88.2	Confident	89.9	Confident	16 Å²	16	65.2 Å²	65.2	8%	0.084	36%	0.356	C	S	.	.	H	α-helix	trans	-99.5	-27.6	-175.1	-65	174	0	0	0	113.1	L14 E20 K21 K22 A25 V53 L69	L14-L18 HydrophobicContact CD2-CD1 4.01Å; L14-L18 WeakPolarHBondContact O-CB 3.31Å; L14-L18 PolarHBondContact O-N 3.04Å; L18-E20 PolarHBondContact O-N 3.46Å; L18-K21 WeakPolarHBondContact O-CA 3.33Å; L18-K21 VanDerWaalsContact O-CB 3.31Å; L18-K21 WeakPolarHBondContact O-CB 3.49Å; L18-K21 PolarHBondContact O-N 2.9Å; L18-K22 HydrophobicContact CB-CB 4.42Å; L18-K22 HydrophobicContact CB-CG 3.59Å; L18-K22 HydrophobicContact CD1-CG 4.32Å; L18-A25 HydrophobicContact CD1-CB 3.88Å; L18-A25 HydrophobicContact CD2-CB 4.16Å; L18-V53 HydrophobicContact CD1-CG2 4.11Å; L18-L69 HydrophobicContact CD2-CB 4.44Å; L18-L69 HydrophobicContact CG-CB 4.45Å; L18-L69 HydrophobicContact CG-CD2 4.32Å
19	K	88.5	Confident	89.7	Confident	142 Å²	142	60.7 Å²	60.7	62%	0.617	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	50	-121	-177.6	-59.9	-179.3	-179.8	-176.8	0	111.4	L14 G15 K21 K22	L14-K19 PolarHBondContact O-N 3.01Å; G15-K19 WeakPolarHBondContact O-CA 3.31Å; G15-K19 VanDerWaalsContact O-CG 3.26Å; G15-K19 WeakPolarHBondContact O-CG 2.9Å; G15-K19 PolarHBondContact O-N 3.44Å; K19-K21 VanDerWaalsContact C-N 3.28Å; K19-K21 PolarHBondContact O-N 3.43Å; K19-K22 WeakPolarHBondContact O-CD 3.12Å; K19-K22 VanDerWaalsContact O-CE 3.23Å; K19-K22 WeakPolarHBondContact O-CE 3.07Å; K19-K22 WeakPolarHBondContact O-CG 3.11Å
20	E	89.8	Confident	89.4	Confident	181 Å²	181	56.1 Å²	56.1	85%	0.846	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-75.1	-15.2	176.9	-56.8	-51.7	139	0	0	113.4	L18 K22	L18-E20 PolarHBondContact O-N 3.46Å; E20-K22 PolarHBondContact O-N 2.89Å
21	K	88.4	Confident	88.9	Confident	172 Å²	172	56.9 Å²	56.9	75%	0.748	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-86.8	22	-177.7	-55.8	-177.4	178.3	-179.4	0	112.9	L18 K19 A25	L18-K21 WeakPolarHBondContact O-CA 3.33Å; L18-K21 VanDerWaalsContact O-CB 3.31Å; L18-K21 WeakPolarHBondContact O-CB 3.49Å; L18-K21 PolarHBondContact O-N 2.9Å; K19-K21 VanDerWaalsContact C-N 3.28Å; K19-K21 PolarHBondContact O-N 3.43Å; K21-A25 WeakPolarHBondContact O-CB 3.23Å
22	K	88.7	Confident	88.5	Confident	39 Å²	39	57.4 Å²	57.4	17%	0.17	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-71.2	-38.6	179.2	-68.1	159.3	177.7	-169.2	0	112.1	L14 L18 K19 E20 G24 A25 N51 G52 V53	L14-K22 WeakPolarHBondContact O-CE 3.2Å; L18-K22 HydrophobicContact CB-CB 4.42Å; L18-K22 HydrophobicContact CB-CG 3.59Å; L18-K22 HydrophobicContact CD1-CG 4.32Å; K19-K22 WeakPolarHBondContact O-CD 3.12Å; K19-K22 VanDerWaalsContact O-CE 3.23Å; K19-K22 WeakPolarHBondContact O-CE 3.07Å; K19-K22 WeakPolarHBondContact O-CG 3.11Å; E20-K22 PolarHBondContact O-N 2.89Å; K22-G24 PolarHBondContact O-N 2.84Å; K22-A25 WeakPolarHBondContact O-CB 3.36Å; K22-A25 PolarHBondContact O-N 3.44Å; K22-A25 VanDerWaalsContact O-N 3.12Å; K22-N51 VanDerWaalsContact CB-O 3.24Å; K22-N51 WeakPolarHBondContact CB-O 3.44Å; K22-N51 HydrophobicContact CD-CB 4.11Å; K22-N51 PolarHBondContact NZ-OD1 3.04Å; K22-G52 CarbonylContact O-C 3.57Å; K22-G52 VanDerWaalsContact O-C 3.32Å; K22-G52 VanDerWaalsContact O-O 3.08Å; K22-V53 PolarHBondContact O-N 3.46Å
23	K	89.9	Confident	87.6	Confident	173 Å²	173	56.4 Å²	56.4	75%	0.752	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	122.6	-177.7	-167.7	174.5	-178.8	178.6	0	110.7	A25 G52	K23-A25 PolarHBondContact O-N 3.25Å; K23-G52 CarbonylContact C-O 3.53Å; K23-G52 VanDerWaalsContact CA-O 3.26Å; K23-G52 WeakPolarHBondContact CA-O 3.33Å
24	G	89.9	Confident	86.8	Confident	34 Å²	34	61 Å²	61	35%	0.351	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	10.9	-175.5	0	0	0	0	0	114.2	K22 G52	K22-G24 PolarHBondContact O-N 2.84Å; G24-G52 PolarHBondContact N-O 3.03Å
25	A	90.7	Very high	86	Confident	11 Å²	11	68.5 Å²	68.5	9%	0.091	39%	0.387	C	S	.	.			trans	-70	156.8	177.4	0	0	0	0	0	111.9	L18 K21 K22 K23 V53 E54 F55	L18-A25 HydrophobicContact CD1-CB 3.88Å; L18-A25 HydrophobicContact CD2-CB 4.16Å; K21-A25 WeakPolarHBondContact O-CB 3.23Å; K22-A25 WeakPolarHBondContact O-CB 3.36Å; K22-A25 PolarHBondContact O-N 3.44Å; K22-A25 VanDerWaalsContact O-N 3.12Å; K23-A25 PolarHBondContact O-N 3.25Å; A25-V53 HydrophobicContact CB-CG2 4.4Å; A25-V53 WeakPolarHBondContact O-CG1 3.46Å; A25-E54 PolarHBondContact O-N 2.99Å; A25-F55 PolarHBondContact O-N 2.68Å
26	A	89.5	Confident	85.4	Confident	26 Å²	26	72 Å²	72	22%	0.215	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.4	164.2	0	0	0	0	0	110.3	F55	A26-F55 CarbonylContact C-O 3.55Å; A26-F55 VanDerWaalsContact CA-O 3.31Å; A26-F55 WeakPolarHBondContact CA-O 3.35Å; A26-F55 HydrophobicContact CB-CB 3.9Å
27	L	89.4	Confident	85	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.4	174	-171	66.8	0	0	0	109.8	L14 I29 I44 A48 V53 F55 F56 N57 L69 V71	L14-L27 HydrophobicContact CD2-CD1 4.31Å; L14-L27 HydrophobicContact CD2-CD2 4.39Å; L27-I29 HydrophobicContact CD2-CD1 4.01Å; L27-I29 HydrophobicContact CD2-CG1 3.9Å; L27-I29 HydrophobicContact CG-CD1 4.41Å; L27-I29 HydrophobicContact CG-CG1 3.92Å; L27-I44 HydrophobicContact CD2-CG2 3.62Å; L27-A48 HydrophobicContact CD2-CB 3.89Å; L27-V53 HydrophobicContact CB-CG1 3.76Å; L27-F55 PolarHBondContact N-O 3.3Å; L27-F56 HydrophobicContact CB-CD1 4.14Å; L27-F56 HydrophobicContact CB-CE1 4.29Å; L27-F56 HydrophobicContact CD2-CD1 4.3Å; L27-F56 HydrophobicContact CD2-CE1 4Å; L27-N57 PolarHBondContact O-N 3.33Å; L27-L69 HydrophobicContact CD1-CB 3.81Å; L27-L69 HydrophobicContact CD1-CD2 4.26Å; L27-L69 HydrophobicContact CD1-CG 4.24Å; L27-L69 WeakPolarHBondContact CD1-O 3.49Å; L27-V71 HydrophobicContact CD1-CG2 4.14Å
28	I	87.7	Confident	84.7	Confident	10 Å²	10	72.8 Å²	72.8	5%	0.051	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.7	170.8	-60.8	175.7	0	0	0	108.4	N57 L59 Y65 A68 L69 F70 V71	I28-N57 CarbonylContact C-O 3.52Å; I28-N57 VanDerWaalsContact CA-O 3.27Å; I28-N57 WeakPolarHBondContact CA-O 3.2Å; I28-N57 HydrophobicContact CG1-CB 4.42Å; I28-L59 HydrophobicContact CG2-CB 3.69Å; I28-L59 HydrophobicContact CG2-CD1 4.17Å; I28-L59 HydrophobicContact CG2-CG 4.47Å; I28-Y65 HydrophobicContact CD1-CD1 4.16Å; I28-Y65 HydrophobicContact CD1-CD2 3.07Å; I28-Y65 HydrophobicContact CD1-CE2 3.57Å; I28-Y65 HydrophobicContact CD1-CG 3.41Å; I28-Y65 VanDerWaalsContact CD1-CG 3.41Å; I28-Y65 HydrophobicContact CG1-CD2 4.23Å; I28-Y65 HydrophobicContact CG1-CE2 4.49Å; I28-Y65 HydrophobicContact CG1-CG 4.31Å; I28-A68 HydrophobicContact CB-CB 4.28Å; I28-A68 HydrophobicContact CD1-CB 3.19Å; I28-A68 HydrophobicContact CG1-CB 3.55Å; I28-L69 PolarHBondContact N-O 3.49Å; I28-L69 VanDerWaalsContact O-O 3.09Å; I28-F70 HydrophobicContact CG2-CD2 4.03Å; I28-F70 HydrophobicContact CG2-CE2 4.33Å; I28-V71 PolarHBondContact O-N 2.88Å
29	I	86.7	Confident	84.6	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.005	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.8	-177.4	-59.5	164.2	0	0	0	108.4	L27 F41 I44 F45 F56 N57 F58 L59	L27-I29 HydrophobicContact CD2-CD1 4.01Å; L27-I29 HydrophobicContact CD2-CG1 3.9Å; L27-I29 HydrophobicContact CG-CD1 4.41Å; L27-I29 HydrophobicContact CG-CG1 3.92Å; I29-F41 HydrophobicContact CG2-CD1 3.34Å; I29-F41 HydrophobicContact CG2-CE1 3.39Å; I29-F41 HydrophobicContact CG2-CG 4.42Å; I29-F41 HydrophobicContact CG2-CZ 4.47Å; I29-I44 HydrophobicContact CD1-CB 4.49Å; I29-I44 HydrophobicContact CD1-CG2 3.61Å; I29-I44 HydrophobicContact CG1-CG2 4.01Å; I29-I44 HydrophobicContact CG2-CD1 4.26Å; I29-F45 HydrophobicContact CD1-CD1 3.76Å; I29-F45 HydrophobicContact CD1-CE1 3.25Å; I29-F45 HydrophobicContact CD1-CZ 3.95Å; I29-F56 HydrophobicContact CD1-CD1 3.76Å; I29-F56 HydrophobicContact CD1-CE1 4.4Å; I29-N57 PolarHBondContact N-O 3.46Å; I29-F58 HydrophobicContact CG2-CE2 4.4Å; I29-F58 CarbonylContact O-C 3.32Å; I29-F58 WeakPolarHBondContact O-CA 3.47Å; I29-L59 PolarHBondContact O-N 2.88Å
30	G	84.2	Confident	84.5	Confident	5 Å²	5	70.5 Å²	70.5	5%	0.052	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	150.9	173.6	0	0	0	0	0	110.5	V71 V73	G30-V71 PolarHBondContact N-O 2.64Å; G30-V71 VanDerWaalsContact O-O 3.12Å; G30-V73 PolarHBondContact O-N 3.33Å
31	G	80	Confident	84.5	Confident	27 Å²	27	62.8 Å²	62.8	28%	0.278	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	164	171	0	0	0	0	0	109.1	G33	G31-G33 VanDerWaalsContact C-N 3.29Å
32	D	81.2	Confident	84.6	Confident	85 Å²	85	61.2 Å²	61.2	46%	0.455	34%	0.337	S	S	.	.			trans	-89.2	7.1	-178.2	71.1	-14.7	0	0	0	113.7	R34	D32-R34 WeakPolarHBondContact OD1-CB 3.26Å; D32-R34 WeakPolarHBondContact OD1-CD 3.42Å; D32-R34 WeakPolarHBondContact OD1-CG 3.35Å; D32-R34 PolarHBondContact OD1-N 3.44Å; D32-R34 IonicContact OD1-NE 2.64Å; D32-R34 WeakPolarHBondContact OD2-CD 3.27Å; D32-R34 IonicContact OD2-CZ 3.78Å; D32-R34 IonicContact OD2-NE 3.49Å; D32-R34 PolarHBondContact OD2-NE 3.22Å; D32-R34 IonicContact OD2-NH2 3.18Å; D32-R34 PolarHBondContact OD2-NH2 3.29Å
33	G	75	Confident	84.7	Confident	66 Å²	66	64 Å²	64	68%	0.68	35%	0.347	S	S	*	.			trans	81.1	14.1	175.3	0	0	0	0	0	114.4	G31	G31-G33 VanDerWaalsContact C-N 3.29Å
34	R	73.8	Confident	84.7	Confident	149 Å²	149	55.8 Å²	55.8	56%	0.562	31%	0.311	S	S	*	.			trans	-64.8	165	175.7	-76.3	173.9	-172.7	-174.8	-0.3	113.2	D32 L36 S37 I74	D32-R34 WeakPolarHBondContact OD1-CB 3.26Å; D32-R34 WeakPolarHBondContact OD1-CD 3.42Å; D32-R34 WeakPolarHBondContact OD1-CG 3.35Å; D32-R34 PolarHBondContact OD1-N 3.44Å; D32-R34 IonicContact OD1-NE 2.64Å; D32-R34 WeakPolarHBondContact OD2-CD 3.27Å; D32-R34 IonicContact OD2-CZ 3.78Å; D32-R34 IonicContact OD2-NE 3.49Å; D32-R34 PolarHBondContact OD2-NE 3.22Å; D32-R34 IonicContact OD2-NH2 3.18Å; D32-R34 PolarHBondContact OD2-NH2 3.29Å; R34-L36 PolarHBondContact O-N 3.37Å; R34-S37 PolarHBondContact N-OG 2.87Å; R34-S37 VanDerWaalsContact O-CB 3.28Å; R34-S37 WeakPolarHBondContact O-CB 3.35Å; R34-S37 PolarHBondContact O-N 2.87Å; R34-S37 PolarHBondContact O-OG 2.88Å; R34-I74 VanDerWaalsContact CD-OXT 3.28Å; R34-I74 WeakPolarHBondContact CD-OXT 3.32Å; R34-I74 PolarHBondContact NH1-OXT 3.48Å
35	N	72.7	Confident	84.9	Confident	157 Å²	157	58.2 Å²	58.2	84%	0.84	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	135.7	173.5	-65.2	-27.5	0	0	0	111	S37	N35-S37 VanDerWaalsContact C-N 3.3Å; N35-S37 PolarHBondContact O-N 3.49Å
36	L	79.7	Confident	85	Confident	102 Å²	102	60 Å²	60	53%	0.534	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	0.8	-178.8	-43.6	170.7	0	0	0	116	R34 D38 I39 V40	R34-L36 PolarHBondContact O-N 3.37Å; L36-D38 PolarHBondContact O-N 3.33Å; L36-I39 HydrophobicContact CD2-CD1 3.78Å; L36-I39 PolarHBondContact O-N 3.2Å; L36-V40 WeakPolarHBondContact O-CG2 3.2Å; L36-V40 PolarHBondContact O-N 2.94Å
37	S	81.1	Confident	85.2	Confident	11 Å²	11	59.8 Å²	59.8	8%	0.077	33%	0.326	C	S	.	.	H	α-helix	trans	-51.3	-45	176.8	-67.6	0	0	0	0	111.9	R34 N35 I39 V40 F41	R34-S37 PolarHBondContact N-OG 2.87Å; R34-S37 VanDerWaalsContact O-CB 3.28Å; R34-S37 WeakPolarHBondContact O-CB 3.35Å; R34-S37 PolarHBondContact O-N 2.87Å; R34-S37 PolarHBondContact O-OG 2.88Å; N35-S37 VanDerWaalsContact C-N 3.3Å; N35-S37 PolarHBondContact O-N 3.49Å; S37-I39 VanDerWaalsContact C-N 3.34Å; S37-I39 PolarHBondContact O-N 3.09Å; S37-V40 PolarHBondContact O-N 2.89Å; S37-V40 VanDerWaalsContact O-N 3.15Å; S37-F41 WeakPolarHBondContact O-CD2 3.07Å; S37-F41 VanDerWaalsContact O-CG 3.24Å; S37-F41 WeakPolarHBondContact O-CG 3.44Å; S37-F41 PolarHBondContact O-N 3.43Å
38	D	83.5	Confident	85.3	Confident	121 Å²	121	59.7 Å²	59.7	65%	0.647	33%	0.326	S	S	*	.	H	α-helix	trans	-59.7	-42.3	179	-61.2	-29.2	0	0	0	112.7	L36 V40 F41 Q42	L36-D38 PolarHBondContact O-N 3.33Å; D38-V40 VanDerWaalsContact C-N 3.34Å; D38-F41 PolarHBondContact O-N 3.12Å; D38-Q42 WeakPolarHBondContact O-CG 3.36Å; D38-Q42 PolarHBondContact O-N 3.03Å
39	I	86.9	Confident	85.6	Confident	79 Å²	79	61 Å²	61	41%	0.405	34%	0.342	S	S	.	.	H	α-helix	trans	-67.2	-39.8	178.9	-61.9	174.7	0	0	0	110.1	L36 S37 R43	L36-I39 HydrophobicContact CD2-CD1 3.78Å; L36-I39 PolarHBondContact O-N 3.2Å; S37-I39 VanDerWaalsContact C-N 3.34Å; S37-I39 PolarHBondContact O-N 3.09Å; I39-R43 WeakPolarHBondContact O-CG 3.38Å; I39-R43 PolarHBondContact O-N 3.26Å
40	V	86.5	Confident	86	Confident	30 Å²	30	65.1 Å²	65.1	18%	0.182	38%	0.376	C	S	.	.	H	α-helix	trans	-67.9	-43.5	177.6	179.9	0	0	0	0	110.6	L36 S37 D38 Q42 R43 I44 V73	L36-V40 WeakPolarHBondContact O-CG2 3.2Å; L36-V40 PolarHBondContact O-N 2.94Å; S37-V40 PolarHBondContact O-N 2.89Å; S37-V40 VanDerWaalsContact O-N 3.15Å; D38-V40 VanDerWaalsContact C-N 3.34Å; V40-Q42 PolarHBondContact O-N 2.92Å; V40-R43 WeakPolarHBondContact O-CB 3.49Å; V40-R43 PolarHBondContact O-N 2.87Å; V40-R43 VanDerWaalsContact O-N 3.12Å; V40-I44 HydrophobicContact CG1-CD1 4.02Å; V40-I44 HydrophobicContact CG1-CG1 4.36Å; V40-I44 WeakPolarHBondContact O-CG1 3.47Å; V40-I44 PolarHBondContact O-N 2.84Å; V40-V73 HydrophobicContact CB-CG1 4.23Å; V40-V73 HydrophobicContact CG1-CB 4.44Å; V40-V73 HydrophobicContact CG1-CG1 3.76Å; V40-V73 HydrophobicContact CG1-CG2 3.79Å; V40-V73 HydrophobicContact CG2-CG1 4.4Å
41	F	88.3	Confident	86.4	Confident	20 Å²	20	66.5 Å²	66.5	9%	0.088	38%	0.382	C	S	.	.	H	α-helix	trans	-60.2	-44	177.1	-64.7	-37.4	0	0	0	112.2	I29 S37 D38 R43 I44 F45 F58 V73	I29-F41 HydrophobicContact CG2-CD1 3.34Å; I29-F41 HydrophobicContact CG2-CE1 3.39Å; I29-F41 HydrophobicContact CG2-CG 4.42Å; I29-F41 HydrophobicContact CG2-CZ 4.47Å; S37-F41 WeakPolarHBondContact O-CD2 3.07Å; S37-F41 VanDerWaalsContact O-CG 3.24Å; S37-F41 WeakPolarHBondContact O-CG 3.44Å; S37-F41 PolarHBondContact O-N 3.43Å; D38-F41 PolarHBondContact O-N 3.12Å; F41-R43 VanDerWaalsContact C-N 3.28Å; F41-R43 PolarHBondContact O-N 3.47Å; F41-I44 HydrophobicContact CD1-CD1 4.27Å; F41-I44 WeakPolarHBondContact O-CB 3.46Å; F41-I44 PolarHBondContact O-N 3.49Å; F41-I44 VanDerWaalsContact O-N 3.09Å; F41-F45 HydrophobicContact CB-CD2 4.48Å; F41-F45 HydrophobicContact CB-CE2 3.98Å; F41-F45 WeakPolarHBondContact O-CD2 3.36Å; F41-F45 WeakPolarHBondContact O-CG 3.34Å; F41-F45 PolarHBondContact O-N 3.34Å; F41-F58 HydrophobicContact CD1-CE2 4.47Å; F41-F58 HydrophobicContact CD2-CE2 4.18Å; F41-F58 HydrophobicContact CE1-CE2 4.04Å; F41-F58 HydrophobicContact CE1-CZ 4.38Å; F41-F58 AromaticContact CE2-CE2 3.7Å; F41-F58 HydrophobicContact CE2-CE2 3.7Å; F41-F58 AromaticContact CE2-CZ 3.76Å; F41-F58 HydrophobicContact CE2-CZ 3.76Å; F41-F58 AromaticContact CZ-CE2 3.63Å; F41-F58 HydrophobicContact CZ-CE2 3.63Å; F41-F58 AromaticContact CZ-CZ 3.61Å; F41-F58 HydrophobicContact CZ-CZ 3.61Å; F41-V73 HydrophobicContact CE1-CG2 4.48Å
42	Q	90.6	Very high	87	Confident	138 Å²	138	66.3 Å²	66.3	65%	0.645	38%	0.38	S	S	*	.	H	α-helix	trans	-57.4	-41.6	174.4	-73.1	178.5	20.4	0	0	112.3	D38 V40 F45 G46	D38-Q42 WeakPolarHBondContact O-CG 3.36Å; D38-Q42 PolarHBondContact O-N 3.03Å; V40-Q42 PolarHBondContact O-N 2.92Å; Q42-F45 PolarHBondContact O-N 2.95Å; Q42-G46 PolarHBondContact O-N 3.42Å
43	R	91.1	Very high	87.5	Confident	97 Å²	97	62.5 Å²	62.5	37%	0.366	36%	0.36	S	S	.	.	H	α-helix	trans	-65.3	-41.4	175.2	-69.2	173.1	-180	-174.9	-0.9	111.8	I10 I39 V40 F41 G46 I47	I10-R43 HydrophobicContact CD1-CB 4.04Å; I39-R43 WeakPolarHBondContact O-CG 3.38Å; I39-R43 PolarHBondContact O-N 3.26Å; V40-R43 WeakPolarHBondContact O-CB 3.49Å; V40-R43 PolarHBondContact O-N 2.87Å; V40-R43 VanDerWaalsContact O-N 3.12Å; F41-R43 VanDerWaalsContact C-N 3.28Å; F41-R43 PolarHBondContact O-N 3.47Å; R43-G46 PolarHBondContact O-N 2.84Å; R43-I47 WeakPolarHBondContact O-CB 3.3Å; R43-I47 VanDerWaalsContact O-CD1 3.32Å; R43-I47 WeakPolarHBondContact O-CD1 3.32Å; R43-I47 WeakPolarHBondContact O-CG1 3.17Å; R43-I47 PolarHBondContact O-N 3.36Å
44	I	91.3	Very high	88.4	Confident	1 Å²	1	65 Å²	65	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-59.5	-50.5	176	-66.5	169.7	0	0	0	110.1	I10 L27 I29 V40 F41 G46 I47 A48 V71 V73	I10-I44 HydrophobicContact CD1-CB 4.4Å; I10-I44 HydrophobicContact CD1-CG1 3.5Å; I10-I44 HydrophobicContact CG1-CG1 3.87Å; I10-I44 HydrophobicContact CG2-CG1 4.42Å; L27-I44 HydrophobicContact CD2-CG2 3.62Å; I29-I44 HydrophobicContact CD1-CB 4.49Å; I29-I44 HydrophobicContact CD1-CG2 3.61Å; I29-I44 HydrophobicContact CG1-CG2 4.01Å; I29-I44 HydrophobicContact CG2-CD1 4.26Å; V40-I44 HydrophobicContact CG1-CD1 4.02Å; V40-I44 HydrophobicContact CG1-CG1 4.36Å; V40-I44 WeakPolarHBondContact O-CG1 3.47Å; V40-I44 PolarHBondContact O-N 2.84Å; F41-I44 HydrophobicContact CD1-CD1 4.27Å; F41-I44 WeakPolarHBondContact O-CB 3.46Å; F41-I44 PolarHBondContact O-N 3.49Å; F41-I44 VanDerWaalsContact O-N 3.09Å; I44-G46 PolarHBondContact O-N 3.15Å; I44-I47 PolarHBondContact O-N 3.48Å; I44-A48 WeakPolarHBondContact O-CB 3.16Å; I44-A48 PolarHBondContact O-N 3.41Å; I44-V71 HydrophobicContact CD1-CG1 4.15Å; I44-V73 HydrophobicContact CD1-CG2 3.76Å
45	F	92.2	Very high	89.2	Confident	86 Å²	86	63.7 Å²	63.7	38%	0.377	35%	0.352	S	S	.	.	H	α-helix	trans	-58.8	-45.9	179.6	-64.4	-48.7	0	0	0	112.2	I29 F41 Q42 G49 F56	I29-F45 HydrophobicContact CD1-CD1 3.76Å; I29-F45 HydrophobicContact CD1-CE1 3.25Å; I29-F45 HydrophobicContact CD1-CZ 3.95Å; F41-F45 HydrophobicContact CB-CD2 4.48Å; F41-F45 HydrophobicContact CB-CE2 3.98Å; F41-F45 WeakPolarHBondContact O-CD2 3.36Å; F41-F45 WeakPolarHBondContact O-CG 3.34Å; F41-F45 PolarHBondContact O-N 3.34Å; Q42-F45 PolarHBondContact O-N 2.95Å; F45-G49 PolarHBondContact O-N 2.87Å; F45-F56 HydrophobicContact CD1-CB 4.24Å; F45-F56 AromaticContact CD1-CD1 3.45Å; F45-F56 HydrophobicContact CD1-CD1 3.45Å; F45-F56 VanDerWaalsContact CD1-CD1 3.45Å; F45-F56 HydrophobicContact CD1-CD2 4.38Å; F45-F56 AromaticContact CD1-CE1 3.77Å; F45-F56 HydrophobicContact CD1-CE1 3.77Å; F45-F56 AromaticContact CD1-CG 3.76Å; F45-F56 HydrophobicContact CD1-CG 3.76Å; F45-F56 HydrophobicContact CD1-CZ 4.38Å; F45-F56 HydrophobicContact CE1-CB 3.86Å; F45-F56 AromaticContact CE1-CD1 3.72Å; F45-F56 HydrophobicContact CE1-CD1 3.72Å; F45-F56 HydrophobicContact CE1-CE1 4.47Å; F45-F56 AromaticContact CE1-CG 3.9Å; F45-F56 HydrophobicContact CE1-CG 3.9Å
46	G	93.5	Very high	90.1	Very high	47 Å²	47	59.5 Å²	59.5	49%	0.485	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-50	178.8	0	0	0	0	0	112.6	Q42 R43 I44 A50	Q42-G46 PolarHBondContact O-N 3.42Å; R43-G46 PolarHBondContact O-N 2.84Å; I44-G46 PolarHBondContact O-N 3.15Å; G46-A50 WeakPolarHBondContact O-CB 3.24Å; G46-A50 PolarHBondContact O-N 3.38Å
47	I	93.2	Very high	90.4	Very high	22 Å²	22	57.6 Å²	57.6	11%	0.113	32%	0.317	C	S	.	.	H	α-helix	trans	-70.1	-44.7	-176.9	-61.5	161.6	0	0	0	111	V7 I10 Q11 L14 R43 I44 A50 N51	V7-I47 HydrophobicContact CB-CD1 3.89Å; V7-I47 HydrophobicContact CG1-CD1 3.59Å; V7-I47 HydrophobicContact CG1-CG1 4.14Å; V7-I47 HydrophobicContact CG2-CD1 4.06Å; I10-I47 HydrophobicContact CB-CD1 3.85Å; I10-I47 HydrophobicContact CD1-CD1 3.83Å; I10-I47 HydrophobicContact CG1-CD1 4.46Å; I10-I47 HydrophobicContact CG2-CB 3.97Å; I10-I47 HydrophobicContact CG2-CD1 3.93Å; I10-I47 HydrophobicContact CG2-CG2 3.89Å; Q11-I47 HydrophobicContact CB-CG2 4.47Å; L14-I47 HydrophobicContact CD1-CG2 3.91Å; R43-I47 WeakPolarHBondContact O-CB 3.3Å; R43-I47 VanDerWaalsContact O-CD1 3.32Å; R43-I47 WeakPolarHBondContact O-CD1 3.32Å; R43-I47 WeakPolarHBondContact O-CG1 3.17Å; R43-I47 PolarHBondContact O-N 3.36Å; I44-I47 PolarHBondContact O-N 3.48Å; I47-A50 PolarHBondContact O-N 3.13Å; I47-N51 PolarHBondContact O-N 2.91Å; I47-N51 PolarHBondContact O-ND2 3.27Å
48	A	92.5	Very high	90.4	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-44	178.7	0	0	0	0	0	111.5	L14 L27 I44 A50 N51 G52 V53 F56	L14-A48 HydrophobicContact CD1-CB 4.03Å; L14-A48 HydrophobicContact CD2-CB 4.36Å; L27-A48 HydrophobicContact CD2-CB 3.89Å; I44-A48 WeakPolarHBondContact O-CB 3.16Å; I44-A48 PolarHBondContact O-N 3.41Å; A48-A50 VanDerWaalsContact C-N 3.34Å; A48-A50 PolarHBondContact O-N 3.32Å; A48-N51 CarbonylContact O-C 3.57Å; A48-N51 WeakPolarHBondContact O-CA 3.34Å; A48-N51 WeakPolarHBondContact O-CB 3.43Å; A48-N51 PolarHBondContact O-N 3.44Å; A48-G52 PolarHBondContact O-N 3.23Å; A48-V53 HydrophobicContact CB-CB 3.95Å; A48-V53 HydrophobicContact CB-CG1 4.41Å; A48-V53 HydrophobicContact CB-CG2 3.88Å; A48-V53 WeakPolarHBondContact O-CB 3.27Å; A48-V53 WeakPolarHBondContact O-CG2 3.28Å; A48-V53 PolarHBondContact O-N 3.06Å; A48-F56 HydrophobicContact CB-CE1 3.49Å; A48-F56 VanDerWaalsContact CB-CE1 3.49Å; A48-F56 HydrophobicContact CB-CZ 3.63Å
49	G	93.9	Very high	89.7	Confident	37 Å²	37	58.8 Å²	58.8	38%	0.381	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-42.7	174.9	0	0	0	0	0	111.9	F45 N51 G52	F45-G49 PolarHBondContact O-N 2.87Å; G49-N51 PolarHBondContact O-N 3.3Å; G49-G52 PolarHBondContact O-N 3.45Å
50	A	94.6	Very high	88.5	Confident	88 Å²	88	61.9 Å²	61.9	73%	0.727	34%	0.335	S	S	*	.	H	α-helix	trans	-63.6	-24.1	174.4	0	0	0	0	0	113.5	G46 I47 A48	G46-A50 WeakPolarHBondContact O-CB 3.24Å; G46-A50 PolarHBondContact O-N 3.38Å; I47-A50 PolarHBondContact O-N 3.13Å; A48-A50 VanDerWaalsContact C-N 3.34Å; A48-A50 PolarHBondContact O-N 3.32Å
51	N	92.9	Very high	86.8	Confident	34 Å²	34	70.7 Å²	70.7	18%	0.182	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	0.1	173.9	-82.3	-97.3	0	0	0	113.4	Q11 L14 K22 I47 A48 G49	Q11-N51 PolarHBondContact NE2-OD1 2.98Å; Q11-N51 PolarHBondContact OE1-ND2 3.25Å; L14-N51 HydrophobicContact CD1-CB 4.48Å; K22-N51 VanDerWaalsContact CB-O 3.24Å; K22-N51 WeakPolarHBondContact CB-O 3.44Å; K22-N51 HydrophobicContact CD-CB 4.11Å; K22-N51 PolarHBondContact NZ-OD1 3.04Å; I47-N51 PolarHBondContact O-N 2.91Å; I47-N51 PolarHBondContact O-ND2 3.27Å; A48-N51 CarbonylContact O-C 3.57Å; A48-N51 WeakPolarHBondContact O-CA 3.34Å; A48-N51 WeakPolarHBondContact O-CB 3.43Å; A48-N51 PolarHBondContact O-N 3.44Å; G49-N51 PolarHBondContact O-N 3.3Å
52	G	92.9	Very high	84.6	Confident	22 Å²	22	75.9 Å²	75.9	23%	0.227	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	12.2	178.3	0	0	0	0	0	115.4	K22 K23 G24 A48 G49 E54	K22-G52 CarbonylContact O-C 3.57Å; K22-G52 VanDerWaalsContact O-C 3.32Å; K22-G52 VanDerWaalsContact O-O 3.08Å; K23-G52 CarbonylContact C-O 3.53Å; K23-G52 VanDerWaalsContact CA-O 3.26Å; K23-G52 WeakPolarHBondContact CA-O 3.33Å; G24-G52 PolarHBondContact N-O 3.03Å; A48-G52 PolarHBondContact O-N 3.23Å; G49-G52 PolarHBondContact O-N 3.45Å; G52-E54 PolarHBondContact O-N 3.4Å
53	V	92.4	Very high	82.7	Confident	6 Å²	6	71.2 Å²	71.2	4%	0.036	39%	0.393	C	S	.	.			trans	-67.2	125.1	169.8	178.2	0	0	0	0	108.4	L14 L18 K22 A25 L27 A48 F56	L14-V53 HydrophobicContact CD2-CG2 4.43Å; L18-V53 HydrophobicContact CD1-CG2 4.11Å; K22-V53 PolarHBondContact O-N 3.46Å; A25-V53 HydrophobicContact CB-CG2 4.4Å; A25-V53 WeakPolarHBondContact O-CG1 3.46Å; L27-V53 HydrophobicContact CB-CG1 3.76Å; A48-V53 HydrophobicContact CB-CB 3.95Å; A48-V53 HydrophobicContact CB-CG1 4.41Å; A48-V53 HydrophobicContact CB-CG2 3.88Å; A48-V53 WeakPolarHBondContact O-CB 3.27Å; A48-V53 WeakPolarHBondContact O-CG2 3.28Å; A48-V53 PolarHBondContact O-N 3.06Å; V53-F56 HydrophobicContact CB-CE1 4.35Å; V53-F56 HydrophobicContact CB-CZ 3.92Å; V53-F56 HydrophobicContact CG1-CD1 4.31Å; V53-F56 HydrophobicContact CG1-CE1 3.77Å; V53-F56 HydrophobicContact CG1-CE2 4.13Å; V53-F56 HydrophobicContact CG1-CZ 3.67Å
54	E	93.2	Very high	80.6	Confident	118 Å²	118	72.9 Å²	72.9	55%	0.551	42%	0.419	S	S	*	.			trans	-103	-33.4	-174.7	-70.7	177.7	-174.7	0	0	112	A25 G52	A25-E54 PolarHBondContact O-N 2.99Å; G52-E54 PolarHBondContact O-N 3.4Å
55	F	91.3	Very high	78.6	Confident	121 Å²	121	77.4 Å²	77.4	53%	0.531	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.8	-174.8	-56.9	-80.6	0	0	0	111.1	A25 A26 L27	A25-F55 PolarHBondContact O-N 2.68Å; A26-F55 CarbonylContact C-O 3.55Å; A26-F55 VanDerWaalsContact CA-O 3.31Å; A26-F55 WeakPolarHBondContact CA-O 3.35Å; A26-F55 HydrophobicContact CB-CB 3.9Å; L27-F55 PolarHBondContact N-O 3.3Å
56	F	89.8	Confident	76.3	Confident	69 Å²	69	85 Å²	85	30%	0.303	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	118.6	178.7	-68	-81.4	0	0	0	110	L27 I29 F45 A48 V53	L27-F56 HydrophobicContact CB-CD1 4.14Å; L27-F56 HydrophobicContact CB-CE1 4.29Å; L27-F56 HydrophobicContact CD2-CD1 4.3Å; L27-F56 HydrophobicContact CD2-CE1 4Å; I29-F56 HydrophobicContact CD1-CD1 3.76Å; I29-F56 HydrophobicContact CD1-CE1 4.4Å; F45-F56 HydrophobicContact CD1-CB 4.24Å; F45-F56 AromaticContact CD1-CD1 3.45Å; F45-F56 HydrophobicContact CD1-CD1 3.45Å; F45-F56 VanDerWaalsContact CD1-CD1 3.45Å; F45-F56 HydrophobicContact CD1-CD2 4.38Å; F45-F56 AromaticContact CD1-CE1 3.77Å; F45-F56 HydrophobicContact CD1-CE1 3.77Å; F45-F56 AromaticContact CD1-CG 3.76Å; F45-F56 HydrophobicContact CD1-CG 3.76Å; F45-F56 HydrophobicContact CD1-CZ 4.38Å; F45-F56 HydrophobicContact CE1-CB 3.86Å; F45-F56 AromaticContact CE1-CD1 3.72Å; F45-F56 HydrophobicContact CE1-CD1 3.72Å; F45-F56 HydrophobicContact CE1-CE1 4.47Å; F45-F56 AromaticContact CE1-CG 3.9Å; F45-F56 HydrophobicContact CE1-CG 3.9Å; A48-F56 HydrophobicContact CB-CE1 3.49Å; A48-F56 VanDerWaalsContact CB-CE1 3.49Å; A48-F56 HydrophobicContact CB-CZ 3.63Å; V53-F56 HydrophobicContact CB-CE1 4.35Å; V53-F56 HydrophobicContact CB-CZ 3.92Å; V53-F56 HydrophobicContact CG1-CD1 4.31Å; V53-F56 HydrophobicContact CG1-CE1 3.77Å; V53-F56 HydrophobicContact CG1-CE2 4.13Å; V53-F56 HydrophobicContact CG1-CZ 3.67Å
57	N	86.8	Confident	74.2	Confident	62 Å²	62	86.8 Å²	86.8	33%	0.332	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.9	179.1	-66.4	-53.5	0	0	0	109.7	L27 I28 I29	L27-N57 PolarHBondContact O-N 3.33Å; I28-N57 CarbonylContact C-O 3.52Å; I28-N57 VanDerWaalsContact CA-O 3.27Å; I28-N57 WeakPolarHBondContact CA-O 3.2Å; I28-N57 HydrophobicContact CG1-CB 4.42Å; I29-N57 PolarHBondContact N-O 3.46Å
58	F	80.4	Confident	72.3	Confident	85 Å²	85	87.7 Å²	87.7	37%	0.373	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	134.5	172.4	-148.9	-93.2	0	0	0	109.5	I29 F41 L60	I29-F58 HydrophobicContact CG2-CE2 4.4Å; I29-F58 CarbonylContact O-C 3.32Å; I29-F58 WeakPolarHBondContact O-CA 3.47Å; F41-F58 HydrophobicContact CD1-CE2 4.47Å; F41-F58 HydrophobicContact CD2-CE2 4.18Å; F41-F58 HydrophobicContact CE1-CE2 4.04Å; F41-F58 HydrophobicContact CE1-CZ 4.38Å; F41-F58 AromaticContact CE2-CE2 3.7Å; F41-F58 HydrophobicContact CE2-CE2 3.7Å; F41-F58 AromaticContact CE2-CZ 3.76Å; F41-F58 HydrophobicContact CE2-CZ 3.76Å; F41-F58 AromaticContact CZ-CE2 3.63Å; F41-F58 HydrophobicContact CZ-CE2 3.63Å; F41-F58 AromaticContact CZ-CZ 3.61Å; F41-F58 HydrophobicContact CZ-CZ 3.61Å; F58-L60 VanDerWaalsContact C-N 3.27Å; F58-L60 HydrophobicContact CB-CG 4.39Å; F58-L60 HydrophobicContact CD1-CD1 4.5Å; F58-L60 HydrophobicContact CD1-CD2 3.63Å; F58-L60 HydrophobicContact CD1-CG 3.75Å; F58-L60 HydrophobicContact CE1-CD2 4.02Å; F58-L60 PolarHBondContact O-N 3.36Å
59	L	70.6	Confident	70.6	Confident	73 Å²	73	89.3 Å²	89.3	38%	0.382	49%	0.492	S	S	.	.			trans	-73.5	85.3	173.9	-171.3	71.2	0	0	0	109.4	I28 I29 F70	I28-L59 HydrophobicContact CG2-CB 3.69Å; I28-L59 HydrophobicContact CG2-CD1 4.17Å; I28-L59 HydrophobicContact CG2-CG 4.47Å; I29-L59 PolarHBondContact O-N 2.88Å; L59-F70 HydrophobicContact CB-CE2 3.96Å; L59-F70 HydrophobicContact CD2-CD2 4.24Å; L59-F70 HydrophobicContact CD2-CE2 3.28Å; L59-F70 HydrophobicContact CD2-CZ 3.61Å; L59-F70 HydrophobicContact CG-CE2 4.16Å
60	L	61.6	Low	69	Low	143 Å²	143	92.1 Å²	92.1	75%	0.749	49%	0.494	S	S	*	.	S	Bend	trans	-102.8	-10.9	169.9	-66.6	179.4	0	0	0	113.3	F58	F58-L60 VanDerWaalsContact C-N 3.27Å; F58-L60 HydrophobicContact CB-CG 4.39Å; F58-L60 HydrophobicContact CD1-CD1 4.5Å; F58-L60 HydrophobicContact CD1-CD2 3.63Å; F58-L60 HydrophobicContact CD1-CG 3.75Å; F58-L60 HydrophobicContact CE1-CD2 4.02Å; F58-L60 PolarHBondContact O-N 3.36Å
61	R	50.1	Low	67.5	Low	216 Å²	216	88.5 Å²	88.5	82%	0.815	46%	0.463	S	S	*	.	S	Bend	trans	-171.6	144.3	177.5	-120.5	163.9	161.8	-179.5	-6.9	112.1	G63	R61-G63 PolarHBondContact O-N 3.25Å
62	S	41	Very low	65.7	Low	129 Å²	129	91.7 Å²	91.7	90%	0.902	48%	0.479	S	S	*	.			trans	-40.8	112.9	169	168.2	0	0	0	0	112.4
63	G	52.3	Low	64	Low	40 Å²	40	91.9 Å²	91.9	41%	0.412	48%	0.476	S	S	.	.			trans	-153.8	141.1	172.6	0	0	0	0	0	108.4	R61 Y65	R61-G63 PolarHBondContact O-N 3.25Å; G63-Y65 WeakPolarHBondContact O-CD2 3.18Å; G63-Y65 WeakPolarHBondContact O-CE2 3.28Å; G63-Y65 PolarHBondContact O-N 3.24Å
64	S	47.1	Very low	62.1	Low	131 Å²	131	99 Å²	99	92%	0.916	51%	0.512	S	S	*	.			trans	-76.3	107.2	-173	-158.4	0	0	0	0	110.4
65	Y	47.8	Very low	60.5	Low	96 Å²	96	98.1 Å²	98.1	38%	0.376	51%	0.51	S	S	.	.			trans	-103.8	120.3	177.9	-56.8	-84.6	0	0	0	110.3	I28 G63 A67	I28-Y65 HydrophobicContact CD1-CD1 4.16Å; I28-Y65 HydrophobicContact CD1-CD2 3.07Å; I28-Y65 HydrophobicContact CD1-CE2 3.57Å; I28-Y65 HydrophobicContact CD1-CG 3.41Å; I28-Y65 VanDerWaalsContact CD1-CG 3.41Å; I28-Y65 HydrophobicContact CG1-CD2 4.23Å; I28-Y65 HydrophobicContact CG1-CE2 4.49Å; I28-Y65 HydrophobicContact CG1-CG 4.31Å; G63-Y65 WeakPolarHBondContact O-CD2 3.18Å; G63-Y65 WeakPolarHBondContact O-CE2 3.28Å; G63-Y65 PolarHBondContact O-N 3.24Å; Y65-A67 PolarHBondContact O-N 2.85Å
66	R	44.1	Very low	58.9	Low	247 Å²	247	96.8 Å²	96.8	93%	0.932	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	110.6	172.5	-76.5	-179.4	149.8	-166.5	-6.4	108.4
67	A	50.8	Low	57.2	Low	83 Å²	83	98.4 Å²	98.4	69%	0.686	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	76.9	-177.4	0	0	0	0	0	114.3	Y65	Y65-A67 PolarHBondContact O-N 2.85Å
68	A	52.4	Low	55.4	Low	41 Å²	41	100.5 Å²	100.5	34%	0.339	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.9	169.3	0	0	0	0	0	110.4	I28	I28-A68 HydrophobicContact CB-CB 4.28Å; I28-A68 HydrophobicContact CD1-CB 3.19Å; I28-A68 HydrophobicContact CG1-CB 3.55Å
69	L	57.8	Low	53.9	Low	34 Å²	34	101.5 Å²	101.5	18%	0.178	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.3	163.1	-178.9	62.1	0	0	0	107.6	I13 L14 L18 L27 I28 V71	I13-L69 HydrophobicContact CG2-CD1 4.43Å; I13-L69 HydrophobicContact CG2-CD2 3.65Å; I13-L69 HydrophobicContact CG2-CG 4.24Å; L14-L69 HydrophobicContact CD2-CD2 4.29Å; L18-L69 HydrophobicContact CD2-CB 4.44Å; L18-L69 HydrophobicContact CG-CB 4.45Å; L18-L69 HydrophobicContact CG-CD2 4.32Å; L27-L69 HydrophobicContact CD1-CB 3.81Å; L27-L69 HydrophobicContact CD1-CD2 4.26Å; L27-L69 HydrophobicContact CD1-CG 4.24Å; L27-L69 WeakPolarHBondContact CD1-O 3.49Å; I28-L69 PolarHBondContact N-O 3.49Å; I28-L69 VanDerWaalsContact O-O 3.09Å; L69-V71 HydrophobicContact CD2-CG2 4.49Å; L69-V71 HydrophobicContact CG-CG2 4.32Å
70	F	59.5	Low	52.8	Low	97 Å²	97	103.4 Å²	103.4	43%	0.425	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.4	112	175.3	-170.3	-113.6	0	0	0	108.9	I28 L59 L72	I28-F70 HydrophobicContact CG2-CD2 4.03Å; I28-F70 HydrophobicContact CG2-CE2 4.33Å; L59-F70 HydrophobicContact CB-CE2 3.96Å; L59-F70 HydrophobicContact CD2-CD2 4.24Å; L59-F70 HydrophobicContact CD2-CE2 3.28Å; L59-F70 HydrophobicContact CD2-CZ 3.61Å; L59-F70 HydrophobicContact CG-CE2 4.16Å; F70-L72 HydrophobicContact CD1-CB 4.18Å; F70-L72 HydrophobicContact CE1-CB 3.72Å; F70-L72 HydrophobicContact CE1-CD1 4.07Å; F70-L72 HydrophobicContact CE1-CG 4.35Å; F70-L72 HydrophobicContact CZ-CB 4.47Å; F70-L72 HydrophobicContact CZ-CD1 4.2Å
71	V	62.8	Low	52.1	Low	11 Å²	11	100.6 Å²	100.6	7%	0.067	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	100.9	171.2	-174.9	0	0	0	0	107	I13 L27 I28 G30 I44 L69 V73	I13-V71 HydrophobicContact CG2-CG2 3.85Å; L27-V71 HydrophobicContact CD1-CG2 4.14Å; I28-V71 PolarHBondContact O-N 2.88Å; G30-V71 PolarHBondContact N-O 2.64Å; G30-V71 VanDerWaalsContact O-O 3.12Å; I44-V71 HydrophobicContact CD1-CG1 4.15Å; L69-V71 HydrophobicContact CD2-CG2 4.49Å; L69-V71 HydrophobicContact CG-CG2 4.32Å; V71-V73 HydrophobicContact CG1-CG2 4.25Å
72	L	56.3	Low	52.3	Low	102 Å²	102	91.7 Å²	91.7	53%	0.534	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	112.6	168.7	-174.8	62.9	0	0	0	108.4	F70 I74	F70-L72 HydrophobicContact CD1-CB 4.18Å; F70-L72 HydrophobicContact CE1-CB 3.72Å; F70-L72 HydrophobicContact CE1-CD1 4.07Å; F70-L72 HydrophobicContact CE1-CG 4.35Å; F70-L72 HydrophobicContact CZ-CB 4.47Å; F70-L72 HydrophobicContact CZ-CD1 4.2Å; L72-I74 HydrophobicContact CD2-CG2 4.17Å; L72-I74 HydrophobicContact CG-CG2 4.16Å
73	V	57.2	Low	53.2	Low	25 Å²	25	88.6 Å²	88.6	15%	0.152	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.9	167.5	-175.3	0	0	0	0	107.5	G30 V40 F41 I44 V71	G30-V73 PolarHBondContact O-N 3.33Å; V40-V73 HydrophobicContact CB-CG1 4.23Å; V40-V73 HydrophobicContact CG1-CB 4.44Å; V40-V73 HydrophobicContact CG1-CG1 3.76Å; V40-V73 HydrophobicContact CG1-CG2 3.79Å; V40-V73 HydrophobicContact CG2-CG1 4.4Å; F41-V73 HydrophobicContact CE1-CG2 4.48Å; I44-V73 HydrophobicContact CD1-CG2 3.76Å; V71-V73 HydrophobicContact CG1-CG2 4.25Å
74	I	51	Low	53.3	Low	156 Å²	156	93 Å²	93	80%	0.8	49%	0.491	S	S	*	.			trans	-100.8	0	176.2	57.9	165.3	0	0	0	112.6	R34 L72	R34-I74 VanDerWaalsContact CD-OXT 3.28Å; R34-I74 WeakPolarHBondContact CD-OXT 3.32Å; R34-I74 PolarHBondContact NH1-OXT 3.48Å; L72-I74 HydrophobicContact CD2-CG2 4.17Å; L72-I74 HydrophobicContact CG-CG2 4.16Å

Retrieved 74 of 74 residues in 50.5 ms (Link to these results)

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