A0A077YXY1_TRITR Loading...

Crust neurohorm domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXY1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 76 aa.

						>A0A077YXY1_TRITR|A0A077YXY1
MAVGNCPIYKNEALHAVMDRICDECHNMFRHADPNLRAKCRYAKCFDNDLFTTCLAIFFPAMELVPPVKRTVRLSS
					

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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	43.7	Very low	75.3	Confident	184 Å²	184	92.4 Å²	92.4	91%	0.906	53%	0.528	S	S	*	.				0	130.2	0	-59.4	-172.9	-167.9	0	0	107.7
2	A	52.1	Low	76.7	Confident	79 Å²	79	98.5 Å²	98.5	65%	0.653	55%	0.548	S	S	*	.			trans	-68.7	137.2	179.4	0	0	0	0	0	110.2	G4 N5	A2-G4 PolarHBondContact O-N 3.42Å; A2-N5 PolarHBondContact O-N 3.17Å
3	V	57.2	Low	78	Confident	81 Å²	81	96.4 Å²	96.4	49%	0.491	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-50.1	-25	-178.5	179.9	0	0	0	0	112.8	Y42	V3-Y42 WeakPolarHBondContact CG2-O 3.38Å
4	G	66.1	Low	79	Confident	68 Å²	68	94.6 Å²	94.6	70%	0.701	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-78.2	-15.2	-176.7	0	0	0	0	0	117.3	A2	A2-G4 PolarHBondContact O-N 3.42Å
5	N	77	Confident	79.9	Confident	142 Å²	142	92.1 Å²	92.1	76%	0.759	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-109.2	20.4	-173.4	-82	2.8	0	0	0	114.5	A2 P7	A2-N5 PolarHBondContact O-N 3.17Å; N5-P7 VanDerWaalsContact O-CD 3.22Å; N5-P7 WeakPolarHBondContact O-CD 3.37Å
6	C	85.5	Confident	80.7	Confident	7 Å²	7	89.1 Å²	89.1	5%	0.047	51%	0.511	C	S	.	.			trans	-69.2	114.9	179.5	-179.9	0	0	0	0	111.1	I8 Y9 C45	C6-I8 PolarHBondContact O-N 3.14Å; C6-Y9 HydrophobicContact CB-CD2 3.47Å; C6-Y9 VanDerWaalsContact CB-CD2 3.47Å; C6-Y9 HydrophobicContact CB-CE2 3.65Å; C6-Y9 HydrophobicContact CB-CG 4.13Å; C6-Y9 PolarHBondContact O-N 3.18Å; C6-Y9 VanDerWaalsContact O-N 3.1Å; C6-C45 WeakPolarHBondContact CA-SG 3.41Å; C6-C45 HydrophobicContact CB-CB 3.48Å; C6-C45 VanDerWaalsContact CB-CB 3.48Å; C6-C45 WeakPolarHBondContact CB-SG 3.39Å; C6-C45 WeakPolarHBondContact SG-CA 3.32Å; C6-C45 WeakPolarHBondContact SG-CB 3.39Å; C6-C45 CovalentContact SG-SG 2.02Å; C6-C45 PolarHBondContact SG-SG 3.12Å
7	P	87	Confident	81.5	Confident	90 Å²	90	88.2 Å²	88.2	58%	0.584	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-62.1	-25.4	-178.9	24	-35.1	0	0	0	113.1	N5 Y9 K10	N5-P7 VanDerWaalsContact O-CD 3.22Å; N5-P7 WeakPolarHBondContact O-CD 3.37Å; P7-Y9 VanDerWaalsContact C-N 3.26Å; P7-Y9 PolarHBondContact O-N 3.21Å; P7-K10 WeakPolarHBondContact O-CB 3.02Å; P7-K10 PolarHBondContact O-N 3.36Å; P7-K10 VanDerWaalsContact O-N 3.09Å
8	I	87.9	Confident	82	Confident	32 Å²	32	84.7 Å²	84.7	16%	0.164	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-59.2	-38.4	175.6	-69.9	165.5	0	0	0	111	C6 K10 N11 L14 H15 M18 F46	C6-I8 PolarHBondContact O-N 3.14Å; I8-K10 PolarHBondContact O-N 3.1Å; I8-N11 CarbonylContact O-C 3.58Å; I8-N11 PolarHBondContact O-N 3.11Å; I8-N11 VanDerWaalsContact O-N 3.07Å; I8-L14 HydrophobicContact CB-CD2 4.49Å; I8-L14 HydrophobicContact CG1-CD2 4.06Å; I8-L14 HydrophobicContact CG2-CD2 4.42Å; I8-L14 HydrophobicContact CG2-CG 4.16Å; I8-H15 HydrophobicContact CG2-CB 4.24Å; I8-M18 HydrophobicContact CD1-CG 4.42Å; I8-M18 HydrophobicContact CG2-CB 4.39Å; I8-M18 HydrophobicContact CG2-CG 3.9Å; I8-F46 HydrophobicContact CB-CD2 4.17Å; I8-F46 HydrophobicContact CB-CE2 3.99Å; I8-F46 HydrophobicContact CD1-CB 4.24Å; I8-F46 HydrophobicContact CD1-CD2 3.47Å; I8-F46 VanDerWaalsContact CD1-CD2 3.47Å; I8-F46 HydrophobicContact CD1-CE2 4.16Å; I8-F46 HydrophobicContact CD1-CG 4.11Å; I8-F46 HydrophobicContact CG1-CD2 4.41Å; I8-F46 HydrophobicContact CG2-CD2 4.02Å; I8-F46 HydrophobicContact CG2-CE2 3.53Å; I8-F46 HydrophobicContact CG2-CZ 4.2Å
9	Y	89.1	Confident	82.6	Confident	71 Å²	71	82 Å²	82	28%	0.278	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-67.5	-17.2	178.4	-62.5	-35.3	0	0	0	114.2	C6 P7 N11 H15 R41 F46	C6-Y9 HydrophobicContact CB-CD2 3.47Å; C6-Y9 VanDerWaalsContact CB-CD2 3.47Å; C6-Y9 HydrophobicContact CB-CE2 3.65Å; C6-Y9 HydrophobicContact CB-CG 4.13Å; C6-Y9 PolarHBondContact O-N 3.18Å; C6-Y9 VanDerWaalsContact O-N 3.1Å; P7-Y9 VanDerWaalsContact C-N 3.26Å; P7-Y9 PolarHBondContact O-N 3.21Å; Y9-N11 PolarHBondContact O-N 3.07Å; Y9-H15 HydrophobicContact CD1-CB 4.38Å; Y9-H15 AromaticContact CD1-CD2 3.52Å; Y9-H15 AromaticContact CD1-CE1 3.79Å; Y9-H15 AromaticContact CD1-CG 3.68Å; Y9-H15 AromaticContact CD1-ND1 3.85Å; Y9-H15 AromaticContact CD1-NE2 3.58Å; Y9-H15 AromaticContact CE1-CD2 3.53Å; Y9-H15 AromaticContact CE1-CE1 3.98Å; Y9-H15 AromaticContact CE1-NE2 3.38Å; Y9-H15 WeakPolarHBondContact CE1-NE2 3.22Å; Y9-R41 PolarHBondContact OH-O 3.09Å; Y9-F46 HydrophobicContact CD1-CE2 4.34Å; Y9-F46 AromaticContact CE1-CE2 3.72Å; Y9-F46 HydrophobicContact CE1-CE2 3.72Å; Y9-F46 AromaticContact CE1-CZ 3.83Å; Y9-F46 HydrophobicContact CE1-CZ 3.83Å
10	K	90.4	Very high	83.1	Confident	182 Å²	182	87.3 Å²	87.3	79%	0.791	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-76	-15.2	174.4	-59	-175.8	178.5	-177.7	0	112.6	P7 I8	P7-K10 WeakPolarHBondContact O-CB 3.02Å; P7-K10 PolarHBondContact O-N 3.36Å; P7-K10 VanDerWaalsContact O-N 3.09Å; I8-K10 PolarHBondContact O-N 3.1Å
11	N	92.3	Very high	83.6	Confident	80 Å²	80	84.2 Å²	84.2	43%	0.428	46%	0.464	S	S	.	.	S	Bend	trans	-115.2	100.2	175.1	-179.8	-26.7	0	0	0	108.6	I8 Y9 A13 L14 H15	I8-N11 CarbonylContact O-C 3.58Å; I8-N11 PolarHBondContact O-N 3.11Å; I8-N11 VanDerWaalsContact O-N 3.07Å; Y9-N11 PolarHBondContact O-N 3.07Å; N11-A13 VanDerWaalsContact C-N 3.28Å; N11-A13 PolarHBondContact O-N 3.19Å; N11-A13 PolarHBondContact OD1-N 3.48Å; N11-L14 HydrophobicContact CB-CB 3.85Å; N11-L14 PolarHBondContact O-N 2.98Å; N11-L14 VanDerWaalsContact O-N 3.17Å; N11-L14 PolarHBondContact OD1-N 2.87Å; N11-H15 WeakPolarHBondContact O-CB 3.33Å; N11-H15 PolarHBondContact O-N 3.22Å
12	E	92	Very high	86	Confident	166 Å²	166	75.5 Å²	75.5	78%	0.776	42%	0.421	S	S	*	.	H	α-helix	trans	-58.5	-38.8	-175.3	-63.7	-170.8	162.7	0	0	113.2	H15 A16	E12-H15 PolarHBondContact O-N 3.47Å; E12-A16 WeakPolarHBondContact O-CB 3.01Å; E12-A16 PolarHBondContact O-N 2.83Å
13	A	93.9	Very high	88	Confident	71 Å²	71	74.3 Å²	74.3	59%	0.587	40%	0.404	S	S	*	.	H	α-helix	trans	-66.4	-45.3	178.4	0	0	0	0	0	111.2	N11 A16 V17	N11-A13 VanDerWaalsContact C-N 3.28Å; N11-A13 PolarHBondContact O-N 3.19Å; N11-A13 PolarHBondContact OD1-N 3.48Å; A13-A16 PolarHBondContact O-N 2.9Å; A13-V17 WeakPolarHBondContact O-CG2 3.34Å; A13-V17 PolarHBondContact O-N 2.02Å; A13-V17 VanDerWaalsContact O-N 3.08Å
14	L	91.8	Very high	89.8	Confident	72 Å²	72	75.2 Å²	75.2	38%	0.377	40%	0.403	S	S	.	.	H	α-helix	trans	-63.6	-45.1	176.3	-178.7	61.7	0	0	0	111.1	I8 N11 A16 V17 M18	I8-L14 HydrophobicContact CB-CD2 4.49Å; I8-L14 HydrophobicContact CG1-CD2 4.06Å; I8-L14 HydrophobicContact CG2-CD2 4.42Å; I8-L14 HydrophobicContact CG2-CG 4.16Å; N11-L14 HydrophobicContact CB-CB 3.85Å; N11-L14 PolarHBondContact O-N 2.98Å; N11-L14 VanDerWaalsContact O-N 3.17Å; N11-L14 PolarHBondContact OD1-N 2.87Å; L14-A16 PolarHBondContact O-N 2.82Å; L14-V17 PolarHBondContact O-N 2.71Å; L14-M18 HydrophobicContact CD1-CE 4.14Å; L14-M18 HydrophobicContact CD1-CG 4.44Å; L14-M18 HydrophobicContact CG-CG 4.5Å; L14-M18 WeakPolarHBondContact O-CG 3.43Å; L14-M18 PolarHBondContact O-N 3.17Å
15	H	92.3	Very high	91.1	Very high	56 Å²	56	72 Å²	72	26%	0.259	37%	0.369	S	S	.	.	H	α-helix	trans	-56.3	-49.4	175.3	173.2	-154.2	0	0	0	111.6	I8 Y9 N11 E12 V17 M18 D19	I8-H15 HydrophobicContact CG2-CB 4.24Å; Y9-H15 HydrophobicContact CD1-CB 4.38Å; Y9-H15 AromaticContact CD1-CD2 3.52Å; Y9-H15 AromaticContact CD1-CE1 3.79Å; Y9-H15 AromaticContact CD1-CG 3.68Å; Y9-H15 AromaticContact CD1-ND1 3.85Å; Y9-H15 AromaticContact CD1-NE2 3.58Å; Y9-H15 AromaticContact CE1-CD2 3.53Å; Y9-H15 AromaticContact CE1-CE1 3.98Å; Y9-H15 AromaticContact CE1-NE2 3.38Å; Y9-H15 WeakPolarHBondContact CE1-NE2 3.22Å; N11-H15 WeakPolarHBondContact O-CB 3.33Å; N11-H15 PolarHBondContact O-N 3.22Å; E12-H15 PolarHBondContact O-N 3.47Å; H15-V17 VanDerWaalsContact C-N 3.27Å; H15-V17 PolarHBondContact O-N 3.32Å; H15-M18 PolarHBondContact O-N 3.28Å; H15-M18 VanDerWaalsContact O-N 3.15Å; H15-D19 IonicContact CD2-OD1 3.96Å; H15-D19 IonicContact NE2-OD1 3.71Å; H15-D19 IonicContact NE2-OD2 3.9Å; H15-D19 PolarHBondContact O-N 3.05Å
16	A	93.5	Very high	92	Very high	45 Å²	45	67.8 Å²	67.8	37%	0.372	35%	0.345	S	S	.	.	H	α-helix	trans	-61.3	-36	179.1	0	0	0	0	0	112.6	E12 A13 L14 R20	E12-A16 WeakPolarHBondContact O-CB 3.01Å; E12-A16 PolarHBondContact O-N 2.83Å; A13-A16 PolarHBondContact O-N 2.9Å; L14-A16 PolarHBondContact O-N 2.82Å; A16-R20 WeakPolarHBondContact O-CG 3.45Å; A16-R20 PolarHBondContact O-N 2.93Å
17	V	92.9	Very high	92.4	Very high	74 Å²	74	72.4 Å²	72.4	45%	0.448	37%	0.37	S	S	.	.	H	α-helix	trans	-67.4	-47.4	174	173.8	0	0	0	0	110.6	A13 L14 H15 D19 R20 I21	A13-V17 WeakPolarHBondContact O-CG2 3.34Å; A13-V17 PolarHBondContact O-N 2.02Å; A13-V17 VanDerWaalsContact O-N 3.08Å; L14-V17 PolarHBondContact O-N 2.71Å; H15-V17 VanDerWaalsContact C-N 3.27Å; H15-V17 PolarHBondContact O-N 3.32Å; V17-D19 VanDerWaalsContact C-N 3.29Å; V17-D19 PolarHBondContact O-N 3.15Å; V17-R20 PolarHBondContact O-N 3.23Å; V17-I21 HydrophobicContact CG1-CD1 3.87Å; V17-I21 HydrophobicContact CG1-CG1 4.44Å; V17-I21 WeakPolarHBondContact O-CG1 3.38Å; V17-I21 PolarHBondContact O-N 3.08Å
18	M	91.8	Very high	92.7	Very high	25 Å²	25	72.7 Å²	72.7	12%	0.123	36%	0.364	C	S	.	.	H	α-helix	trans	-60.2	-40	178.5	-67.4	-62.4	105	0	0	111.8	I8 L14 H15 R20 I21 C22 F46 F51	I8-M18 HydrophobicContact CD1-CG 4.42Å; I8-M18 HydrophobicContact CG2-CB 4.39Å; I8-M18 HydrophobicContact CG2-CG 3.9Å; L14-M18 HydrophobicContact CD1-CE 4.14Å; L14-M18 HydrophobicContact CD1-CG 4.44Å; L14-M18 HydrophobicContact CG-CG 4.5Å; L14-M18 WeakPolarHBondContact O-CG 3.43Å; L14-M18 PolarHBondContact O-N 3.17Å; H15-M18 PolarHBondContact O-N 3.28Å; H15-M18 VanDerWaalsContact O-N 3.15Å; M18-R20 PolarHBondContact O-N 3.48Å; M18-I21 HydrophobicContact CE-CD1 3.74Å; M18-I21 PolarHBondContact O-N 3.41Å; M18-C22 PolarHBondContact O-N 2.88Å; M18-C22 PolarHBondContact O-SG 3.18Å; M18-F46 HydrophobicContact CB-CD1 3.76Å; M18-F46 HydrophobicContact CB-CE1 3.41Å; M18-F46 VanDerWaalsContact CB-CE1 3.41Å; M18-F46 HydrophobicContact CB-CE2 4.33Å; M18-F46 HydrophobicContact CB-CG 4.36Å; M18-F46 HydrophobicContact CB-CZ 3.73Å; M18-F46 HydrophobicContact CG-CD1 4.42Å; M18-F46 HydrophobicContact CG-CE1 4.41Å; M18-F51 HydrophobicContact SD-CZ 4.33Å
19	D	92.5	Very high	93	Very high	33 Å²	33	73.5 Å²	73.5	18%	0.176	37%	0.366	C	S	.	.	H	α-helix	trans	-62.4	-40.4	176.8	-103.5	13.6	0	0	0	112.9	H15 V17 C22 D23 R41	H15-D19 IonicContact CD2-OD1 3.96Å; H15-D19 IonicContact NE2-OD1 3.71Å; H15-D19 IonicContact NE2-OD2 3.9Å; H15-D19 PolarHBondContact O-N 3.05Å; V17-D19 VanDerWaalsContact C-N 3.29Å; V17-D19 PolarHBondContact O-N 3.15Å; D19-C22 WeakPolarHBondContact O-CB 3.33Å; D19-C22 PolarHBondContact O-N 2.91Å; D19-D23 PolarHBondContact O-N 3.22Å; D19-R41 WeakPolarHBondContact OD1-CG 3.09Å; D19-R41 IonicContact OD1-CZ 3.73Å; D19-R41 IonicContact OD1-NE 3.76Å; D19-R41 PolarHBondContact OD1-NE 2.82Å; D19-R41 IonicContact OD2-CZ 2.7Å; D19-R41 IonicContact OD2-NH1 2.9Å
20	R	93.9	Very high	93.2	Very high	187 Å²	187	76.1 Å²	76.1	71%	0.706	38%	0.376	S	S	*	.	H	α-helix	trans	-65.5	-43.1	174.4	-70	174.8	-170.2	-153.3	2.7	111.2	A16 V17 M18 C22 D23 E24	A16-R20 WeakPolarHBondContact O-CG 3.45Å; A16-R20 PolarHBondContact O-N 2.93Å; V17-R20 PolarHBondContact O-N 3.23Å; M18-R20 PolarHBondContact O-N 3.48Å; R20-C22 VanDerWaalsContact C-N 3.31Å; R20-C22 PolarHBondContact O-N 2.9Å; R20-D23 PolarHBondContact O-N 2.79Å; R20-D23 VanDerWaalsContact O-N 3.14Å; R20-E24 PolarHBondContact O-N 3.36Å
21	I	93.3	Very high	93.4	Very high	24 Å²	24	75 Å²	75	12%	0.123	37%	0.373	C	S	.	.	H	α-helix	trans	-63.4	-39.7	176.7	-62.2	171.2	0	0	0	110.2	V17 M18 D23 E24 C25 F51 L55 F58	V17-I21 HydrophobicContact CG1-CD1 3.87Å; V17-I21 HydrophobicContact CG1-CG1 4.44Å; V17-I21 WeakPolarHBondContact O-CG1 3.38Å; V17-I21 PolarHBondContact O-N 3.08Å; M18-I21 HydrophobicContact CE-CD1 3.74Å; M18-I21 PolarHBondContact O-N 3.41Å; I21-D23 PolarHBondContact O-N 2.87Å; I21-E24 PolarHBondContact O-N 2.02Å; I21-C25 VanDerWaalsContact O-CB 3.29Å; I21-C25 WeakPolarHBondContact O-CB 3.33Å; I21-C25 PolarHBondContact O-N 3.13Å; I21-C25 PolarHBondContact O-SG 2.84Å; I21-F51 HydrophobicContact CB-CE2 4.27Å; I21-F51 HydrophobicContact CB-CZ 4.44Å; I21-F51 HydrophobicContact CG2-CE2 3.68Å; I21-F51 HydrophobicContact CG2-CZ 4Å; I21-L55 HydrophobicContact CD1-CD1 3.72Å; I21-L55 HydrophobicContact CG2-CD1 3.92Å; I21-F58 HydrophobicContact CG2-CD2 3.86Å; I21-F58 HydrophobicContact CG2-CE2 3.81Å
22	C	93.7	Very high	93.5	Very high	0 Å²	0	75 Å²	75	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-55.9	-40.9	173.8	-65.3	0	0	0	0	112.2	M18 D19 R20 H26 C40 F46	M18-C22 PolarHBondContact O-N 2.88Å; M18-C22 PolarHBondContact O-SG 3.18Å; D19-C22 WeakPolarHBondContact O-CB 3.33Å; D19-C22 PolarHBondContact O-N 2.91Å; R20-C22 VanDerWaalsContact C-N 3.31Å; R20-C22 PolarHBondContact O-N 2.9Å; C22-H26 VanDerWaalsContact O-CB 3.31Å; C22-H26 WeakPolarHBondContact O-CB 3.34Å; C22-H26 PolarHBondContact O-N 3.13Å; C22-C40 VanDerWaalsContact CA-SG 3.6Å; C22-C40 HydrophobicContact CB-CB 3.64Å; C22-C40 WeakPolarHBondContact CB-SG 3.17Å; C22-C40 WeakPolarHBondContact SG-CB 3.26Å; C22-C40 CovalentContact SG-SG 2.02Å; C22-C40 PolarHBondContact SG-SG 2.83Å; C22-F46 VanDerWaalsContact SG-CE1 3.57Å
23	D	94.5	Very high	93.5	Very high	55 Å²	55	68 Å²	68	29%	0.294	35%	0.352	S	S	.	.	H	α-helix	trans	-69.4	-43.2	-179	-70.7	-5.2	0	0	0	111	D19 R20 I21 H26 N27 R37 R41	D19-D23 PolarHBondContact O-N 3.22Å; R20-D23 PolarHBondContact O-N 2.79Å; R20-D23 VanDerWaalsContact O-N 3.14Å; I21-D23 PolarHBondContact O-N 2.87Å; D23-H26 PolarHBondContact O-N 3.39Å; D23-N27 PolarHBondContact O-N 3.3Å; D23-R37 WeakPolarHBondContact OD1-CD 3.45Å; D23-R37 WeakPolarHBondContact OD1-CG 3.31Å; D23-R37 IonicContact OD1-CZ 3.47Å; D23-R37 IonicContact OD1-NE 3.58Å; D23-R37 PolarHBondContact OD1-NE 3.32Å; D23-R37 IonicContact OD1-NH2 2.76Å; D23-R37 IonicContact OD2-NE 2.64Å; D23-R37 IonicContact OD2-NH2 3.15Å; D23-R41 VanDerWaalsContact CG-NH2 3.33Å; D23-R41 IonicContact OD1-CZ 3.73Å; D23-R41 IonicContact OD1-NH2 3.93Å; D23-R41 PolarHBondContact OD1-NH2 2.7Å; D23-R41 IonicContact OD2-NH2 3.75Å; D23-R41 PolarHBondContact OD2-NH2 2.86Å; D23-R41 VanDerWaalsContact OD2-NH2 3.15Å
24	E	94.3	Very high	93.5	Very high	99 Å²	99	68.6 Å²	68.6	46%	0.463	35%	0.35	S	S	.	.	H	α-helix	trans	-64.7	-45.1	174.5	-64.9	-54.8	148.5	0	0	112.1	R20 I21 H26 N27 M28 F58	R20-E24 PolarHBondContact O-N 3.36Å; I21-E24 PolarHBondContact O-N 2.02Å; E24-H26 VanDerWaalsContact C-N 3.3Å; E24-H26 PolarHBondContact O-N 3.23Å; E24-N27 WeakPolarHBondContact O-CB 3.44Å; E24-N27 PolarHBondContact O-N 3.47Å; E24-M28 WeakPolarHBondContact O-CG 2.94Å; E24-M28 PolarHBondContact O-N 3.38Å; E24-F58 HydrophobicContact CB-CZ 3.83Å; E24-F58 HydrophobicContact CG-CZ 4.47Å
25	C	93.9	Very high	93.5	Very high	0 Å²	0	70 Å²	70	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-41.2	176.6	-68.4	0	0	0	0	112.1	I21 N27 M28 F29 L36 F51 C54	I21-C25 VanDerWaalsContact O-CB 3.29Å; I21-C25 WeakPolarHBondContact O-CB 3.33Å; I21-C25 PolarHBondContact O-N 3.13Å; I21-C25 PolarHBondContact O-SG 2.84Å; C25-N27 VanDerWaalsContact C-N 3.31Å; C25-N27 PolarHBondContact O-N 3.2Å; C25-M28 PolarHBondContact O-N 3.21Å; C25-F29 WeakPolarHBondContact O-CB 3.04Å; C25-F29 WeakPolarHBondContact O-CD2 3.43Å; C25-F29 PolarHBondContact O-N 3.37Å; C25-L36 HydrophobicContact CB-CD2 4.06Å; C25-F51 HydrophobicContact CB-CD2 4.29Å; C25-C54 WeakPolarHBondContact CA-SG 3.15Å; C25-C54 HydrophobicContact CB-CB 3.68Å; C25-C54 WeakPolarHBondContact CB-SG 3.4Å; C25-C54 WeakPolarHBondContact SG-CB 3.26Å; C25-C54 CovalentContact SG-SG 2.01Å; C25-C54 PolarHBondContact SG-SG 2.64Å
26	H	95	Very high	93.5	Very high	54 Å²	54	67.3 Å²	67.3	25%	0.25	35%	0.345	C	S	.	.	H	α-helix	trans	-59.9	-43.7	173.4	172.3	66.1	0	0	0	111.2	C22 D23 E24 M28 F29 R30 P34 R37	C22-H26 VanDerWaalsContact O-CB 3.31Å; C22-H26 WeakPolarHBondContact O-CB 3.34Å; C22-H26 PolarHBondContact O-N 3.13Å; D23-H26 PolarHBondContact O-N 3.39Å; E24-H26 VanDerWaalsContact C-N 3.3Å; E24-H26 PolarHBondContact O-N 3.23Å; H26-M28 PolarHBondContact O-N 3.46Å; H26-F29 PolarHBondContact O-N 3Å; H26-R30 VanDerWaalsContact O-CA 3.25Å; H26-R30 WeakPolarHBondContact O-CA 3.35Å; H26-R30 WeakPolarHBondContact O-CB 3.12Å; H26-R30 PolarHBondContact O-N 3.2Å; H26-P34 PolarHBondContact CE1-O 3.36Å; H26-P34 PolarHBondContact ND1-O 2.84Å; H26-R37 HydrophobicContact CB-CB 3.76Å
27	N	94.4	Very high	93.4	Very high	105 Å²	105	70.5 Å²	70.5	56%	0.561	35%	0.348	S	S	*	.	H	α-helix	trans	-61.5	-42.9	177.2	-172.4	41.5	0	0	0	112.2	D23 E24 C25 R30	D23-N27 PolarHBondContact O-N 3.3Å; E24-N27 WeakPolarHBondContact O-CB 3.44Å; E24-N27 PolarHBondContact O-N 3.47Å; C25-N27 VanDerWaalsContact C-N 3.31Å; C25-N27 PolarHBondContact O-N 3.2Å; N27-R30 WeakPolarHBondContact O-CG 3.46Å
28	M	92.5	Very high	93.3	Very high	95 Å²	95	69 Å²	69	47%	0.468	34%	0.343	S	S	.	.	H	α-helix	trans	-68.7	-41.7	179.6	-64.9	-178.3	77.8	0	0	113.1	E24 C25 H26 I57	E24-M28 WeakPolarHBondContact O-CG 2.94Å; E24-M28 PolarHBondContact O-N 3.38Å; C25-M28 PolarHBondContact O-N 3.21Å; H26-M28 PolarHBondContact O-N 3.46Å; M28-I57 HydrophobicContact CE-CD1 3.73Å; M28-I57 HydrophobicContact CE-CG2 4.43Å; M28-I57 HydrophobicContact SD-CD1 4.37Å
29	F	94.4	Very high	93.2	Very high	49 Å²	49	71.9 Å²	71.9	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-110.1	12.5	-171.3	-64.3	-78.4	0	0	0	114.1	C25 H26 H31 A32 D33 L36 L50 C54 I57	C25-F29 WeakPolarHBondContact O-CB 3.04Å; C25-F29 WeakPolarHBondContact O-CD2 3.43Å; C25-F29 PolarHBondContact O-N 3.37Å; H26-F29 PolarHBondContact O-N 3Å; F29-H31 PolarHBondContact O-N 2.76Å; F29-A32 PolarHBondContact O-N 3.15Å; F29-D33 PolarHBondContact O-N 3.33Å; F29-L36 HydrophobicContact CB-CD2 3.75Å; F29-L36 HydrophobicContact CD2-CD2 4.38Å; F29-L36 HydrophobicContact CG-CD2 4.45Å; F29-L50 HydrophobicContact CB-CD1 4.3Å; F29-L50 HydrophobicContact CB-CD2 4.11Å; F29-L50 HydrophobicContact CB-CG 4.31Å; F29-L50 HydrophobicContact CD1-CD1 3.76Å; F29-L50 HydrophobicContact CE1-CD1 4.18Å; F29-L50 HydrophobicContact CG-CD1 3.96Å; F29-L50 HydrophobicContact CG-CG 4.33Å; F29-C54 HydrophobicContact CD2-CB 3.9Å; F29-C54 HydrophobicContact CE2-CB 3.46Å; F29-C54 VanDerWaalsContact CE2-CB 3.46Å; F29-C54 HydrophobicContact CZ-CB 4.47Å; F29-I57 HydrophobicContact CE2-CD1 4Å; F29-I57 HydrophobicContact CZ-CD1 3.94Å
30	R	94.2	Very high	93	Very high	126 Å²	126	70.3 Å²	70.3	48%	0.475	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-30.7	179.6	55.4	-171.7	-73.8	-106.2	5.2	114.4	H26 N27 P34	H26-R30 VanDerWaalsContact O-CA 3.25Å; H26-R30 WeakPolarHBondContact O-CA 3.35Å; H26-R30 WeakPolarHBondContact O-CB 3.12Å; H26-R30 PolarHBondContact O-N 3.2Å; N27-R30 WeakPolarHBondContact O-CG 3.46Å; R30-P34 WeakPolarHBondContact O-CA 3.41Å
31	H	94.3	Very high	92.6	Very high	160 Å²	160	63.8 Å²	63.8	74%	0.741	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-30.5	178.7	-66.8	-70.2	0	0	0	113	F29	F29-H31 PolarHBondContact O-N 2.76Å
32	A	93.5	Very high	92.2	Very high	78 Å²	78	70 Å²	70	65%	0.645	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-40.2	176.5	0	0	0	0	0	111.4	F29	F29-A32 PolarHBondContact O-N 3.15Å
33	D	92.7	Very high	91.5	Very high	19 Å²	19	71.4 Å²	71.4	10%	0.102	36%	0.357	C	S	.	.			trans	-145.6	98	177.2	-169.1	-8.8	0	0	0	111.3	F29 N35 L36 K39 L50	F29-D33 PolarHBondContact O-N 3.33Å; D33-N35 PolarHBondContact O-N 3.45Å; D33-N35 VanDerWaalsContact O-N 3.16Å; D33-N35 PolarHBondContact OD1-N 2.8Å; D33-N35 VanDerWaalsContact OD1-N 3.08Å; D33-L36 HydrophobicContact CB-CB 4.14Å; D33-L36 VanDerWaalsContact O-CB 3.3Å; D33-L36 WeakPolarHBondContact O-CB 3.28Å; D33-L36 PolarHBondContact O-N 2.78Å; D33-L36 VanDerWaalsContact O-N 3.11Å; D33-L36 PolarHBondContact OD1-N 3.18Å; D33-K39 IonicContact OD1-NZ 3.61Å; D33-K39 PolarHBondContact OD1-NZ 2.92Å; D33-K39 WeakPolarHBondContact OD2-CD 3.34Å; D33-K39 WeakPolarHBondContact OD2-CE 3.03Å; D33-K39 IonicContact OD2-NZ 3.5Å; D33-K39 PolarHBondContact OD2-NZ 3.29Å; D33-L50 HydrophobicContact CB-CD2 3.49Å; D33-L50 VanDerWaalsContact CB-CD2 3.49Å
34	P	93.7	Very high	90.9	Very high	85 Å²	85	74.7 Å²	74.7	55%	0.552	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.1	-179.8	27	-34.8	0	0	0	112.7	H26 R30	H26-P34 PolarHBondContact CE1-O 3.36Å; H26-P34 PolarHBondContact ND1-O 2.84Å; R30-P34 WeakPolarHBondContact O-CA 3.41Å
35	N	92.6	Very high	90.6	Very high	101 Å²	101	71.3 Å²	71.3	54%	0.54	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	9.6	178	-68.8	-51.6	0	0	0	112.8	D33 R37 A38 K39	D33-N35 PolarHBondContact O-N 3.45Å; D33-N35 VanDerWaalsContact O-N 3.16Å; D33-N35 PolarHBondContact OD1-N 2.8Å; D33-N35 VanDerWaalsContact OD1-N 3.08Å; N35-R37 PolarHBondContact O-N 3.46Å; N35-A38 PolarHBondContact O-N 2.93Å; N35-K39 HydrophobicContact CB-CD 4.45Å; N35-K39 WeakPolarHBondContact O-CG 3.22Å; N35-K39 PolarHBondContact O-N 3.06Å
36	L	91.4	Very high	90.3	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-54	-40.1	-175.6	-177.3	56.1	0	0	0	112.6	C25 F29 D33 A38 K39 C40 L50 F51	C25-L36 HydrophobicContact CB-CD2 4.06Å; F29-L36 HydrophobicContact CB-CD2 3.75Å; F29-L36 HydrophobicContact CD2-CD2 4.38Å; F29-L36 HydrophobicContact CG-CD2 4.45Å; D33-L36 HydrophobicContact CB-CB 4.14Å; D33-L36 VanDerWaalsContact O-CB 3.3Å; D33-L36 WeakPolarHBondContact O-CB 3.28Å; D33-L36 PolarHBondContact O-N 2.78Å; D33-L36 VanDerWaalsContact O-N 3.11Å; D33-L36 PolarHBondContact OD1-N 3.18Å; L36-A38 PolarHBondContact O-N 3.44Å; L36-K39 PolarHBondContact O-N 3.17Å; L36-C40 WeakPolarHBondContact O-CB 3.16Å; L36-C40 PolarHBondContact O-N 3.06Å; L36-L50 HydrophobicContact CD1-CB 4.14Å; L36-L50 HydrophobicContact CD1-CD2 4.03Å; L36-L50 HydrophobicContact CD1-CG 4.15Å; L36-L50 HydrophobicContact CD2-CD2 3.84Å; L36-L50 HydrophobicContact CD2-CG 3.93Å; L36-L50 HydrophobicContact CG-CD2 4.4Å; L36-F51 HydrophobicContact CD1-CB 4.42Å
37	R	91.5	Very high	89.9	Confident	112 Å²	112	73.3 Å²	73.3	42%	0.423	37%	0.367	S	S	.	.	H	α-helix	trans	-56.1	-50.6	176.7	-171.9	-177.8	-177.2	-151.7	5	112.3	D23 H26 N35 C40 R41	D23-R37 WeakPolarHBondContact OD1-CD 3.45Å; D23-R37 WeakPolarHBondContact OD1-CG 3.31Å; D23-R37 IonicContact OD1-CZ 3.47Å; D23-R37 IonicContact OD1-NE 3.58Å; D23-R37 PolarHBondContact OD1-NE 3.32Å; D23-R37 IonicContact OD1-NH2 2.76Å; D23-R37 IonicContact OD2-NE 2.64Å; D23-R37 IonicContact OD2-NH2 3.15Å; H26-R37 HydrophobicContact CB-CB 3.76Å; N35-R37 PolarHBondContact O-N 3.46Å; R37-C40 WeakPolarHBondContact O-CB 3.5Å; R37-C40 PolarHBondContact O-N 3.05Å; R37-R41 PolarHBondContact O-N 3.3Å
38	A	90.6	Very high	89.5	Confident	43 Å²	43	69.9 Å²	69.9	36%	0.355	35%	0.349	S	S	.	.	H	α-helix	trans	-68.3	-41.6	-179.6	0	0	0	0	0	110.9	N35 L36 C40 R41 Y42	N35-A38 PolarHBondContact O-N 2.93Å; L36-A38 PolarHBondContact O-N 3.44Å; A38-C40 VanDerWaalsContact C-N 3.33Å; A38-C40 PolarHBondContact O-N 3.4Å; A38-R41 PolarHBondContact O-N 3.14Å; A38-Y42 HydrophobicContact CB-CD2 4.2Å; A38-Y42 HydrophobicContact CB-CE2 4.47Å; A38-Y42 WeakPolarHBondContact O-CB 3.49Å; A38-Y42 WeakPolarHBondContact O-CD2 3.19Å; A38-Y42 PolarHBondContact O-N 2.65Å
39	K	90.1	Very high	89.4	Confident	84 Å²	84	71.8 Å²	71.8	37%	0.365	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-42	175.9	-71.6	171.6	177.3	170.6	0	111.5	D33 N35 L36 R41 A43	D33-K39 IonicContact OD1-NZ 3.61Å; D33-K39 PolarHBondContact OD1-NZ 2.92Å; D33-K39 WeakPolarHBondContact OD2-CD 3.34Å; D33-K39 WeakPolarHBondContact OD2-CE 3.03Å; D33-K39 IonicContact OD2-NZ 3.5Å; D33-K39 PolarHBondContact OD2-NZ 3.29Å; N35-K39 HydrophobicContact CB-CD 4.45Å; N35-K39 WeakPolarHBondContact O-CG 3.22Å; N35-K39 PolarHBondContact O-N 3.06Å; L36-K39 PolarHBondContact O-N 3.17Å; K39-R41 VanDerWaalsContact C-N 3.33Å; K39-R41 PolarHBondContact O-N 3.45Å; K39-A43 WeakPolarHBondContact O-CA 3.31Å; K39-A43 WeakPolarHBondContact O-CB 3.38Å; K39-A43 PolarHBondContact O-N 2.98Å
40	C	89	Confident	89.2	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.007	36%	0.361	C	S	.	.	H	α-helix	trans	-57.2	-46.2	178.2	-174.3	0	0	0	0	111.9	C22 L36 R37 A38 F46 F51	C22-C40 VanDerWaalsContact CA-SG 3.6Å; C22-C40 HydrophobicContact CB-CB 3.64Å; C22-C40 WeakPolarHBondContact CB-SG 3.17Å; C22-C40 WeakPolarHBondContact SG-CB 3.26Å; C22-C40 CovalentContact SG-SG 2.02Å; C22-C40 PolarHBondContact SG-SG 2.83Å; L36-C40 WeakPolarHBondContact O-CB 3.16Å; L36-C40 PolarHBondContact O-N 3.06Å; R37-C40 WeakPolarHBondContact O-CB 3.5Å; R37-C40 PolarHBondContact O-N 3.05Å; A38-C40 VanDerWaalsContact C-N 3.33Å; A38-C40 PolarHBondContact O-N 3.4Å; C40-F46 WeakPolarHBondContact O-CA 3.38Å; C40-F46 WeakPolarHBondContact O-CD1 3.17Å; C40-F51 HydrophobicContact CB-CD2 4.25Å; C40-F51 WeakPolarHBondContact SG-CD2 3.45Å; C40-F51 WeakPolarHBondContact SG-CE2 3.29Å
41	R	86.2	Confident	89	Confident	49 Å²	49	65.6 Å²	65.6	19%	0.185	34%	0.34	C	S	.	.	H	α-helix	trans	-75.6	-46.9	-179.6	-60.6	-177.9	-169.5	-163	-3.1	112.3	Y9 D19 D23 R37 A38 K39	Y9-R41 PolarHBondContact OH-O 3.09Å; D19-R41 WeakPolarHBondContact OD1-CG 3.09Å; D19-R41 IonicContact OD1-CZ 3.73Å; D19-R41 IonicContact OD1-NE 3.76Å; D19-R41 PolarHBondContact OD1-NE 2.82Å; D19-R41 IonicContact OD2-CZ 2.7Å; D19-R41 IonicContact OD2-NH1 2.9Å; D23-R41 VanDerWaalsContact CG-NH2 3.33Å; D23-R41 IonicContact OD1-CZ 3.73Å; D23-R41 IonicContact OD1-NH2 3.93Å; D23-R41 PolarHBondContact OD1-NH2 2.7Å; D23-R41 IonicContact OD2-NH2 3.75Å; D23-R41 PolarHBondContact OD2-NH2 2.86Å; D23-R41 VanDerWaalsContact OD2-NH2 3.15Å; R37-R41 PolarHBondContact O-N 3.3Å; A38-R41 PolarHBondContact O-N 3.14Å; K39-R41 VanDerWaalsContact C-N 3.33Å; K39-R41 PolarHBondContact O-N 3.45Å
42	Y	83.1	Confident	88.8	Confident	154 Å²	154	61.5 Å²	61.5	60%	0.604	33%	0.326	S	S	*	.	H	α-helix	trans	-96.6	-17.2	-169	-58.1	-62.8	0	0	0	114.5	V3 A38	V3-Y42 WeakPolarHBondContact CG2-O 3.38Å; A38-Y42 HydrophobicContact CB-CD2 4.2Å; A38-Y42 HydrophobicContact CB-CE2 4.47Å; A38-Y42 WeakPolarHBondContact O-CB 3.49Å; A38-Y42 WeakPolarHBondContact O-CD2 3.19Å; A38-Y42 PolarHBondContact O-N 2.65Å
43	A	79	Confident	88.7	Confident	30 Å²	30	61.8 Å²	61.8	25%	0.248	32%	0.32	C	S	.	.	S	Bend	trans	-89.5	120.8	-179.9	0	0	0	0	0	110.6	K39 C45 F46	K39-A43 WeakPolarHBondContact O-CA 3.31Å; K39-A43 WeakPolarHBondContact O-CB 3.38Å; K39-A43 PolarHBondContact O-N 2.98Å; A43-C45 PolarHBondContact O-N 3.02Å; A43-F46 PolarHBondContact O-N 2.96Å
44	K	83.5	Confident	88.7	Confident	124 Å²	124	60.9 Å²	60.9	54%	0.539	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	29.7	159.6	-59.1	-174.9	-177.1	175.5	0	116.3	D47	K44-D47 HydrophobicContact CB-CB 3.84Å; K44-D47 VanDerWaalsContact O-CB 3.26Å; K44-D47 WeakPolarHBondContact O-CB 3.44Å
45	C	87.3	Confident	88.5	Confident	29 Å²	29	58.2 Å²	58.2	20%	0.196	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	63	59.5	-177.8	-170.3	0	0	0	0	113.5	C6 A43 D47	C6-C45 WeakPolarHBondContact CA-SG 3.41Å; C6-C45 HydrophobicContact CB-CB 3.48Å; C6-C45 VanDerWaalsContact CB-CB 3.48Å; C6-C45 WeakPolarHBondContact CB-SG 3.39Å; C6-C45 WeakPolarHBondContact SG-CA 3.32Å; C6-C45 WeakPolarHBondContact SG-CB 3.39Å; C6-C45 CovalentContact SG-SG 2.02Å; C6-C45 PolarHBondContact SG-SG 3.12Å; A43-C45 PolarHBondContact O-N 3.02Å; C45-D47 PolarHBondContact O-N 3.42Å; C45-D47 VanDerWaalsContact O-N 3.13Å
46	F	87.8	Confident	88.3	Confident	12 Å²	12	56.2 Å²	56.2	5%	0.053	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	14	-179.4	-51.5	-94.3	0	0	0	113.9	I8 Y9 M18 C22 C40 A43 N48 F51	I8-F46 HydrophobicContact CB-CD2 4.17Å; I8-F46 HydrophobicContact CB-CE2 3.99Å; I8-F46 HydrophobicContact CD1-CB 4.24Å; I8-F46 HydrophobicContact CD1-CD2 3.47Å; I8-F46 VanDerWaalsContact CD1-CD2 3.47Å; I8-F46 HydrophobicContact CD1-CE2 4.16Å; I8-F46 HydrophobicContact CD1-CG 4.11Å; I8-F46 HydrophobicContact CG1-CD2 4.41Å; I8-F46 HydrophobicContact CG2-CD2 4.02Å; I8-F46 HydrophobicContact CG2-CE2 3.53Å; I8-F46 HydrophobicContact CG2-CZ 4.2Å; Y9-F46 HydrophobicContact CD1-CE2 4.34Å; Y9-F46 AromaticContact CE1-CE2 3.72Å; Y9-F46 HydrophobicContact CE1-CE2 3.72Å; Y9-F46 AromaticContact CE1-CZ 3.83Å; Y9-F46 HydrophobicContact CE1-CZ 3.83Å; M18-F46 HydrophobicContact CB-CD1 3.76Å; M18-F46 HydrophobicContact CB-CE1 3.41Å; M18-F46 VanDerWaalsContact CB-CE1 3.41Å; M18-F46 HydrophobicContact CB-CE2 4.33Å; M18-F46 HydrophobicContact CB-CG 4.36Å; M18-F46 HydrophobicContact CB-CZ 3.73Å; M18-F46 HydrophobicContact CG-CD1 4.42Å; M18-F46 HydrophobicContact CG-CE1 4.41Å; C22-F46 VanDerWaalsContact SG-CE1 3.57Å; C40-F46 WeakPolarHBondContact O-CA 3.38Å; C40-F46 WeakPolarHBondContact O-CD1 3.17Å; A43-F46 PolarHBondContact O-N 2.96Å; F46-N48 PolarHBondContact O-N 2.93Å; F46-F51 HydrophobicContact CB-CD1 4.27Å; F46-F51 HydrophobicContact CB-CE1 3.87Å; F46-F51 HydrophobicContact CD1-CE1 4.39Å; F46-F51 HydrophobicContact CD1-CZ 4.35Å; F46-F51 WeakPolarHBondContact O-CD1 3.39Å
47	D	86	Confident	88.1	Confident	83 Å²	83	60.5 Å²	60.5	44%	0.444	32%	0.315	S	S	.	.			trans	-90.6	91.7	176.9	178.4	33.3	0	0	0	110.2	K44 C45	K44-D47 HydrophobicContact CB-CB 3.84Å; K44-D47 VanDerWaalsContact O-CB 3.26Å; K44-D47 WeakPolarHBondContact O-CB 3.44Å; C45-D47 PolarHBondContact O-N 3.42Å; C45-D47 VanDerWaalsContact O-N 3.13Å
48	N	87.5	Confident	87.6	Confident	34 Å²	34	59.6 Å²	59.6	18%	0.182	32%	0.315	C	S	.	.			trans	-147.4	132.8	178.8	175.6	-79.5	0	0	0	109.5	F46 L50 F51 T52	F46-N48 PolarHBondContact O-N 2.93Å; N48-L50 VanDerWaalsContact C-N 3.33Å; N48-L50 PolarHBondContact O-N 3.49Å; N48-L50 WeakPolarHBondContact OD1-CB 3.46Å; N48-L50 PolarHBondContact OD1-N 3.2Å; N48-F51 HydrophobicContact CB-CB 3.95Å; N48-F51 PolarHBondContact O-N 3.42Å; N48-F51 PolarHBondContact OD1-N 2.94Å; N48-T52 WeakPolarHBondContact O-CB 3.41Å; N48-T52 PolarHBondContact O-N 2.75Å; N48-T52 PolarHBondContact O-OG1 3.02Å
49	D	90.4	Very high	87	Confident	135 Å²	135	63.4 Å²	63.4	72%	0.722	32%	0.323	S	S	*	.	H	α-helix	trans	-59.6	-41.6	-174.4	-58.9	-46.7	0	0	0	113	T52 T53	D49-T52 PolarHBondContact O-N 3.44Å; D49-T53 WeakPolarHBondContact O-CB 2.94Å; D49-T53 PolarHBondContact O-N 3.02Å; D49-T53 PolarHBondContact O-OG1 2.78Å
50	L	89.5	Confident	85.8	Confident	41 Å²	41	64.3 Å²	64.3	22%	0.215	34%	0.338	C	S	.	.	H	α-helix	trans	-70.7	-39	179.6	-174.1	61.4	0	0	0	111.1	F29 D33 L36 N48 T53 C54	F29-L50 HydrophobicContact CB-CD1 4.3Å; F29-L50 HydrophobicContact CB-CD2 4.11Å; F29-L50 HydrophobicContact CB-CG 4.31Å; F29-L50 HydrophobicContact CD1-CD1 3.76Å; F29-L50 HydrophobicContact CE1-CD1 4.18Å; F29-L50 HydrophobicContact CG-CD1 3.96Å; F29-L50 HydrophobicContact CG-CG 4.33Å; D33-L50 HydrophobicContact CB-CD2 3.49Å; D33-L50 VanDerWaalsContact CB-CD2 3.49Å; L36-L50 HydrophobicContact CD1-CB 4.14Å; L36-L50 HydrophobicContact CD1-CD2 4.03Å; L36-L50 HydrophobicContact CD1-CG 4.15Å; L36-L50 HydrophobicContact CD2-CD2 3.84Å; L36-L50 HydrophobicContact CD2-CG 3.93Å; L36-L50 HydrophobicContact CG-CD2 4.4Å; N48-L50 VanDerWaalsContact C-N 3.33Å; N48-L50 PolarHBondContact O-N 3.49Å; N48-L50 WeakPolarHBondContact OD1-CB 3.46Å; N48-L50 PolarHBondContact OD1-N 3.2Å; L50-T53 PolarHBondContact O-N 3.33Å; L50-C54 WeakPolarHBondContact O-CB 3.18Å; L50-C54 PolarHBondContact O-N 3.32Å
51	F	89.9	Confident	84.3	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.018	38%	0.375	C	S	.	.	H	α-helix	trans	-64.7	-43.8	172.7	178.1	-107.5	0	0	0	111.8	M18 I21 C25 L36 C40 F46 N48 T53 C54 L55	M18-F51 HydrophobicContact SD-CZ 4.33Å; I21-F51 HydrophobicContact CB-CE2 4.27Å; I21-F51 HydrophobicContact CB-CZ 4.44Å; I21-F51 HydrophobicContact CG2-CE2 3.68Å; I21-F51 HydrophobicContact CG2-CZ 4Å; C25-F51 HydrophobicContact CB-CD2 4.29Å; L36-F51 HydrophobicContact CD1-CB 4.42Å; C40-F51 HydrophobicContact CB-CD2 4.25Å; C40-F51 WeakPolarHBondContact SG-CD2 3.45Å; C40-F51 WeakPolarHBondContact SG-CE2 3.29Å; F46-F51 HydrophobicContact CB-CD1 4.27Å; F46-F51 HydrophobicContact CB-CE1 3.87Å; F46-F51 HydrophobicContact CD1-CE1 4.39Å; F46-F51 HydrophobicContact CD1-CZ 4.35Å; F46-F51 WeakPolarHBondContact O-CD1 3.39Å; N48-F51 HydrophobicContact CB-CB 3.95Å; N48-F51 PolarHBondContact O-N 3.42Å; N48-F51 PolarHBondContact OD1-N 2.94Å; F51-T53 VanDerWaalsContact C-N 3.3Å; F51-T53 PolarHBondContact O-N 3.04Å; F51-C54 CarbonylContact O-C 3.56Å; F51-C54 WeakPolarHBondContact O-CB 3.47Å; F51-C54 PolarHBondContact O-N 2.9Å; F51-C54 VanDerWaalsContact O-N 3.12Å; F51-L55 HydrophobicContact CE1-CD2 4.35Å; F51-L55 HydrophobicContact CZ-CD1 4.45Å; F51-L55 WeakPolarHBondContact O-CB 3.48Å; F51-L55 PolarHBondContact O-N 3.29Å
52	T	90.2	Very high	82.6	Confident	73 Å²	73	74.2 Å²	74.2	45%	0.448	40%	0.404	S	S	.	.	H	α-helix	trans	-62	-41	178.5	-55	0	0	0	0	110.9	N48 D49 L55 A56	N48-T52 WeakPolarHBondContact O-CB 3.41Å; N48-T52 PolarHBondContact O-N 2.75Å; N48-T52 PolarHBondContact O-OG1 3.02Å; D49-T52 PolarHBondContact O-N 3.44Å; T52-L55 PolarHBondContact O-N 2.01Å; T52-A56 PolarHBondContact O-N 3.08Å
53	T	90.9	Very high	81.1	Confident	84 Å²	84	75.1 Å²	75.1	52%	0.515	41%	0.414	S	S	.	.	H	α-helix	trans	-61.4	-44.1	173	-58.3	0	0	0	0	111.6	D49 L50 F51 A56	D49-T53 WeakPolarHBondContact O-CB 2.94Å; D49-T53 PolarHBondContact O-N 3.02Å; D49-T53 PolarHBondContact O-OG1 2.78Å; L50-T53 PolarHBondContact O-N 3.33Å; F51-T53 VanDerWaalsContact C-N 3.3Å; F51-T53 PolarHBondContact O-N 3.04Å; T53-A56 WeakPolarHBondContact O-CB 3.39Å; T53-A56 PolarHBondContact O-N 3.11Å
54	C	92.3	Very high	79.9	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-65	-42.9	175.2	178.6	0	0	0	0	112.4	C25 F29 L50 F51 A56 I57 F58	C25-C54 WeakPolarHBondContact CA-SG 3.15Å; C25-C54 HydrophobicContact CB-CB 3.68Å; C25-C54 WeakPolarHBondContact CB-SG 3.4Å; C25-C54 WeakPolarHBondContact SG-CB 3.26Å; C25-C54 CovalentContact SG-SG 2.01Å; C25-C54 PolarHBondContact SG-SG 2.64Å; F29-C54 HydrophobicContact CD2-CB 3.9Å; F29-C54 HydrophobicContact CE2-CB 3.46Å; F29-C54 VanDerWaalsContact CE2-CB 3.46Å; F29-C54 HydrophobicContact CZ-CB 4.47Å; L50-C54 WeakPolarHBondContact O-CB 3.18Å; L50-C54 PolarHBondContact O-N 3.32Å; F51-C54 CarbonylContact O-C 3.56Å; F51-C54 WeakPolarHBondContact O-CB 3.47Å; F51-C54 PolarHBondContact O-N 2.9Å; F51-C54 VanDerWaalsContact O-N 3.12Å; C54-A56 PolarHBondContact O-N 3.16Å; C54-I57 WeakPolarHBondContact O-CB 2.93Å; C54-I57 WeakPolarHBondContact O-CG1 3.3Å; C54-I57 PolarHBondContact O-N 3.47Å; C54-F58 WeakPolarHBondContact O-CD2 3.25Å
55	L	89.4	Confident	78.3	Confident	30 Å²	30	81.7 Å²	81.7	16%	0.157	45%	0.454	C	S	.	.	H	α-helix	trans	-59.8	-36.3	179.1	-174.7	68.7	0	0	0	111	I21 F51 T52 I57 F58 F59	I21-L55 HydrophobicContact CD1-CD1 3.72Å; I21-L55 HydrophobicContact CG2-CD1 3.92Å; F51-L55 HydrophobicContact CE1-CD2 4.35Å; F51-L55 HydrophobicContact CZ-CD1 4.45Å; F51-L55 WeakPolarHBondContact O-CB 3.48Å; F51-L55 PolarHBondContact O-N 3.29Å; T52-L55 PolarHBondContact O-N 2.01Å; L55-I57 PolarHBondContact O-N 3.06Å; L55-F58 PolarHBondContact O-N 3.1Å; L55-F59 HydrophobicContact CD1-CE2 4.17Å; L55-F59 HydrophobicContact CD1-CZ 4.33Å; L55-F59 HydrophobicContact CD2-CE2 3.68Å; L55-F59 HydrophobicContact CD2-CZ 4.1Å; L55-F59 HydrophobicContact CG-CD2 4.17Å; L55-F59 HydrophobicContact CG-CE2 3.44Å; L55-F59 VanDerWaalsContact CG-CE2 3.44Å; L55-F59 HydrophobicContact CG-CZ 4.02Å; L55-F59 VanDerWaalsContact O-CD2 3.28Å; L55-F59 WeakPolarHBondContact O-CD2 3.41Å; L55-F59 PolarHBondContact O-N 3.47Å
56	A	89.3	Confident	76.6	Confident	59 Å²	59	85.1 Å²	85.1	49%	0.488	48%	0.476	S	S	.	.	H	α-helix	trans	-59.5	-24.1	173.4	0	0	0	0	0	113.9	T52 T53 C54 F58	T52-A56 PolarHBondContact O-N 3.08Å; T53-A56 WeakPolarHBondContact O-CB 3.39Å; T53-A56 PolarHBondContact O-N 3.11Å; C54-A56 PolarHBondContact O-N 3.16Å; A56-F58 VanDerWaalsContact C-N 3.33Å
57	I	86.9	Confident	74.9	Confident	90 Å²	90	90.3 Å²	90.3	46%	0.462	51%	0.511	S	S	.	.	H	α-helix	trans	-69.4	-35.5	175.2	-55.7	173.1	0	0	0	110.7	M28 F29 C54 L55	M28-I57 HydrophobicContact CE-CD1 3.73Å; M28-I57 HydrophobicContact CE-CG2 4.43Å; M28-I57 HydrophobicContact SD-CD1 4.37Å; F29-I57 HydrophobicContact CE2-CD1 4Å; F29-I57 HydrophobicContact CZ-CD1 3.94Å; C54-I57 WeakPolarHBondContact O-CB 2.93Å; C54-I57 WeakPolarHBondContact O-CG1 3.3Å; C54-I57 PolarHBondContact O-N 3.47Å; L55-I57 PolarHBondContact O-N 3.06Å
58	F	81.6	Confident	73.6	Confident	92 Å²	92	92 Å²	92	40%	0.404	53%	0.525	S	S	.	.	H	α-helix	trans	-82.5	-15.2	-179.2	-63.3	-74.1	0	0	0	113.6	I21 E24 C54 L55 A56 P60	I21-F58 HydrophobicContact CG2-CD2 3.86Å; I21-F58 HydrophobicContact CG2-CE2 3.81Å; E24-F58 HydrophobicContact CB-CZ 3.83Å; E24-F58 HydrophobicContact CG-CZ 4.47Å; C54-F58 WeakPolarHBondContact O-CD2 3.25Å; L55-F58 PolarHBondContact O-N 3.1Å; A56-F58 VanDerWaalsContact C-N 3.33Å; F58-P60 WeakPolarHBondContact O-CD 3.4Å
59	F	78	Confident	72	Confident	124 Å²	124	99.4 Å²	99.4	54%	0.544	56%	0.555	S	S	.	*	S	Bend	trans	-84.5	100	168	-65.4	-60.5	0	0	0	108.2	L55 A61	L55-F59 HydrophobicContact CD1-CE2 4.17Å; L55-F59 HydrophobicContact CD1-CZ 4.33Å; L55-F59 HydrophobicContact CD2-CE2 3.68Å; L55-F59 HydrophobicContact CD2-CZ 4.1Å; L55-F59 HydrophobicContact CG-CD2 4.17Å; L55-F59 HydrophobicContact CG-CE2 3.44Å; L55-F59 VanDerWaalsContact CG-CE2 3.44Å; L55-F59 HydrophobicContact CG-CZ 4.02Å; L55-F59 VanDerWaalsContact O-CD2 3.28Å; L55-F59 WeakPolarHBondContact O-CD2 3.41Å; L55-F59 PolarHBondContact O-N 3.47Å; F59-A61 PolarHBondContact O-N 2.81Å
60	P	65	Low	70.3	Confident	102 Å²	102	103.8 Å²	103.8	66%	0.662	56%	0.561	S	S	*	*			trans	-59.7	115.8	165.7	26.7	-31.8	0	0	0	105.3	F58 M62	F58-P60 WeakPolarHBondContact O-CD 3.4Å; P60-M62 VanDerWaalsContact C-N 3.3Å; P60-M62 WeakPolarHBondContact O-CA 3.45Å; P60-M62 VanDerWaalsContact O-CG 3.31Å; P60-M62 WeakPolarHBondContact O-CG 3.44Å; P60-M62 PolarHBondContact O-N 3.5Å
61	A	56	Low	68.8	Low	96 Å²	96	107 Å²	107	79%	0.793	58%	0.583	S	S	*	*			trans	-24.7	88.2	-175.1	0	0	0	0	0	112.9	F59 E63	F59-A61 PolarHBondContact O-N 2.81Å; A61-E63 PolarHBondContact O-N 3.45Å
62	M	50.7	Low	67.1	Low	162 Å²	162	112.5 Å²	112.5	80%	0.798	62%	0.617	S	S	*	*			trans	-83.3	59.4	-175.1	-85.5	-85.5	-73	0	0	106.7	P60	P60-M62 VanDerWaalsContact C-N 3.3Å; P60-M62 WeakPolarHBondContact O-CA 3.45Å; P60-M62 VanDerWaalsContact O-CG 3.31Å; P60-M62 WeakPolarHBondContact O-CG 3.44Å; P60-M62 PolarHBondContact O-N 3.5Å
63	E	51.7	Low	65.9	Low	173 Å²	173	120 Å²	120	81%	0.808	64%	0.637	S	S	*	*	S	Bend	trans	-163.1	51.5	169.6	-159.5	94.2	99.5	0	0	110.9	A61	A61-E63 PolarHBondContact O-N 3.45Å
64	L	54.3	Low	64.8	Low	168 Å²	168	123.2 Å²	123.2	88%	0.88	65%	0.65	S	S	*	*	S	Bend	trans	-132.9	-6.8	149.5	-78.3	-176.7	0	0	0	113.8
65	V	50	Low	63.3	Low	124 Å²	124	128.6 Å²	128.6	75%	0.752	69%	0.687	S	S	*	*	S	Bend	trans	-121.1	114.7	175.6	-172.6	0	0	0	0	109.1
66	P	51.2	Low	62.4	Low	102 Å²	102	136 Å²	136	66%	0.662	74%	0.742	S	S	*	*			trans	-58.9	154.7	177.3	24.3	-32.5	0	0	0	110.3	V68	P66-V68 PolarHBondContact O-N 2.88Å; P66-V68 VanDerWaalsContact O-N 3.13Å
67	P	52	Low	61.1	Low	120 Å²	120	139.9 Å²	139.9	78%	0.779	75%	0.754	S	S	*	*			trans	-51.8	122.9	-172.5	20.2	-33.2	0	0	0	110.9	K69	P67-K69 PolarHBondContact O-N 3.38Å
68	V	58.6	Low	59.7	Low	120 Å²	120	142.5 Å²	142.5	73%	0.727	77%	0.77	S	S	*	*			trans	-56.5	108.2	164.7	163	0	0	0	0	106.7	P66 R70	P66-V68 PolarHBondContact O-N 2.88Å; P66-V68 VanDerWaalsContact O-N 3.13Å; V68-R70 VanDerWaalsContact C-N 3.31Å; V68-R70 HydrophobicContact CG1-CG 4.29Å; V68-R70 PolarHBondContact O-N 3.31Å
69	K	53.6	Low	58.5	Low	188 Å²	188	145.3 Å²	145.3	82%	0.817	79%	0.79	S	S	*	*			trans	-61.1	99.8	163.1	-69.4	-172.7	179.7	-171.2	0	106.3	P67 T71	P67-K69 PolarHBondContact O-N 3.38Å; K69-T71 PolarHBondContact O-N 3.06Å
70	R	54.7	Low	57.4	Low	227 Å²	227	146.5 Å²	146.5	86%	0.857	81%	0.805	S	S	*	*			trans	-67.7	80.8	164.7	-76.7	-176.2	173.4	152.2	-1.5	107.5	V68 V72	V68-R70 VanDerWaalsContact C-N 3.31Å; V68-R70 HydrophobicContact CG1-CG 4.29Å; V68-R70 PolarHBondContact O-N 3.31Å; R70-V72 VanDerWaalsContact C-N 3.35Å; R70-V72 PolarHBondContact O-N 2.95Å
71	T	57.6	Low	56.9	Low	109 Å²	109	149.3 Å²	149.3	67%	0.669	81%	0.813	S	S	*	*			trans	-72.8	95.7	168.4	-54.2	0	0	0	0	106.9	K69 R73	K69-T71 PolarHBondContact O-N 3.06Å; T71-R73 PolarHBondContact O-N 2.9Å; T71-R73 VanDerWaalsContact O-N 3.14Å
72	V	54.3	Low	57	Low	120 Å²	120	152.9 Å²	152.9	73%	0.727	82%	0.815	S	S	*	*			trans	-67.5	106.1	164.2	179.8	0	0	0	0	105.9	R70 L74	R70-V72 VanDerWaalsContact C-N 3.35Å; R70-V72 PolarHBondContact O-N 2.95Å; V72-L74 PolarHBondContact O-N 3.44Å; V72-L74 VanDerWaalsContact O-N 3.11Å
73	R	66.5	Low	57.4	Low	231 Å²	231	152.2 Å²	152.2	87%	0.872	82%	0.816	S	S	*	*			trans	-73	101.3	166	-68.2	-166.6	-173.2	-126.7	4.1	106.5	T71 S75	T71-R73 PolarHBondContact O-N 2.9Å; T71-R73 VanDerWaalsContact O-N 3.14Å; R73-S75 PolarHBondContact O-N 3.01Å
74	L	66.1	Low	57.9	Low	151 Å²	151	150.6 Å²	150.6	79%	0.791	82%	0.817	S	S	*	*			trans	-70.9	104.5	165.9	-156.3	76	0	0	0	106.4	V72 S76	V72-L74 PolarHBondContact O-N 3.44Å; V72-L74 VanDerWaalsContact O-N 3.11Å; L74-S76 PolarHBondContact O-N 2.88Å
75	S	62.7	Low	58.2	Low	112 Å²	112	149.2 Å²	149.2	78%	0.783	81%	0.811	S	S	*	*			trans	-64.8	121.5	168.4	37	0	0	0	0	109.1	R73	R73-S75 PolarHBondContact O-N 3.01Å
76	S	70.4	Confident	58.9	Low	186 Å²	186	151.5 Å²	151.5	100%	1.301	82%	0.817	S	S	*	*			trans	-134.9	0	155.1	-71.1	0	0	0	0	107.2	L74	L74-S76 PolarHBondContact O-N 2.88Å

Retrieved 76 of 76 residues in 24.9 ms (Link to these results)

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