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Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit DAD1

Subunit of the oligosaccharyl transferase (OST) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER). All subunits are required for a maximal enzyme activity.

AlphaFold DB , UniProt , Accession A0A077Z740, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 90 aa.

						>A0A077Z740_TRITR|A0A077Z740
MKIIDAYMLCTFLTGVLQFLYCAIVGTFPFNSFLAGFISCVASFVLAASLRIQMNPQNKRQFPGISRERAFADFLMAHVVLHLFVINFIG
					

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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	82.2	Confident	94.7	Very high	91 Å²	91	77.1 Å²	77.1	45%	0.448	40%	0.403	S	S	.	.				0	-66.5	0	-59.5	-44.7	-175.5	0	0	112	I3 I4 D5 M54 N55	M1-I3 PolarHBondContact O-N 3.13Å; M1-I4 WeakPolarHBondContact O-CB 3.49Å; M1-I4 PolarHBondContact O-N 2.76Å; M1-I4 HydrophobicContact SD-CD1 4.23Å; M1-D5 PolarHBondContact O-N 3.36Å; M1-D5 VanDerWaalsContact O-N 3.07Å; M1-M54 HydrophobicContact CE-CB 3.58Å; M1-M54 WeakPolarHBondContact CE-O 3.44Å; M1-M54 HydrophobicContact SD-CB 4.42Å; M1-N55 HydrophobicContact CE-CB 4.34Å
2	K	91.6	Very high	94.9	Very high	183 Å²	183	80.3 Å²	80.3	80%	0.796	41%	0.412	S	S	*	.	H	α-helix	trans	-49.9	-37.9	179.7	-64.4	-176	177	-178.6	0	114.9	D5 A6	K2-D5 PolarHBondContact O-N 3.09Å; K2-A6 WeakPolarHBondContact O-CB 3.03Å; K2-A6 PolarHBondContact O-N 3.1Å
3	I	94.6	Very high	95.2	Very high	148 Å²	148	80.8 Å²	80.8	76%	0.759	42%	0.415	S	S	*	.	H	α-helix	trans	-65.2	-42.4	176.8	-62.7	171.2	0	0	0	112	M1 D5 A6 Y7	M1-I3 PolarHBondContact O-N 3.13Å; I3-D5 VanDerWaalsContact C-N 3.27Å; I3-D5 PolarHBondContact O-N 2.9Å; I3-A6 PolarHBondContact O-N 2.93Å; I3-Y7 WeakPolarHBondContact O-CB 3.43Å; I3-Y7 PolarHBondContact O-N 3.37Å
4	I	94.8	Very high	95.4	Very high	22 Å²	22	79.3 Å²	79.3	11%	0.113	41%	0.411	C	S	.	.	H	α-helix	trans	-64.7	-39.6	177.1	-60.9	163.7	0	0	0	109.2	M1 Y7 M8 A47 L50 R51 M54	M1-I4 WeakPolarHBondContact O-CB 3.49Å; M1-I4 PolarHBondContact O-N 2.76Å; M1-I4 HydrophobicContact SD-CD1 4.23Å; I4-Y7 WeakPolarHBondContact O-CB 3.48Å; I4-Y7 PolarHBondContact O-N 3.37Å; I4-M8 HydrophobicContact CG2-CG 4.37Å; I4-M8 HydrophobicContact CG2-SD 4.19Å; I4-M8 VanDerWaalsContact O-CG 3.27Å; I4-M8 WeakPolarHBondContact O-CG 3.49Å; I4-M8 PolarHBondContact O-N 3.07Å; I4-A47 HydrophobicContact CG2-CB 4.33Å; I4-L50 HydrophobicContact CD1-CD2 4.22Å; I4-L50 HydrophobicContact CD1-CG 4.32Å; I4-L50 HydrophobicContact CG1-CD2 4.46Å; I4-R51 HydrophobicContact CG2-CB 4Å; I4-M54 HydrophobicContact CD1-SD 3.78Å
5	D	95.3	Very high	95.5	Very high	48 Å²	48	74.5 Å²	74.5	26%	0.257	39%	0.389	S	S	.	.	H	α-helix	trans	-65.3	-42.4	179	-54.8	-4.8	0	0	0	111.3	M1 K2 I3 M8 L9 R51	M1-D5 PolarHBondContact O-N 3.36Å; M1-D5 VanDerWaalsContact O-N 3.07Å; K2-D5 PolarHBondContact O-N 3.09Å; I3-D5 VanDerWaalsContact C-N 3.27Å; I3-D5 PolarHBondContact O-N 2.9Å; D5-M8 PolarHBondContact O-N 2.9Å; D5-L9 PolarHBondContact O-N 3.05Å; D5-R51 IonicContact OD1-CZ 2.76Å; D5-R51 IonicContact OD1-NE 3.16Å; D5-R51 PolarHBondContact OD1-NE 2.88Å; D5-R51 VanDerWaalsContact OD1-NE 3.16Å; D5-R51 IonicContact OD1-NH1 2.81Å; D5-R51 PolarHBondContact OD1-NH1 2.79Å; D5-R51 IonicContact OD1-NH2 3.13Å; D5-R51 PolarHBondContact OD1-NH2 3.46Å; D5-R51 VanDerWaalsContact OD1-NH2 3.13Å; D5-R51 IonicContact OD2-CZ 3.29Å; D5-R51 VanDerWaalsContact OD2-CZ 3.29Å; D5-R51 IonicContact OD2-NH1 3.51Å; D5-R51 IonicContact OD2-NH2 2.76Å; D5-R51 PolarHBondContact OD2-NH2 3.16Å
6	A	97.3	Very high	95.7	Very high	61 Å²	61	73.3 Å²	73.3	50%	0.504	39%	0.386	S	S	.	.	H	α-helix	trans	-64.5	-40	174.2	0	0	0	0	0	111.9	K2 I3 L9 C10	K2-A6 WeakPolarHBondContact O-CB 3.03Å; K2-A6 PolarHBondContact O-N 3.1Å; I3-A6 PolarHBondContact O-N 2.93Å; A6-L9 PolarHBondContact O-N 3.29Å; A6-C10 WeakPolarHBondContact O-CB 3.31Å; A6-C10 PolarHBondContact O-N 2.81Å
7	Y	96.8	Very high	95.8	Very high	82 Å²	82	75.8 Å²	75.8	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-46.5	174.5	176.1	-104.4	0	0	0	111.9	I3 I4 L9 C10 T11 S43 A47 F74 H78	I3-Y7 WeakPolarHBondContact O-CB 3.43Å; I3-Y7 PolarHBondContact O-N 3.37Å; I4-Y7 WeakPolarHBondContact O-CB 3.48Å; I4-Y7 PolarHBondContact O-N 3.37Å; Y7-L9 VanDerWaalsContact C-N 3.31Å; Y7-L9 PolarHBondContact O-N 2.93Å; Y7-C10 WeakPolarHBondContact O-CB 3.15Å; Y7-C10 PolarHBondContact O-N 3.16Å; Y7-C10 VanDerWaalsContact O-N 3.15Å; Y7-T11 HydrophobicContact CD1-CG2 4.43Å; Y7-T11 HydrophobicContact CD2-CG2 4.37Å; Y7-T11 HydrophobicContact CE1-CG2 3.92Å; Y7-T11 HydrophobicContact CE2-CG2 3.85Å; Y7-T11 PolarHBondContact O-N 2.87Å; Y7-T11 PolarHBondContact O-OG1 2.96Å; Y7-S43 WeakPolarHBondContact OH-CB 3.47Å; Y7-A47 HydrophobicContact CD1-CB 3.61Å; Y7-A47 HydrophobicContact CE1-CB 3.75Å; Y7-F74 HydrophobicContact CE1-CZ 4.3Å; Y7-H78 PolarHBondContact OH-CE1 3.34Å
8	M	97.1	Very high	95.8	Very high	22 Å²	22	74.8 Å²	74.8	11%	0.108	39%	0.392	C	S	.	.	H	α-helix	trans	-59.1	-41.5	174.9	-71.9	176.8	73.2	0	0	112	I4 D5 C10 T11 F12 F44 A47 A48	I4-M8 HydrophobicContact CG2-CG 4.37Å; I4-M8 HydrophobicContact CG2-SD 4.19Å; I4-M8 VanDerWaalsContact O-CG 3.27Å; I4-M8 WeakPolarHBondContact O-CG 3.49Å; I4-M8 PolarHBondContact O-N 3.07Å; D5-M8 PolarHBondContact O-N 2.9Å; M8-C10 VanDerWaalsContact C-N 3.34Å; M8-T11 PolarHBondContact O-OG1 3.15Å; M8-T11 VanDerWaalsContact O-OG1 3.09Å; M8-F12 VanDerWaalsContact O-CB 3.26Å; M8-F12 WeakPolarHBondContact O-CB 3.27Å; M8-F12 PolarHBondContact O-N 3.35Å; M8-F44 HydrophobicContact CB-CD2 4.06Å; M8-F44 HydrophobicContact CB-CE2 3.85Å; M8-F44 HydrophobicContact CE-CD1 4.49Å; M8-F44 HydrophobicContact CE-CD2 4.39Å; M8-F44 HydrophobicContact CE-CE1 3.9Å; M8-F44 HydrophobicContact CE-CE2 3.8Å; M8-F44 HydrophobicContact CE-CZ 3.52Å; M8-F44 HydrophobicContact CG-CD2 4.49Å; M8-F44 HydrophobicContact CG-CE2 4.45Å; M8-F44 WeakPolarHBondContact O-CD2 3.46Å; M8-A47 HydrophobicContact CG-CB 3.53Å; M8-A47 HydrophobicContact SD-CB 4.38Å; M8-A48 HydrophobicContact CE-CB 3.77Å
9	L	97.7	Very high	95.7	Very high	103 Å²	103	76.9 Å²	76.9	54%	0.539	40%	0.397	S	S	.	.	H	α-helix	trans	-63.7	-42.7	175.7	-177.6	63.7	0	0	0	111.2	D5 A6 Y7 F12 L13	D5-L9 PolarHBondContact O-N 3.05Å; A6-L9 PolarHBondContact O-N 3.29Å; Y7-L9 VanDerWaalsContact C-N 3.31Å; Y7-L9 PolarHBondContact O-N 2.93Å; L9-F12 PolarHBondContact O-N 3.42Å; L9-L13 HydrophobicContact CD1-CD1 4.17Å; L9-L13 HydrophobicContact CD1-CG 4.21Å; L9-L13 HydrophobicContact CG-CD1 3.98Å; L9-L13 HydrophobicContact CG-CG 4.41Å; L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 VanDerWaalsContact O-CG 3.26Å; L9-L13 WeakPolarHBondContact O-CG 3.37Å; L9-L13 PolarHBondContact O-N 2.96Å
10	C	97.2	Very high	95.8	Very high	74 Å²	74	77.4 Å²	77.4	50%	0.5	40%	0.4	S	S	.	.	H	α-helix	trans	-62.6	-47.4	178.5	-172.2	0	0	0	0	112.2	A6 Y7 M8 F12 L13 T14	A6-C10 WeakPolarHBondContact O-CB 3.31Å; A6-C10 PolarHBondContact O-N 2.81Å; Y7-C10 WeakPolarHBondContact O-CB 3.15Å; Y7-C10 PolarHBondContact O-N 3.16Å; Y7-C10 VanDerWaalsContact O-N 3.15Å; M8-C10 VanDerWaalsContact C-N 3.34Å; C10-F12 VanDerWaalsContact C-N 3.35Å; C10-F12 PolarHBondContact O-N 3.14Å; C10-L13 PolarHBondContact O-N 3.41Å; C10-T14 WeakPolarHBondContact O-CB 3.45Å; C10-T14 PolarHBondContact O-N 3.46Å; C10-T14 PolarHBondContact O-OG1 3.46Å
11	T	97.2	Very high	95.8	Very high	14 Å²	14	81 Å²	81	9%	0.086	41%	0.41	C	S	.	.	H	α-helix	trans	-65.8	-38.2	178.4	55.3	0	0	0	0	111.9	Y7 M8 T14 G15	Y7-T11 HydrophobicContact CD1-CG2 4.43Å; Y7-T11 HydrophobicContact CD2-CG2 4.37Å; Y7-T11 HydrophobicContact CE1-CG2 3.92Å; Y7-T11 HydrophobicContact CE2-CG2 3.85Å; Y7-T11 PolarHBondContact O-N 2.87Å; Y7-T11 PolarHBondContact O-OG1 2.96Å; M8-T11 PolarHBondContact O-OG1 3.15Å; M8-T11 VanDerWaalsContact O-OG1 3.09Å; T11-T14 PolarHBondContact O-N 3.26Å; T11-G15 PolarHBondContact O-N 3.44Å
12	F	97.5	Very high	96.3	Very high	116 Å²	116	77.3 Å²	77.3	51%	0.509	39%	0.392	S	S	.	.	H	α-helix	trans	-61.8	-52.1	174.3	176.6	-101.2	0	0	0	112	M8 L9 C10 T14 G15 V16 F44	M8-F12 VanDerWaalsContact O-CB 3.26Å; M8-F12 WeakPolarHBondContact O-CB 3.27Å; M8-F12 PolarHBondContact O-N 3.35Å; L9-F12 PolarHBondContact O-N 3.42Å; C10-F12 VanDerWaalsContact C-N 3.35Å; C10-F12 PolarHBondContact O-N 3.14Å; F12-T14 VanDerWaalsContact C-N 3.28Å; F12-T14 PolarHBondContact O-N 3.18Å; F12-G15 PolarHBondContact O-N 2.89Å; F12-V16 HydrophobicContact CD1-CG2 4.36Å; F12-V16 HydrophobicContact CE1-CG2 3.94Å; F12-V16 HydrophobicContact CE2-CG2 4.18Å; F12-V16 HydrophobicContact CZ-CG2 3.83Å; F12-V16 WeakPolarHBondContact O-CG2 3.44Å; F12-V16 PolarHBondContact O-N 3.1Å; F12-F44 HydrophobicContact CB-CD2 4.08Å; F12-F44 HydrophobicContact CB-CE2 4.06Å
13	L	98	Very high	96.5	Very high	87 Å²	87	72 Å²	72	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-60.5	-39.9	179.2	-71	173.9	0	0	0	111.5	L9 C10 V16 L17	L9-L13 HydrophobicContact CD1-CD1 4.17Å; L9-L13 HydrophobicContact CD1-CG 4.21Å; L9-L13 HydrophobicContact CG-CD1 3.98Å; L9-L13 HydrophobicContact CG-CG 4.41Å; L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 VanDerWaalsContact O-CG 3.26Å; L9-L13 WeakPolarHBondContact O-CG 3.37Å; L9-L13 PolarHBondContact O-N 2.96Å; C10-L13 PolarHBondContact O-N 3.41Å; L13-V16 PolarHBondContact O-N 3.41Å; L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.37Å; L13-L17 PolarHBondContact O-N 2.84Å
14	T	97.6	Very high	96.5	Very high	59 Å²	59	71.8 Å²	71.8	36%	0.362	38%	0.382	S	S	.	.	H	α-helix	trans	-62.8	-44.2	176.7	-54.6	0	0	0	0	111.6	C10 T11 F12 L17 Q18	C10-T14 WeakPolarHBondContact O-CB 3.45Å; C10-T14 PolarHBondContact O-N 3.46Å; C10-T14 PolarHBondContact O-OG1 3.46Å; T11-T14 PolarHBondContact O-N 3.26Å; F12-T14 VanDerWaalsContact C-N 3.28Å; F12-T14 PolarHBondContact O-N 3.18Å; T14-L17 PolarHBondContact O-N 3.27Å; T14-Q18 PolarHBondContact O-N 3.24Å
15	G	97.5	Very high	96.5	Very high	7 Å²	7	75.3 Å²	75.3	7%	0.072	40%	0.404	C	S	.	.	H	α-helix	trans	-63.1	-40.5	175.7	0	0	0	0	0	113	T11 F12 Q18 F19	T11-G15 PolarHBondContact O-N 3.44Å; F12-G15 PolarHBondContact O-N 2.89Å; G15-Q18 PolarHBondContact O-N 3.18Å; G15-F19 WeakPolarHBondContact O-CB 3.48Å; G15-F19 PolarHBondContact O-N 3.31Å
16	V	98.1	Very high	96.2	Very high	56 Å²	56	74.8 Å²	74.8	34%	0.339	41%	0.41	S	S	.	.	H	α-helix	trans	-61.9	-46.2	174.2	172.1	0	0	0	0	110.8	F12 L13 Q18 F19 L20	F12-V16 HydrophobicContact CD1-CG2 4.36Å; F12-V16 HydrophobicContact CE1-CG2 3.94Å; F12-V16 HydrophobicContact CE2-CG2 4.18Å; F12-V16 HydrophobicContact CZ-CG2 3.83Å; F12-V16 WeakPolarHBondContact O-CG2 3.44Å; F12-V16 PolarHBondContact O-N 3.1Å; L13-V16 PolarHBondContact O-N 3.41Å; V16-Q18 PolarHBondContact O-N 3.33Å; V16-F19 PolarHBondContact O-N 2.99Å; V16-L20 HydrophobicContact CG1-CD1 3.97Å; V16-L20 HydrophobicContact CG1-CG 4.35Å; V16-L20 WeakPolarHBondContact O-CG 3.44Å; V16-L20 PolarHBondContact O-N 3.47Å
17	L	97.3	Very high	95.8	Very high	115 Å²	115	75.9 Å²	75.9	60%	0.602	41%	0.411	S	S	*	.	H	α-helix	trans	-62.5	-41.7	178.1	-71.3	171.6	0	0	0	112.2	L13 T14 L20 Y21	L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.37Å; L13-L17 PolarHBondContact O-N 2.84Å; T14-L17 PolarHBondContact O-N 3.27Å; L17-L20 PolarHBondContact O-N 3.3Å; L17-Y21 WeakPolarHBondContact O-CB 3.3Å; L17-Y21 PolarHBondContact O-N 2.86Å
18	Q	95.8	Very high	95.5	Very high	59 Å²	59	81.5 Å²	81.5	28%	0.276	44%	0.437	S	S	.	.	H	α-helix	trans	-62.1	-43.1	174.6	-78.5	-179.3	-40.6	0	0	112.3	T14 G15 V16 Y21 C22 G36 C40	T14-Q18 PolarHBondContact O-N 3.24Å; G15-Q18 PolarHBondContact O-N 3.18Å; V16-Q18 PolarHBondContact O-N 3.33Å; Q18-Y21 PolarHBondContact O-N 3.11Å; Q18-C22 WeakPolarHBondContact O-CB 3.42Å; Q18-C22 PolarHBondContact O-N 3.17Å; Q18-G36 PolarHBondContact OE1-O 3.42Å; Q18-G36 VanDerWaalsContact OE1-O 3.08Å; Q18-C40 PolarHBondContact OE1-SG 3.05Å
19	F	95.5	Very high	95	Very high	115 Å²	115	83.6 Å²	83.6	50%	0.504	45%	0.453	S	S	.	.	H	α-helix	trans	-63.4	-45.6	177.3	-177.6	-96.7	0	0	0	111.8	G15 V16 Y21 C22 A23 F33 F37	G15-F19 WeakPolarHBondContact O-CB 3.48Å; G15-F19 PolarHBondContact O-N 3.31Å; V16-F19 PolarHBondContact O-N 2.99Å; F19-Y21 VanDerWaalsContact C-N 3.35Å; F19-Y21 PolarHBondContact O-N 3.47Å; F19-C22 PolarHBondContact O-N 3.03Å; F19-A23 WeakPolarHBondContact O-CB 3.31Å; F19-A23 PolarHBondContact O-N 2.9Å; F19-F33 HydrophobicContact CD2-CZ 4.25Å; F19-F37 HydrophobicContact CB-CD2 4.38Å; F19-F37 HydrophobicContact CB-CE2 3.97Å; F19-F37 HydrophobicContact CD2-CE2 4.4Å
20	L	97.1	Very high	94.7	Very high	86 Å²	86	83.9 Å²	83.9	45%	0.45	45%	0.45	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176.4	-70.8	174.7	0	0	0	111.8	V16 L17 C22 A23 I24	V16-L20 HydrophobicContact CG1-CD1 3.97Å; V16-L20 HydrophobicContact CG1-CG 4.35Å; V16-L20 WeakPolarHBondContact O-CG 3.44Å; V16-L20 PolarHBondContact O-N 3.47Å; L17-L20 PolarHBondContact O-N 3.3Å; L20-C22 PolarHBondContact O-N 3.29Å; L20-A23 PolarHBondContact O-N 3.44Å; L20-I24 VanDerWaalsContact O-CG1 3.29Å; L20-I24 WeakPolarHBondContact O-CG1 3.26Å; L20-I24 PolarHBondContact O-N 3.33Å
21	Y	94.8	Very high	94.5	Very high	153 Å²	153	83.6 Å²	83.6	60%	0.6	44%	0.443	S	S	*	.	H	α-helix	trans	-58.8	-48.1	175.3	176	-94	0	0	0	111.6	L17 Q18 F19 A23 I24 V25	L17-Y21 WeakPolarHBondContact O-CB 3.3Å; L17-Y21 PolarHBondContact O-N 2.86Å; Q18-Y21 PolarHBondContact O-N 3.11Å; F19-Y21 VanDerWaalsContact C-N 3.35Å; F19-Y21 PolarHBondContact O-N 3.47Å; Y21-A23 VanDerWaalsContact C-N 3.32Å; Y21-A23 PolarHBondContact O-N 2.94Å; Y21-I24 PolarHBondContact O-N 3Å; Y21-V25 HydrophobicContact CD2-CG2 3.82Å; Y21-V25 HydrophobicContact CE1-CB 4.37Å; Y21-V25 HydrophobicContact CE2-CB 4.19Å; Y21-V25 HydrophobicContact CE2-CG1 4.46Å; Y21-V25 HydrophobicContact CE2-CG2 3.57Å; Y21-V25 HydrophobicContact CG-CG2 4.44Å; Y21-V25 WeakPolarHBondContact O-CB 3.26Å; Y21-V25 PolarHBondContact O-N 3.36Å
22	C	94.3	Very high	94.4	Very high	13 Å²	13	84.9 Å²	84.9	9%	0.088	45%	0.453	C	S	.	.	H	α-helix	trans	-61.1	-40.1	177.4	-173.8	0	0	0	0	112.2	Q18 F19 L20 I24 G26 F33	Q18-C22 WeakPolarHBondContact O-CB 3.42Å; Q18-C22 PolarHBondContact O-N 3.17Å; F19-C22 PolarHBondContact O-N 3.03Å; L20-C22 PolarHBondContact O-N 3.29Å; C22-I24 PolarHBondContact O-N 2.95Å; C22-G26 CarbonylContact O-C 3.55Å; C22-G26 VanDerWaalsContact O-CA 3.3Å; C22-G26 WeakPolarHBondContact O-CA 3.31Å; C22-G26 PolarHBondContact O-N 3.09Å; C22-F33 HydrophobicContact CB-CD1 4.5Å; C22-F33 HydrophobicContact CB-CD2 3.48Å; C22-F33 VanDerWaalsContact CB-CD2 3.48Å; C22-F33 HydrophobicContact CB-CE1 4.45Å; C22-F33 HydrophobicContact CB-CE2 3.43Å; C22-F33 VanDerWaalsContact CB-CE2 3.43Å; C22-F33 HydrophobicContact CB-CG 4.04Å; C22-F33 HydrophobicContact CB-CZ 3.95Å
23	A	94.2	Very high	94.2	Very high	73 Å²	73	81.2 Å²	81.2	60%	0.603	44%	0.437	S	S	*	.	H	α-helix	trans	-67.3	-32.6	178.4	0	0	0	0	0	113.5	F19 L20 Y21	F19-A23 WeakPolarHBondContact O-CB 3.31Å; F19-A23 PolarHBondContact O-N 2.9Å; L20-A23 PolarHBondContact O-N 3.44Å; Y21-A23 VanDerWaalsContact C-N 3.32Å; Y21-A23 PolarHBondContact O-N 2.94Å
24	I	95.9	Very high	94	Very high	143 Å²	143	79.3 Å²	79.3	73%	0.733	43%	0.427	S	S	*	.	H	α-helix	trans	-90.1	-45.2	-176.6	-62.6	165.6	0	0	0	111.9	L20 Y21 C22	L20-I24 VanDerWaalsContact O-CG1 3.29Å; L20-I24 WeakPolarHBondContact O-CG1 3.26Å; L20-I24 PolarHBondContact O-N 3.33Å; Y21-I24 PolarHBondContact O-N 3Å; C22-I24 PolarHBondContact O-N 2.95Å
25	V	94.3	Very high	94	Very high	96 Å²	96	76.6 Å²	76.6	58%	0.582	41%	0.41	S	S	*	.	H	α-helix	trans	-89.9	-28.7	-172.9	-177.1	0	0	0	0	111.9	Y21	Y21-V25 HydrophobicContact CD2-CG2 3.82Å; Y21-V25 HydrophobicContact CE1-CB 4.37Å; Y21-V25 HydrophobicContact CE2-CB 4.19Å; Y21-V25 HydrophobicContact CE2-CG1 4.46Å; Y21-V25 HydrophobicContact CE2-CG2 3.57Å; Y21-V25 HydrophobicContact CG-CG2 4.44Å; Y21-V25 WeakPolarHBondContact O-CB 3.26Å; Y21-V25 PolarHBondContact O-N 3.36Å
26	G	90	Very high	93.9	Very high	37 Å²	37	76.9 Å²	76.9	38%	0.381	41%	0.413	S	S	.	.			trans	114.1	-179.4	-177.3	0	0	0	0	0	113	C22	C22-G26 CarbonylContact O-C 3.55Å; C22-G26 VanDerWaalsContact O-CA 3.3Å; C22-G26 WeakPolarHBondContact O-CA 3.31Å; C22-G26 PolarHBondContact O-N 3.09Å
27	T	88.3	Confident	93.8	Very high	84 Å²	84	77.2 Å²	77.2	52%	0.515	41%	0.41	S	S	.	.			trans	-103.1	0.5	-164.5	55.1	0	0	0	0	114.4	P29 F30	T27-P29 CarbonylContact O-C 3.36Å; T27-F30 HydrophobicContact CG2-CD2 4.39Å; T27-F30 WeakPolarHBondContact O-CA 3.43Å; T27-F30 VanDerWaalsContact O-CB 3.29Å; T27-F30 WeakPolarHBondContact O-CB 3.4Å; T27-F30 PolarHBondContact O-N 3.47Å
28	F	89.5	Confident	93.7	Very high	199 Å²	199	75.6 Å²	75.6	87%	0.873	40%	0.401	S	S	*	.	S	Bend	trans	-97.3	123.9	-178.8	-171.5	-97.9	0	0	0	111.4
29	P	88.4	Confident	93.8	Very high	67 Å²	67	73.6 Å²	73.6	44%	0.435	39%	0.394	S	S	.	.	S	Bend	cis	-82.1	132.2	-3.3	31	-33.6	0	0	0	114.1	T27 S32 F33	T27-P29 CarbonylContact O-C 3.36Å; P29-S32 VanDerWaalsContact CG-OG 3.31Å; P29-S32 WeakPolarHBondContact CG-OG 3.34Å; P29-S32 PolarHBondContact O-N 2.92Å; P29-F33 PolarHBondContact O-N 3.49Å
30	F	90.2	Very high	93.9	Very high	108 Å²	108	68.9 Å²	68.9	47%	0.474	38%	0.375	S	S	.	.	H	α-helix	trans	-74.4	-33.9	-171.4	-171.6	-122.2	0	0	0	112.6	T27 F33 L34	T27-F30 HydrophobicContact CG2-CD2 4.39Å; T27-F30 WeakPolarHBondContact O-CA 3.43Å; T27-F30 VanDerWaalsContact O-CB 3.29Å; T27-F30 WeakPolarHBondContact O-CB 3.4Å; T27-F30 PolarHBondContact O-N 3.47Å; F30-F33 HydrophobicContact CD2-CD1 4.04Å; F30-F33 AromaticContact CE2-CD1 3.86Å; F30-F33 HydrophobicContact CE2-CD1 3.86Å; F30-F33 HydrophobicContact CE2-CE1 4.25Å; F30-F33 PolarHBondContact O-N 3.43Å; F30-L34 HydrophobicContact CD1-CD1 3.56Å; F30-L34 HydrophobicContact CE1-CD1 3.22Å; F30-L34 HydrophobicContact CE1-CG 4.21Å; F30-L34 HydrophobicContact CE2-CD1 4.42Å; F30-L34 HydrophobicContact CG-CD1 4.31Å; F30-L34 HydrophobicContact CZ-CD1 3.7Å; F30-L34 HydrophobicContact CZ-CG 4.23Å; F30-L34 WeakPolarHBondContact O-CB 3.43Å; F30-L34 PolarHBondContact O-N 3.32Å
31	N	93.7	Very high	93.9	Very high	68 Å²	68	68 Å²	68	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-60.8	-44.8	175.4	-74.7	2.4	0	0	0	111.6	F33 L34 A35 F88 G90	N31-F33 VanDerWaalsContact C-N 3.33Å; N31-F33 PolarHBondContact O-N 3Å; N31-L34 PolarHBondContact O-N 2.94Å; N31-A35 VanDerWaalsContact O-CB 3.32Å; N31-A35 WeakPolarHBondContact O-CB 3.37Å; N31-A35 PolarHBondContact O-N 2.94Å; N31-F88 HydrophobicContact CB-CE1 4.3Å; N31-G90 WeakPolarHBondContact CB-OXT 3.42Å; N31-G90 PolarHBondContact ND2-OXT 3.43Å; N31-G90 VanDerWaalsContact ND2-OXT 3.08Å
32	S	93.9	Very high	94	Very high	42 Å²	42	61.9 Å²	61.9	29%	0.294	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-39.2	179.1	-44.9	0	0	0	0	111.8	P29 G36 I89	P29-S32 VanDerWaalsContact CG-OG 3.31Å; P29-S32 WeakPolarHBondContact CG-OG 3.34Å; P29-S32 PolarHBondContact O-N 2.92Å; S32-G36 PolarHBondContact O-N 3.33Å; S32-I89 WeakPolarHBondContact CA-O 3.45Å; S32-I89 WeakPolarHBondContact CB-O 3.37Å; S32-I89 PolarHBondContact OG-O 2.75Å
33	F	94	Very high	94.2	Very high	39 Å²	39	61.6 Å²	61.6	17%	0.171	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-51.2	171.8	166.3	-107.1	0	0	0	111.3	F19 C22 P29 F30 N31 A35 G36 F37	F19-F33 HydrophobicContact CD2-CZ 4.25Å; C22-F33 HydrophobicContact CB-CD1 4.5Å; C22-F33 HydrophobicContact CB-CD2 3.48Å; C22-F33 VanDerWaalsContact CB-CD2 3.48Å; C22-F33 HydrophobicContact CB-CE1 4.45Å; C22-F33 HydrophobicContact CB-CE2 3.43Å; C22-F33 VanDerWaalsContact CB-CE2 3.43Å; C22-F33 HydrophobicContact CB-CG 4.04Å; C22-F33 HydrophobicContact CB-CZ 3.95Å; P29-F33 PolarHBondContact O-N 3.49Å; F30-F33 HydrophobicContact CD2-CD1 4.04Å; F30-F33 AromaticContact CE2-CD1 3.86Å; F30-F33 HydrophobicContact CE2-CD1 3.86Å; F30-F33 HydrophobicContact CE2-CE1 4.25Å; F30-F33 PolarHBondContact O-N 3.43Å; N31-F33 VanDerWaalsContact C-N 3.33Å; N31-F33 PolarHBondContact O-N 3Å; F33-A35 PolarHBondContact O-N 3.09Å; F33-G36 PolarHBondContact O-N 2.89Å; F33-F37 HydrophobicContact CD2-CB 4.46Å; F33-F37 HydrophobicContact CE2-CB 4.01Å; F33-F37 HydrophobicContact CE2-CD2 4.26Å; F33-F37 HydrophobicContact CE2-CG 4.28Å; F33-F37 HydrophobicContact CZ-CB 4.06Å; F33-F37 HydrophobicContact CZ-CD2 4.23Å; F33-F37 HydrophobicContact CZ-CG 4.04Å; F33-F37 VanDerWaalsContact O-CB 3.26Å; F33-F37 WeakPolarHBondContact O-CB 3.46Å; F33-F37 PolarHBondContact O-N 2.92Å
34	L	94.7	Very high	94.4	Very high	46 Å²	46	61.7 Å²	61.7	24%	0.241	34%	0.339	C	S	.	.	H	α-helix	trans	-58.2	-46	178.6	-101.9	156.4	0	0	0	111.9	F30 N31 G36 F37 I38 F88	F30-L34 HydrophobicContact CD1-CD1 3.56Å; F30-L34 HydrophobicContact CE1-CD1 3.22Å; F30-L34 HydrophobicContact CE1-CG 4.21Å; F30-L34 HydrophobicContact CE2-CD1 4.42Å; F30-L34 HydrophobicContact CG-CD1 4.31Å; F30-L34 HydrophobicContact CZ-CD1 3.7Å; F30-L34 HydrophobicContact CZ-CG 4.23Å; F30-L34 WeakPolarHBondContact O-CB 3.43Å; F30-L34 PolarHBondContact O-N 3.32Å; N31-L34 PolarHBondContact O-N 2.94Å; L34-G36 PolarHBondContact O-N 3.49Å; L34-F37 PolarHBondContact O-N 3.28Å; L34-I38 HydrophobicContact CB-CD1 4.48Å; L34-I38 HydrophobicContact CD2-CD1 3.44Å; L34-I38 VanDerWaalsContact CD2-CD1 3.44Å; L34-I38 HydrophobicContact CD2-CG1 4.07Å; L34-I38 WeakPolarHBondContact O-CB 3.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.49Å; L34-I38 PolarHBondContact O-N 2.9Å; L34-F88 HydrophobicContact CB-CE1 3.81Å
35	A	96.4	Very high	94.4	Very high	2 Å²	2	58.7 Å²	58.7	2%	0.017	33%	0.327	C	S	.	.	H	α-helix	trans	-58.1	-48.9	178.2	0	0	0	0	0	111	N31 F33 S39 V85 F88 I89	N31-A35 VanDerWaalsContact O-CB 3.32Å; N31-A35 WeakPolarHBondContact O-CB 3.37Å; N31-A35 PolarHBondContact O-N 2.94Å; F33-A35 PolarHBondContact O-N 3.09Å; A35-S39 VanDerWaalsContact O-CB 3.27Å; A35-S39 WeakPolarHBondContact O-CB 3.28Å; A35-S39 PolarHBondContact O-N 3Å; A35-V85 HydrophobicContact CB-CG1 4.27Å; A35-F88 HydrophobicContact CB-CD1 4.06Å; A35-I89 HydrophobicContact CB-CB 3.92Å; A35-I89 HydrophobicContact CB-CG1 4.03Å
36	G	95.8	Very high	94.6	Very high	13 Å²	13	56 Å²	56	13%	0.134	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-48.7	177.4	0	0	0	0	0	112.7	Q18 S32 F33 L34 S39 C40	Q18-G36 PolarHBondContact OE1-O 3.42Å; Q18-G36 VanDerWaalsContact OE1-O 3.08Å; S32-G36 PolarHBondContact O-N 3.33Å; F33-G36 PolarHBondContact O-N 2.89Å; L34-G36 PolarHBondContact O-N 3.49Å; G36-S39 WeakPolarHBondContact O-CB 3.2Å; G36-S39 PolarHBondContact O-N 3.18Å; G36-C40 PolarHBondContact O-N 3.32Å; G36-C40 VanDerWaalsContact O-N 3.11Å; G36-C40 PolarHBondContact O-SG 2.89Å
37	F	95.7	Very high	94.9	Very high	63 Å²	63	54.2 Å²	54.2	28%	0.276	29%	0.291	S	S	.	.	H	α-helix	trans	-66.7	-45.8	-176.5	-173.8	-102.2	0	0	0	112	F19 F33 L34 S39 C40 V41	F19-F37 HydrophobicContact CB-CD2 4.38Å; F19-F37 HydrophobicContact CB-CE2 3.97Å; F19-F37 HydrophobicContact CD2-CE2 4.4Å; F33-F37 HydrophobicContact CD2-CB 4.46Å; F33-F37 HydrophobicContact CE2-CB 4.01Å; F33-F37 HydrophobicContact CE2-CD2 4.26Å; F33-F37 HydrophobicContact CE2-CG 4.28Å; F33-F37 HydrophobicContact CZ-CB 4.06Å; F33-F37 HydrophobicContact CZ-CD2 4.23Å; F33-F37 HydrophobicContact CZ-CG 4.04Å; F33-F37 VanDerWaalsContact O-CB 3.26Å; F33-F37 WeakPolarHBondContact O-CB 3.46Å; F33-F37 PolarHBondContact O-N 2.92Å; L34-F37 PolarHBondContact O-N 3.28Å; F37-S39 VanDerWaalsContact C-N 3.29Å; F37-S39 PolarHBondContact O-N 3.35Å; F37-C40 PolarHBondContact O-N 3.39Å; F37-V41 HydrophobicContact CD1-CG2 4.18Å; F37-V41 HydrophobicContact CE1-CG2 3.82Å; F37-V41 HydrophobicContact CZ-CG2 4.03Å; F37-V41 WeakPolarHBondContact O-CG2 3.33Å; F37-V41 PolarHBondContact O-N 2.95Å
38	I	95.9	Very high	95.3	Very high	81 Å²	81	51.4 Å²	51.4	42%	0.415	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-38.9	175.3	-69	170.8	0	0	0	110.4	L34 C40 V41 A42	L34-I38 HydrophobicContact CB-CD1 4.48Å; L34-I38 HydrophobicContact CD2-CD1 3.44Å; L34-I38 VanDerWaalsContact CD2-CD1 3.44Å; L34-I38 HydrophobicContact CD2-CG1 4.07Å; L34-I38 WeakPolarHBondContact O-CB 3.31Å; L34-I38 WeakPolarHBondContact O-CG1 3.49Å; L34-I38 PolarHBondContact O-N 2.9Å; I38-C40 VanDerWaalsContact C-N 3.32Å; I38-C40 PolarHBondContact O-N 2.99Å; I38-V41 PolarHBondContact O-N 3.1Å; I38-A42 WeakPolarHBondContact O-CB 3.48Å; I38-A42 PolarHBondContact O-N 3.01Å
39	S	97.3	Very high	95.6	Very high	17 Å²	17	44.2 Å²	44.2	12%	0.119	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-44.5	175.1	-171.1	0	0	0	0	111.9	A35 G36 F37 S43	A35-S39 VanDerWaalsContact O-CB 3.27Å; A35-S39 WeakPolarHBondContact O-CB 3.28Å; A35-S39 PolarHBondContact O-N 3Å; G36-S39 WeakPolarHBondContact O-CB 3.2Å; G36-S39 PolarHBondContact O-N 3.18Å; F37-S39 VanDerWaalsContact C-N 3.29Å; F37-S39 PolarHBondContact O-N 3.35Å; S39-S43 WeakPolarHBondContact O-CB 3.45Å; S39-S43 PolarHBondContact O-N 2.91Å; S39-S43 PolarHBondContact O-OG 3.27Å
40	C	97.3	Very high	96	Very high	16 Å²	16	41.5 Å²	41.5	11%	0.108	23%	0.233	C	C	.	.	H	α-helix	trans	-63.6	-47.6	176.4	-67.5	0	0	0	0	112.1	Q18 G36 F37 I38 S43 F44	Q18-C40 PolarHBondContact OE1-SG 3.05Å; G36-C40 PolarHBondContact O-N 3.32Å; G36-C40 VanDerWaalsContact O-N 3.11Å; G36-C40 PolarHBondContact O-SG 2.89Å; F37-C40 PolarHBondContact O-N 3.39Å; I38-C40 VanDerWaalsContact C-N 3.32Å; I38-C40 PolarHBondContact O-N 2.99Å; C40-S43 PolarHBondContact O-N 3.47Å; C40-F44 PolarHBondContact O-N 3.34Å
41	V	97.4	Very high	96.2	Very high	69 Å²	69	41.1 Å²	41.1	42%	0.418	23%	0.228	S	C	.	.	H	α-helix	trans	-63.4	-48.6	-179.9	174.1	0	0	0	0	111.3	F37 I38 S43 F44 V45	F37-V41 HydrophobicContact CD1-CG2 4.18Å; F37-V41 HydrophobicContact CE1-CG2 3.82Å; F37-V41 HydrophobicContact CZ-CG2 4.03Å; F37-V41 WeakPolarHBondContact O-CG2 3.33Å; F37-V41 PolarHBondContact O-N 2.95Å; I38-V41 PolarHBondContact O-N 3.1Å; V41-S43 PolarHBondContact O-N 2.95Å; V41-F44 WeakPolarHBondContact O-CB 3.32Å; V41-F44 PolarHBondContact O-N 3.34Å; V41-V45 WeakPolarHBondContact O-CG2 3.41Å; V41-V45 PolarHBondContact O-N 3.31Å
42	A	97.7	Very high	96.2	Very high	24 Å²	24	41.8 Å²	41.8	20%	0.198	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-42.6	180	0	0	0	0	0	111.3	I38 F44 V45 L46 L81	I38-A42 WeakPolarHBondContact O-CB 3.48Å; I38-A42 PolarHBondContact O-N 3.01Å; A42-F44 VanDerWaalsContact C-N 3.28Å; A42-F44 PolarHBondContact O-N 3.41Å; A42-V45 PolarHBondContact O-N 2.97Å; A42-V45 VanDerWaalsContact O-N 3.15Å; A42-L46 WeakPolarHBondContact O-CG 3.42Å; A42-L46 PolarHBondContact O-N 3Å; A42-L81 HydrophobicContact CB-CD1 3.49Å; A42-L81 VanDerWaalsContact CB-CD1 3.49Å; A42-L81 HydrophobicContact CB-CD2 3.56Å; A42-L81 HydrophobicContact CB-CG 4.17Å
43	S	97.7	Very high	96.2	Very high	6 Å²	6	42.3 Å²	42.3	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-38.2	175.2	-63.6	0	0	0	0	112.3	Y7 S39 C40 V41 A47 H78	Y7-S43 WeakPolarHBondContact OH-CB 3.47Å; S39-S43 WeakPolarHBondContact O-CB 3.45Å; S39-S43 PolarHBondContact O-N 2.91Å; S39-S43 PolarHBondContact O-OG 3.27Å; C40-S43 PolarHBondContact O-N 3.47Å; V41-S43 PolarHBondContact O-N 2.95Å; S43-A47 WeakPolarHBondContact O-CB 3.41Å; S43-A47 PolarHBondContact O-N 3.48Å; S43-H78 PolarHBondContact OG-CE1 2.96Å
44	F	97.6	Very high	96	Very high	75 Å²	75	42.9 Å²	42.9	33%	0.329	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-45.1	174	-175.1	-86.2	0	0	0	112.1	M8 F12 C40 V41 A42 A47 A48	M8-F44 HydrophobicContact CB-CD2 4.06Å; M8-F44 HydrophobicContact CB-CE2 3.85Å; M8-F44 HydrophobicContact CE-CD1 4.49Å; M8-F44 HydrophobicContact CE-CD2 4.39Å; M8-F44 HydrophobicContact CE-CE1 3.9Å; M8-F44 HydrophobicContact CE-CE2 3.8Å; M8-F44 HydrophobicContact CE-CZ 3.52Å; M8-F44 HydrophobicContact CG-CD2 4.49Å; M8-F44 HydrophobicContact CG-CE2 4.45Å; M8-F44 WeakPolarHBondContact O-CD2 3.46Å; F12-F44 HydrophobicContact CB-CD2 4.08Å; F12-F44 HydrophobicContact CB-CE2 4.06Å; C40-F44 PolarHBondContact O-N 3.34Å; V41-F44 WeakPolarHBondContact O-CB 3.32Å; V41-F44 PolarHBondContact O-N 3.34Å; A42-F44 VanDerWaalsContact C-N 3.28Å; A42-F44 PolarHBondContact O-N 3.41Å; F44-A47 PolarHBondContact O-N 2.95Å; F44-A48 WeakPolarHBondContact O-CB 3.41Å; F44-A48 PolarHBondContact O-N 2.92Å
45	V	97.8	Very high	95.8	Very high	80 Å²	80	42.7 Å²	42.7	49%	0.485	23%	0.232	S	C	.	.	H	α-helix	trans	-64.6	-41.8	178.4	174.2	0	0	0	0	111.4	V41 A42 A48 S49	V41-V45 WeakPolarHBondContact O-CG2 3.41Å; V41-V45 PolarHBondContact O-N 3.31Å; A42-V45 PolarHBondContact O-N 2.97Å; A42-V45 VanDerWaalsContact O-N 3.15Å; V45-A48 PolarHBondContact O-N 3.32Å; V45-S49 WeakPolarHBondContact O-CB 3.42Å; V45-S49 PolarHBondContact O-N 3.48Å; V45-S49 PolarHBondContact O-OG 3.2Å
46	L	97.5	Very high	95.4	Very high	39 Å²	39	47 Å²	47	20%	0.204	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-43.1	175.6	-68.7	178.7	0	0	0	111.3	A42 S49 L50 F74 A77 L81	A42-L46 WeakPolarHBondContact O-CG 3.42Å; A42-L46 PolarHBondContact O-N 3Å; L46-S49 WeakPolarHBondContact O-CB 3.42Å; L46-S49 PolarHBondContact O-N 3.03Å; L46-L50 PolarHBondContact O-N 3.15Å; L46-F74 HydrophobicContact CB-CD2 3.93Å; L46-F74 HydrophobicContact CB-CE2 3.8Å; L46-A77 HydrophobicContact CD1-CB 3.9Å; L46-A77 HydrophobicContact CD2-CB 3.61Å; L46-A77 HydrophobicContact CG-CB 4.41Å; L46-L81 HydrophobicContact CD1-CD2 4.03Å
47	A	97.1	Very high	95.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-40	176.2	0	0	0	0	0	112.8	I4 Y7 M8 S43 F44 S49 L50 R51 F74	I4-A47 HydrophobicContact CG2-CB 4.33Å; Y7-A47 HydrophobicContact CD1-CB 3.61Å; Y7-A47 HydrophobicContact CE1-CB 3.75Å; M8-A47 HydrophobicContact CG-CB 3.53Å; M8-A47 HydrophobicContact SD-CB 4.38Å; S43-A47 WeakPolarHBondContact O-CB 3.41Å; S43-A47 PolarHBondContact O-N 3.48Å; F44-A47 PolarHBondContact O-N 2.95Å; A47-S49 VanDerWaalsContact C-N 3.31Å; A47-S49 PolarHBondContact O-N 3.04Å; A47-L50 PolarHBondContact O-N 2.99Å; A47-R51 WeakPolarHBondContact O-CB 3.43Å; A47-R51 PolarHBondContact O-N 3.22Å; A47-F74 HydrophobicContact CB-CE2 4.44Å
48	A	96.8	Very high	94.8	Very high	25 Å²	25	52.9 Å²	52.9	21%	0.207	29%	0.286	C	S	.	.	H	α-helix	trans	-61	-42.8	173.6	0	0	0	0	0	111.2	M8 F44 V45 R51 I52	M8-A48 HydrophobicContact CE-CB 3.77Å; F44-A48 WeakPolarHBondContact O-CB 3.41Å; F44-A48 PolarHBondContact O-N 2.92Å; V45-A48 PolarHBondContact O-N 3.32Å; A48-R51 WeakPolarHBondContact O-CB 3.34Å; A48-R51 PolarHBondContact O-N 3.35Å; A48-I52 VanDerWaalsContact O-CG1 3.31Å; A48-I52 WeakPolarHBondContact O-CG1 3.43Å; A48-I52 PolarHBondContact O-N 3.11Å
49	S	95.4	Very high	94.2	Very high	49 Å²	49	56.3 Å²	56.3	34%	0.343	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-45.8	177.5	-57.2	0	0	0	0	111.4	V45 L46 A47 R51 I52 Q53	V45-S49 WeakPolarHBondContact O-CB 3.42Å; V45-S49 PolarHBondContact O-N 3.48Å; V45-S49 PolarHBondContact O-OG 3.2Å; L46-S49 WeakPolarHBondContact O-CB 3.42Å; L46-S49 PolarHBondContact O-N 3.03Å; A47-S49 VanDerWaalsContact C-N 3.31Å; A47-S49 PolarHBondContact O-N 3.04Å; S49-R51 VanDerWaalsContact C-N 3.34Å; S49-R51 PolarHBondContact O-N 3.49Å; S49-I52 PolarHBondContact O-N 3.42Å; S49-Q53 WeakPolarHBondContact O-CG 3.16Å; S49-Q53 PolarHBondContact O-N 3.39Å; S49-Q53 VanDerWaalsContact O-N 3.1Å
50	L	95.6	Very high	93.7	Very high	10 Å²	10	66.9 Å²	66.9	5%	0.052	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-44	174.1	-179.5	65.7	0	0	0	111.3	I4 L46 A47 I52 Q53 M54 A70 F71 F74	I4-L50 HydrophobicContact CD1-CD2 4.22Å; I4-L50 HydrophobicContact CD1-CG 4.32Å; I4-L50 HydrophobicContact CG1-CD2 4.46Å; L46-L50 PolarHBondContact O-N 3.15Å; A47-L50 PolarHBondContact O-N 2.99Å; L50-I52 VanDerWaalsContact C-N 3.33Å; L50-I52 PolarHBondContact O-N 2.71Å; L50-Q53 PolarHBondContact O-N 2.96Å; L50-M54 HydrophobicContact CD1-CG 3.84Å; L50-M54 HydrophobicContact CD1-SD 3.67Å; L50-M54 HydrophobicContact CD2-SD 4.22Å; L50-M54 HydrophobicContact CG-CG 4.2Å; L50-M54 HydrophobicContact CG-SD 3.76Å; L50-M54 WeakPolarHBondContact O-CB 3.32Å; L50-M54 VanDerWaalsContact O-CG 3.3Å; L50-M54 WeakPolarHBondContact O-CG 3.49Å; L50-M54 PolarHBondContact O-N 3.38Å; L50-A70 HydrophobicContact CD1-CB 4.13Å; L50-F71 HydrophobicContact CD2-CD2 4.42Å; L50-F74 HydrophobicContact CB-CB 4.44Å; L50-F74 HydrophobicContact CB-CD2 3.91Å; L50-F74 HydrophobicContact CB-CG 4.31Å; L50-F74 HydrophobicContact CD1-CB 4.07Å; L50-F74 HydrophobicContact CD2-CB 4.25Å; L50-F74 HydrophobicContact CD2-CD1 3.99Å; L50-F74 HydrophobicContact CD2-CD2 3.97Å; L50-F74 HydrophobicContact CD2-CE1 4.33Å; L50-F74 HydrophobicContact CD2-CE2 4.31Å; L50-F74 HydrophobicContact CD2-CG 3.8Å; L50-F74 HydrophobicContact CD2-CZ 4.48Å; L50-F74 HydrophobicContact CG-CB 4.48Å; L50-F74 HydrophobicContact CG-CD2 4.46Å; L50-F74 HydrophobicContact CG-CG 4.43Å
51	R	95	Very high	93.3	Very high	99 Å²	99	72.5 Å²	72.5	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-58.8	-44.8	178.5	-172.2	-177.3	-179.2	156.1	9.7	111.7	I4 D5 A47 A48 S49 N55	I4-R51 HydrophobicContact CG2-CB 4Å; D5-R51 IonicContact OD1-CZ 2.76Å; D5-R51 IonicContact OD1-NE 3.16Å; D5-R51 PolarHBondContact OD1-NE 2.88Å; D5-R51 VanDerWaalsContact OD1-NE 3.16Å; D5-R51 IonicContact OD1-NH1 2.81Å; D5-R51 PolarHBondContact OD1-NH1 2.79Å; D5-R51 IonicContact OD1-NH2 3.13Å; D5-R51 PolarHBondContact OD1-NH2 3.46Å; D5-R51 VanDerWaalsContact OD1-NH2 3.13Å; D5-R51 IonicContact OD2-CZ 3.29Å; D5-R51 VanDerWaalsContact OD2-CZ 3.29Å; D5-R51 IonicContact OD2-NH1 3.51Å; D5-R51 IonicContact OD2-NH2 2.76Å; D5-R51 PolarHBondContact OD2-NH2 3.16Å; A47-R51 WeakPolarHBondContact O-CB 3.43Å; A47-R51 PolarHBondContact O-N 3.22Å; A48-R51 WeakPolarHBondContact O-CB 3.34Å; A48-R51 PolarHBondContact O-N 3.35Å; S49-R51 VanDerWaalsContact C-N 3.34Å; S49-R51 PolarHBondContact O-N 3.49Å; R51-N55 PolarHBondContact O-N 2.84Å
52	I	94	Very high	92.7	Very high	82 Å²	82	72.2 Å²	72.2	42%	0.421	35%	0.353	S	S	.	.	H	α-helix	trans	-63.7	-44.9	179.9	-70.1	165	0	0	0	110.6	A48 S49 L50 N55 N58 F62	A48-I52 VanDerWaalsContact O-CG1 3.31Å; A48-I52 WeakPolarHBondContact O-CG1 3.43Å; A48-I52 PolarHBondContact O-N 3.11Å; S49-I52 PolarHBondContact O-N 3.42Å; L50-I52 VanDerWaalsContact C-N 3.33Å; L50-I52 PolarHBondContact O-N 2.71Å; I52-N55 PolarHBondContact O-N 2.95Å; I52-N58 WeakPolarHBondContact O-CB 3.44Å; I52-N58 PolarHBondContact O-ND2 2.99Å; I52-N58 VanDerWaalsContact O-ND2 3.14Å; I52-F62 HydrophobicContact CG2-CE2 3.69Å; I52-F62 HydrophobicContact CG2-CZ 3.82Å
53	Q	92.6	Very high	91.9	Very high	53 Å²	53	76.4 Å²	76.4	25%	0.248	38%	0.378	C	S	.	.	H	α-helix	trans	-70.1	-35.6	-179.4	-68.7	176.9	44.9	0	0	112.8	S49 L50 N55 F62 A70	S49-Q53 WeakPolarHBondContact O-CG 3.16Å; S49-Q53 PolarHBondContact O-N 3.39Å; S49-Q53 VanDerWaalsContact O-N 3.1Å; L50-Q53 PolarHBondContact O-N 2.96Å; Q53-N55 VanDerWaalsContact C-N 3.32Å; Q53-F62 HydrophobicContact CG-CD1 4.39Å; Q53-F62 HydrophobicContact CG-CE1 4.24Å; Q53-F62 HydrophobicContact CG-CZ 4.32Å; Q53-A70 HydrophobicContact CB-CB 3.99Å
54	M	90.3	Very high	91.1	Very high	51 Å²	51	80.1 Å²	80.1	25%	0.251	42%	0.417	S	S	.	.	H	α-helix	trans	-78.5	-15	179.2	-69.6	-172	78.2	0	0	113.2	M1 I4 L50 P56	M1-M54 HydrophobicContact CE-CB 3.58Å; M1-M54 WeakPolarHBondContact CE-O 3.44Å; M1-M54 HydrophobicContact SD-CB 4.42Å; I4-M54 HydrophobicContact CD1-SD 3.78Å; L50-M54 HydrophobicContact CD1-CG 3.84Å; L50-M54 HydrophobicContact CD1-SD 3.67Å; L50-M54 HydrophobicContact CD2-SD 4.22Å; L50-M54 HydrophobicContact CG-CG 4.2Å; L50-M54 HydrophobicContact CG-SD 3.76Å; L50-M54 WeakPolarHBondContact O-CB 3.32Å; L50-M54 VanDerWaalsContact O-CG 3.3Å; L50-M54 WeakPolarHBondContact O-CG 3.49Å; L50-M54 PolarHBondContact O-N 3.38Å; M54-P56 VanDerWaalsContact O-CD 3.31Å; M54-P56 WeakPolarHBondContact O-CD 3.29Å
55	N	91.8	Very high	90.7	Very high	43 Å²	43	79.8 Å²	79.8	23%	0.23	42%	0.418	C	S	.	.			trans	-68.5	118.5	-176.1	-172.5	-9.5	0	0	0	110.4	M1 R51 I52 Q53 Q57 N58	M1-N55 HydrophobicContact CE-CB 4.34Å; R51-N55 PolarHBondContact O-N 2.84Å; I52-N55 PolarHBondContact O-N 2.95Å; Q53-N55 VanDerWaalsContact C-N 3.32Å; N55-Q57 PolarHBondContact ND2-OE1 3.48Å; N55-Q57 PolarHBondContact O-N 2.95Å; N55-Q57 VanDerWaalsContact O-N 3.1Å; N55-Q57 WeakPolarHBondContact OD1-CB 3.45Å; N55-Q57 PolarHBondContact OD1-N 3.44Å; N55-Q57 VanDerWaalsContact OD1-N 3.09Å; N55-N58 HydrophobicContact CB-CB 4.37Å; N55-N58 PolarHBondContact O-N 3.42Å
56	P	87.1	Confident	90.3	Very high	92 Å²	92	78.5 Å²	78.5	60%	0.597	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-56.2	-30.1	179.2	-23.7	32.9	0	0	0	113.7	M54 N58 K59	M54-P56 VanDerWaalsContact O-CD 3.31Å; M54-P56 WeakPolarHBondContact O-CD 3.29Å; P56-N58 PolarHBondContact O-N 3.14Å; P56-K59 WeakPolarHBondContact O-CB 3.45Å; P56-K59 PolarHBondContact O-N 3.28Å
57	Q	89.6	Confident	90	Very high	162 Å²	162	84.3 Å²	84.3	76%	0.757	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-65	-28.8	177.2	-62.8	177.2	-52.8	0	0	112.1	N55	N55-Q57 PolarHBondContact ND2-OE1 3.48Å; N55-Q57 PolarHBondContact O-N 2.95Å; N55-Q57 VanDerWaalsContact O-N 3.1Å; N55-Q57 WeakPolarHBondContact OD1-CB 3.45Å; N55-Q57 PolarHBondContact OD1-N 3.44Å; N55-Q57 VanDerWaalsContact OD1-N 3.09Å
58	N	89	Confident	89.8	Confident	38 Å²	38	90.2 Å²	90.2	20%	0.203	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-93.2	3.5	-179	-64.1	-13.8	0	0	0	113.1	I52 N55 P56 R60 Q61 F62	I52-N58 WeakPolarHBondContact O-CB 3.44Å; I52-N58 PolarHBondContact O-ND2 2.99Å; I52-N58 VanDerWaalsContact O-ND2 3.14Å; N55-N58 HydrophobicContact CB-CB 4.37Å; N55-N58 PolarHBondContact O-N 3.42Å; P56-N58 PolarHBondContact O-N 3.14Å; N58-R60 PolarHBondContact O-N 3.1Å; N58-Q61 WeakPolarHBondContact O-CB 3.45Å; N58-Q61 PolarHBondContact O-N 3.45Å; N58-F62 HydrophobicContact CB-CD2 4.32Å; N58-F62 HydrophobicContact CB-CE2 4.26Å; N58-F62 PolarHBondContact O-N 2.96Å
59	K	83.5	Confident	89.6	Confident	153 Å²	153	95.8 Å²	95.8	67%	0.665	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-32.5	179.8	-96.6	-169.8	170.9	-170	0	113.6	P56 Q61 F62	P56-K59 WeakPolarHBondContact O-CB 3.45Å; P56-K59 PolarHBondContact O-N 3.28Å; K59-Q61 VanDerWaalsContact C-N 3.29Å; K59-Q61 PolarHBondContact O-N 3.45Å; K59-F62 CarbonylContact O-C 3.1Å; K59-F62 PolarHBondContact O-N 3.47Å
60	R	86.2	Confident	89.6	Confident	238 Å²	238	93.6 Å²	93.6	90%	0.898	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.1	178.2	-69.1	-176.2	174.7	-178.8	-1.7	113.3	N58	N58-R60 PolarHBondContact O-N 3.1Å
61	Q	88.6	Confident	89.5	Confident	135 Å²	135	98 Å²	98	63%	0.631	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-21.9	178.7	-68	177.2	-9.8	0	0	112.6	N58 K59 P63	N58-Q61 WeakPolarHBondContact O-CB 3.45Å; N58-Q61 PolarHBondContact O-N 3.45Å; K59-Q61 VanDerWaalsContact C-N 3.29Å; K59-Q61 PolarHBondContact O-N 3.45Å; Q61-P63 VanDerWaalsContact O-CD 3.31Å; Q61-P63 WeakPolarHBondContact O-CD 3.26Å
62	F	86.8	Confident	89.6	Confident	62 Å²	62	95.7 Å²	95.7	27%	0.272	48%	0.481	S	S	.	.	S	Bend	trans	-121.3	59.2	-179.5	-56.8	-77.6	0	0	0	111.9	I52 Q53 N58 K59 G64 I65	I52-F62 HydrophobicContact CG2-CE2 3.69Å; I52-F62 HydrophobicContact CG2-CZ 3.82Å; Q53-F62 HydrophobicContact CG-CD1 4.39Å; Q53-F62 HydrophobicContact CG-CE1 4.24Å; Q53-F62 HydrophobicContact CG-CZ 4.32Å; N58-F62 HydrophobicContact CB-CD2 4.32Å; N58-F62 HydrophobicContact CB-CE2 4.26Å; N58-F62 PolarHBondContact O-N 2.96Å; K59-F62 CarbonylContact O-C 3.1Å; K59-F62 PolarHBondContact O-N 3.47Å; F62-G64 PolarHBondContact O-N 2.77Å; F62-I65 HydrophobicContact CB-CB 4.1Å; F62-I65 HydrophobicContact CB-CD1 4.13Å; F62-I65 HydrophobicContact CB-CG1 4.17Å; F62-I65 HydrophobicContact CD1-CD1 3.85Å; F62-I65 HydrophobicContact CG-CD1 4.36Å; F62-I65 PolarHBondContact O-N 3.05Å
63	P	79	Confident	89.7	Confident	113 Å²	113	94.5 Å²	94.5	73%	0.734	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	119.9	177	28.4	-32.7	0	0	0	109.3	Q61	Q61-P63 VanDerWaalsContact O-CD 3.31Å; Q61-P63 WeakPolarHBondContact O-CD 3.26Å
64	G	82.3	Confident	89.9	Confident	83 Å²	83	93.6 Å²	93.6	86%	0.856	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	-11.5	179.2	0	0	0	0	0	115.4	F62 S66	F62-G64 PolarHBondContact O-N 2.77Å; G64-S66 PolarHBondContact O-N 3.27Å
65	I	88.3	Confident	90.2	Very high	69 Å²	69	95.2 Å²	95.2	35%	0.354	48%	0.48	S	S	.	.			trans	-83	106.9	170.7	-56.4	-168.8	0	0	0	108.6	F62 A70	F62-I65 HydrophobicContact CB-CB 4.1Å; F62-I65 HydrophobicContact CB-CD1 4.13Å; F62-I65 HydrophobicContact CB-CG1 4.17Å; F62-I65 HydrophobicContact CD1-CD1 3.85Å; F62-I65 HydrophobicContact CG-CD1 4.36Å; F62-I65 PolarHBondContact O-N 3.05Å; I65-A70 HydrophobicContact CG2-CB 3.89Å
66	S	90.8	Very high	90.5	Very high	53 Å²	53	99.3 Å²	99.3	37%	0.371	50%	0.499	S	S	.	.			trans	-73.1	158.6	169.5	83.7	0	0	0	0	110.5	G64 E68 R69 A70	G64-S66 PolarHBondContact O-N 3.27Å; S66-E68 WeakPolarHBondContact CB-OE2 3.38Å; S66-E68 PolarHBondContact O-N 3.29Å; S66-E68 PolarHBondContact OG-OE2 3.42Å; S66-R69 PolarHBondContact O-N 2.93Å; S66-R69 VanDerWaalsContact O-N 3.17Å; S66-R69 PolarHBondContact OG-N 3.29Å; S66-R69 VanDerWaalsContact OG-N 3.09Å; S66-A70 PolarHBondContact O-N 3.47Å
67	R	89.5	Confident	91	Very high	161 Å²	161	96.6 Å²	96.6	61%	0.608	48%	0.484	S	S	*	.	H	α-helix	trans	-63.3	-34.2	178.5	-72.8	-176.1	-67.8	-177.2	-2.1	111.2	F71	R67-F71 WeakPolarHBondContact O-CB 3.27Å; R67-F71 PolarHBondContact O-N 3.01Å; R67-F71 VanDerWaalsContact O-N 3.11Å
68	E	92.7	Very high	91.4	Very high	124 Å²	124	90 Å²	90	58%	0.579	45%	0.454	S	S	*	.	H	α-helix	trans	-67.1	-40.7	177.6	-54.4	71.2	-148.1	0	0	110.1	S66 F71 A72	S66-E68 WeakPolarHBondContact CB-OE2 3.38Å; S66-E68 PolarHBondContact O-N 3.29Å; S66-E68 PolarHBondContact OG-OE2 3.42Å; E68-F71 PolarHBondContact O-N 3.41Å; E68-A72 WeakPolarHBondContact O-CB 3.41Å; E68-A72 PolarHBondContact O-N 3.49Å
69	R	93.9	Very high	91.8	Very high	142 Å²	142	92.7 Å²	92.7	54%	0.536	47%	0.471	S	S	.	.	H	α-helix	trans	-65.2	-48.4	175.8	-179.8	63.7	-164.2	-155	10	112	S66 F71 A72 D73	S66-R69 PolarHBondContact O-N 2.93Å; S66-R69 VanDerWaalsContact O-N 3.17Å; S66-R69 PolarHBondContact OG-N 3.29Å; S66-R69 VanDerWaalsContact OG-N 3.09Å; R69-F71 PolarHBondContact O-N 2.81Å; R69-A72 PolarHBondContact O-N 3.42Å; R69-A72 VanDerWaalsContact O-N 3.1Å; R69-D73 IonicContact CZ-OD1 3.21Å; R69-D73 IonicContact CZ-OD2 3.78Å; R69-D73 VanDerWaalsContact NE-CG 3.33Å; R69-D73 IonicContact NE-OD1 2.95Å; R69-D73 PolarHBondContact NE-OD1 3.47Å; R69-D73 IonicContact NE-OD2 3.82Å; R69-D73 PolarHBondContact NE-OD2 3.39Å; R69-D73 IonicContact NH2-OD1 2.77Å; R69-D73 PolarHBondContact NH2-OD1 2.82Å; R69-D73 IonicContact NH2-OD2 3.01Å; R69-D73 PolarHBondContact O-N 2.81Å
70	A	94.6	Very high	92.5	Very high	3 Å²	3	88.7 Å²	88.7	3%	0.025	46%	0.459	C	S	.	.	H	α-helix	trans	-56.9	-40.1	177.6	0	0	0	0	0	111.9	L50 Q53 I65 S66 F74	L50-A70 HydrophobicContact CD1-CB 4.13Å; Q53-A70 HydrophobicContact CB-CB 3.99Å; I65-A70 HydrophobicContact CG2-CB 3.89Å; S66-A70 PolarHBondContact O-N 3.47Å; A70-F74 WeakPolarHBondContact O-CB 3.29Å; A70-F74 PolarHBondContact O-N 3.3Å
71	F	94.3	Very high	93	Very high	103 Å²	103	78.5 Å²	78.5	45%	0.452	42%	0.423	S	S	.	.	H	α-helix	trans	-69.7	-39.5	176.3	-172.6	-107.6	0	0	0	112.8	L50 R67 E68 R69 F74 L75	L50-F71 HydrophobicContact CD2-CD2 4.42Å; R67-F71 WeakPolarHBondContact O-CB 3.27Å; R67-F71 PolarHBondContact O-N 3.01Å; R67-F71 VanDerWaalsContact O-N 3.11Å; E68-F71 PolarHBondContact O-N 3.41Å; R69-F71 PolarHBondContact O-N 2.81Å; F71-F74 HydrophobicContact CE2-CD1 4.49Å; F71-F74 WeakPolarHBondContact O-CB 3.26Å; F71-F74 PolarHBondContact O-N 3.07Å; F71-L75 HydrophobicContact CD1-CD1 3.92Å; F71-L75 HydrophobicContact CD1-CG 4.42Å; F71-L75 HydrophobicContact CE1-CD1 3.47Å; F71-L75 VanDerWaalsContact CE1-CD1 3.47Å; F71-L75 HydrophobicContact CE1-CG 4.06Å; F71-L75 HydrophobicContact CZ-CD1 4.01Å; F71-L75 HydrophobicContact CZ-CD2 4.31Å; F71-L75 HydrophobicContact CZ-CG 4.17Å; F71-L75 PolarHBondContact O-N 3.3Å
72	A	96.3	Very high	93.3	Very high	49 Å²	49	75.6 Å²	75.6	41%	0.405	41%	0.409	S	S	.	.	H	α-helix	trans	-63.3	-43.4	175	0	0	0	0	0	112	E68 R69 F74 L75 M76	E68-A72 WeakPolarHBondContact O-CB 3.41Å; E68-A72 PolarHBondContact O-N 3.49Å; R69-A72 PolarHBondContact O-N 3.42Å; R69-A72 VanDerWaalsContact O-N 3.1Å; A72-F74 VanDerWaalsContact C-N 3.32Å; A72-F74 PolarHBondContact O-N 3.47Å; A72-L75 PolarHBondContact O-N 3.02Å; A72-M76 WeakPolarHBondContact O-CB 3.22Å; A72-M76 PolarHBondContact O-N 3.19Å
73	D	96.2	Very high	93.8	Very high	58 Å²	58	78.3 Å²	78.3	31%	0.31	43%	0.425	S	S	.	.	H	α-helix	trans	-63.8	-39.2	176.4	-69	-32.6	0	0	0	111.1	R69 M76 A77	R69-D73 IonicContact CZ-OD1 3.21Å; R69-D73 IonicContact CZ-OD2 3.78Å; R69-D73 VanDerWaalsContact NE-CG 3.33Å; R69-D73 IonicContact NE-OD1 2.95Å; R69-D73 PolarHBondContact NE-OD1 3.47Å; R69-D73 IonicContact NE-OD2 3.82Å; R69-D73 PolarHBondContact NE-OD2 3.39Å; R69-D73 IonicContact NH2-OD1 2.77Å; R69-D73 PolarHBondContact NH2-OD1 2.82Å; R69-D73 IonicContact NH2-OD2 3.01Å; R69-D73 PolarHBondContact O-N 2.81Å; D73-M76 PolarHBondContact O-N 3.41Å; D73-A77 WeakPolarHBondContact O-CB 3.3Å; D73-A77 PolarHBondContact O-N 3.24Å
74	F	96.7	Very high	94.6	Very high	33 Å²	33	79.3 Å²	79.3	15%	0.145	42%	0.419	C	S	.	.	H	α-helix	trans	-60.7	-46.9	173.6	172.8	-97.1	0	0	0	112.7	Y7 L46 A47 L50 A70 F71 A72 A77 H78	Y7-F74 HydrophobicContact CE1-CZ 4.3Å; L46-F74 HydrophobicContact CB-CD2 3.93Å; L46-F74 HydrophobicContact CB-CE2 3.8Å; A47-F74 HydrophobicContact CB-CE2 4.44Å; L50-F74 HydrophobicContact CB-CB 4.44Å; L50-F74 HydrophobicContact CB-CD2 3.91Å; L50-F74 HydrophobicContact CB-CG 4.31Å; L50-F74 HydrophobicContact CD1-CB 4.07Å; L50-F74 HydrophobicContact CD2-CB 4.25Å; L50-F74 HydrophobicContact CD2-CD1 3.99Å; L50-F74 HydrophobicContact CD2-CD2 3.97Å; L50-F74 HydrophobicContact CD2-CE1 4.33Å; L50-F74 HydrophobicContact CD2-CE2 4.31Å; L50-F74 HydrophobicContact CD2-CG 3.8Å; L50-F74 HydrophobicContact CD2-CZ 4.48Å; L50-F74 HydrophobicContact CG-CB 4.48Å; L50-F74 HydrophobicContact CG-CD2 4.46Å; L50-F74 HydrophobicContact CG-CG 4.43Å; A70-F74 WeakPolarHBondContact O-CB 3.29Å; A70-F74 PolarHBondContact O-N 3.3Å; F71-F74 HydrophobicContact CE2-CD1 4.49Å; F71-F74 WeakPolarHBondContact O-CB 3.26Å; F71-F74 PolarHBondContact O-N 3.07Å; A72-F74 VanDerWaalsContact C-N 3.32Å; A72-F74 PolarHBondContact O-N 3.47Å; F74-A77 PolarHBondContact O-N 3.08Å; F74-H78 AromaticContact CD2-CD2 3.91Å; F74-H78 AromaticContact CE1-CD2 3.67Å; F74-H78 AromaticContact CE2-CD2 3.41Å; F74-H78 VanDerWaalsContact CE2-CD2 3.41Å; F74-H78 WeakPolarHBondContact CE2-CD2 3.24Å; F74-H78 AromaticContact CE2-NE2 3.33Å; F74-H78 VanDerWaalsContact CE2-NE2 3.33Å; F74-H78 WeakPolarHBondContact CE2-NE2 3.5Å; F74-H78 AromaticContact CZ-CD2 3.28Å; F74-H78 WeakPolarHBondContact CZ-CD2 3.42Å; F74-H78 AromaticContact CZ-NE2 3.2Å; F74-H78 WeakPolarHBondContact CZ-NE2 3.2Å; F74-H78 PolarHBondContact O-CD2 3.03Å; F74-H78 PolarHBondContact O-N 3.4Å
75	L	97.3	Very high	95.2	Very high	86 Å²	86	76.1 Å²	76.1	45%	0.45	38%	0.383	S	S	.	.	H	α-helix	trans	-63.4	-45.2	177.5	-74.8	175	0	0	0	111.9	F71 A72 A77 H78 V79	F71-L75 HydrophobicContact CD1-CD1 3.92Å; F71-L75 HydrophobicContact CD1-CG 4.42Å; F71-L75 HydrophobicContact CE1-CD1 3.47Å; F71-L75 VanDerWaalsContact CE1-CD1 3.47Å; F71-L75 HydrophobicContact CE1-CG 4.06Å; F71-L75 HydrophobicContact CZ-CD1 4.01Å; F71-L75 HydrophobicContact CZ-CD2 4.31Å; F71-L75 HydrophobicContact CZ-CG 4.17Å; F71-L75 PolarHBondContact O-N 3.3Å; A72-L75 PolarHBondContact O-N 3.02Å; L75-A77 VanDerWaalsContact C-N 3.33Å; L75-A77 PolarHBondContact O-N 3.4Å; L75-H78 WeakPolarHBondContact O-CB 3.22Å; L75-H78 PolarHBondContact O-N 2.9Å; L75-H78 VanDerWaalsContact O-N 3.14Å; L75-V79 WeakPolarHBondContact O-CG2 3.42Å; L75-V79 PolarHBondContact O-N 2.89Å
76	M	97.5	Very high	95.5	Very high	128 Å²	128	78.8 Å²	78.8	63%	0.631	40%	0.396	S	S	*	.	H	α-helix	trans	-60.5	-44.9	178.7	-170.4	66.5	169.9	0	0	111.1	A72 D73 H78 V79 V80	A72-M76 WeakPolarHBondContact O-CB 3.22Å; A72-M76 PolarHBondContact O-N 3.19Å; D73-M76 PolarHBondContact O-N 3.41Å; M76-H78 VanDerWaalsContact C-N 3.3Å; M76-H78 PolarHBondContact O-N 3.17Å; M76-V79 PolarHBondContact O-N 3.42Å; M76-V80 WeakPolarHBondContact O-CG2 3.4Å; M76-V80 PolarHBondContact O-N 2.94Å; M76-V80 VanDerWaalsContact O-N 3.1Å
77	A	97.7	Very high	95.7	Very high	35 Å²	35	82.7 Å²	82.7	29%	0.289	41%	0.413	S	S	.	.	H	α-helix	trans	-61.9	-38.3	175.4	0	0	0	0	0	112.1	L46 D73 F74 L75 V80 L81	L46-A77 HydrophobicContact CD1-CB 3.9Å; L46-A77 HydrophobicContact CD2-CB 3.61Å; L46-A77 HydrophobicContact CG-CB 4.41Å; D73-A77 WeakPolarHBondContact O-CB 3.3Å; D73-A77 PolarHBondContact O-N 3.24Å; F74-A77 PolarHBondContact O-N 3.08Å; L75-A77 VanDerWaalsContact C-N 3.33Å; L75-A77 PolarHBondContact O-N 3.4Å; A77-V80 PolarHBondContact O-N 3.04Å; A77-L81 VanDerWaalsContact O-CB 3.26Å; A77-L81 WeakPolarHBondContact O-CB 3.2Å; A77-L81 PolarHBondContact O-N 3.44Å
78	H	97.6	Very high	95.8	Very high	24 Å²	24	79.4 Å²	79.4	11%	0.111	40%	0.403	C	S	.	.	H	α-helix	trans	-64.4	-41.5	175.3	-101.3	-83	0	0	0	113.1	Y7 S43 F74 L75 M76 L81 H82	Y7-H78 PolarHBondContact OH-CE1 3.34Å; S43-H78 PolarHBondContact OG-CE1 2.96Å; F74-H78 AromaticContact CD2-CD2 3.91Å; F74-H78 AromaticContact CE1-CD2 3.67Å; F74-H78 AromaticContact CE2-CD2 3.41Å; F74-H78 VanDerWaalsContact CE2-CD2 3.41Å; F74-H78 WeakPolarHBondContact CE2-CD2 3.24Å; F74-H78 AromaticContact CE2-NE2 3.33Å; F74-H78 VanDerWaalsContact CE2-NE2 3.33Å; F74-H78 WeakPolarHBondContact CE2-NE2 3.5Å; F74-H78 AromaticContact CZ-CD2 3.28Å; F74-H78 WeakPolarHBondContact CZ-CD2 3.42Å; F74-H78 AromaticContact CZ-NE2 3.2Å; F74-H78 WeakPolarHBondContact CZ-NE2 3.2Å; F74-H78 PolarHBondContact O-CD2 3.03Å; F74-H78 PolarHBondContact O-N 3.4Å; L75-H78 WeakPolarHBondContact O-CB 3.22Å; L75-H78 PolarHBondContact O-N 2.9Å; L75-H78 VanDerWaalsContact O-N 3.14Å; M76-H78 VanDerWaalsContact C-N 3.3Å; M76-H78 PolarHBondContact O-N 3.17Å; H78-L81 PolarHBondContact O-N 3.26Å; H78-H82 AromaticContact ND1-CE1 3.38Å; H78-H82 PolarHBondContact ND1-CE1 3.05Å; H78-H82 AromaticContact ND1-ND1 3.73Å; H78-H82 WeakPolarHBondContact O-CB 3.37Å; H78-H82 PolarHBondContact O-N 3.48Å; H78-H82 PolarHBondContact O-ND1 2.64Å
79	V	98	Very high	95.7	Very high	95 Å²	95	77.6 Å²	77.6	58%	0.576	40%	0.397	S	S	*	.	H	α-helix	trans	-61.3	-48.7	176.6	170.5	0	0	0	0	110.4	L75 M76 H82 L83	L75-V79 WeakPolarHBondContact O-CG2 3.42Å; L75-V79 PolarHBondContact O-N 2.89Å; M76-V79 PolarHBondContact O-N 3.42Å; V79-H82 PolarHBondContact O-N 3.46Å; V79-L83 WeakPolarHBondContact O-CB 3.4Å; V79-L83 PolarHBondContact O-N 3.23Å
80	V	97.6	Very high	95.2	Very high	69 Å²	69	75.3 Å²	75.3	42%	0.418	42%	0.417	S	S	.	.	H	α-helix	trans	-61.5	-47.6	178.3	176.2	0	0	0	0	110.6	M76 A77 H82 L83 F84	M76-V80 WeakPolarHBondContact O-CG2 3.4Å; M76-V80 PolarHBondContact O-N 2.94Å; M76-V80 VanDerWaalsContact O-N 3.1Å; A77-V80 PolarHBondContact O-N 3.04Å; V80-H82 PolarHBondContact O-N 2.78Å; V80-L83 WeakPolarHBondContact O-CB 3.39Å; V80-L83 PolarHBondContact O-N 3.23Å; V80-F84 HydrophobicContact CG1-CD2 3.87Å; V80-F84 HydrophobicContact CG1-CE2 3.65Å; V80-F84 VanDerWaalsContact O-CD2 3.24Å; V80-F84 WeakPolarHBondContact O-CD2 3.32Å; V80-F84 PolarHBondContact O-N 2.88Å
81	L	97.2	Very high	95.3	Very high	24 Å²	24	78.9 Å²	78.9	13%	0.126	44%	0.437	C	S	.	.	H	α-helix	trans	-54.5	-51.3	177.3	172.2	62.9	0	0	0	111.8	A42 L46 A77 H78 L83 F84 V85	A42-L81 HydrophobicContact CB-CD1 3.49Å; A42-L81 VanDerWaalsContact CB-CD1 3.49Å; A42-L81 HydrophobicContact CB-CD2 3.56Å; A42-L81 HydrophobicContact CB-CG 4.17Å; L46-L81 HydrophobicContact CD1-CD2 4.03Å; A77-L81 VanDerWaalsContact O-CB 3.26Å; A77-L81 WeakPolarHBondContact O-CB 3.2Å; A77-L81 PolarHBondContact O-N 3.44Å; H78-L81 PolarHBondContact O-N 3.26Å; L81-L83 VanDerWaalsContact C-N 3.29Å; L81-L83 PolarHBondContact O-N 3.43Å; L81-F84 PolarHBondContact O-N 3.33Å; L81-V85 HydrophobicContact CD1-CG2 3.99Å; L81-V85 HydrophobicContact CG-CG2 4.36Å; L81-V85 VanDerWaalsContact O-CG2 3.29Å; L81-V85 WeakPolarHBondContact O-CG2 3.38Å; L81-V85 PolarHBondContact O-N 3.35Å
82	H	95.7	Very high	95.3	Very high	73 Å²	73	77.6 Å²	77.6	34%	0.338	44%	0.436	S	S	.	.	H	α-helix	trans	-69.4	-29.7	-176	-74.9	72.6	0	0	0	112.2	H78 V79 V80 V85 I86	H78-H82 AromaticContact ND1-CE1 3.38Å; H78-H82 PolarHBondContact ND1-CE1 3.05Å; H78-H82 AromaticContact ND1-ND1 3.73Å; H78-H82 WeakPolarHBondContact O-CB 3.37Å; H78-H82 PolarHBondContact O-N 3.48Å; H78-H82 PolarHBondContact O-ND1 2.64Å; V79-H82 PolarHBondContact O-N 3.46Å; V80-H82 PolarHBondContact O-N 2.78Å; H82-V85 PolarHBondContact O-N 2.95Å; H82-I86 WeakPolarHBondContact O-CB 3.46Å; H82-I86 WeakPolarHBondContact O-CD1 3.29Å; H82-I86 WeakPolarHBondContact O-CG1 2.99Å; H82-I86 PolarHBondContact O-N 3.45Å
83	L	96.7	Very high	95.3	Very high	119 Å²	119	79.2 Å²	79.2	62%	0.623	44%	0.438	S	S	*	.	H	α-helix	trans	-62.8	-43.9	173.1	-167.8	140.7	0	0	0	111.6	V79 V80 L81 N87	V79-L83 WeakPolarHBondContact O-CB 3.4Å; V79-L83 PolarHBondContact O-N 3.23Å; V80-L83 WeakPolarHBondContact O-CB 3.39Å; V80-L83 PolarHBondContact O-N 3.23Å; L81-L83 VanDerWaalsContact C-N 3.29Å; L81-L83 PolarHBondContact O-N 3.43Å; L83-N87 WeakPolarHBondContact O-CB 3.31Å; L83-N87 PolarHBondContact O-N 3.25Å; L83-N87 VanDerWaalsContact O-N 3.16Å
84	F	95	Very high	95.2	Very high	134 Å²	134	80.5 Å²	80.5	59%	0.588	45%	0.445	S	S	*	.	H	α-helix	trans	-68.3	-41.9	174.3	-77.9	-74	0	0	0	112.8	V80 L81 I86 N87 F88	V80-F84 HydrophobicContact CG1-CD2 3.87Å; V80-F84 HydrophobicContact CG1-CE2 3.65Å; V80-F84 VanDerWaalsContact O-CD2 3.24Å; V80-F84 WeakPolarHBondContact O-CD2 3.32Å; V80-F84 PolarHBondContact O-N 2.88Å; L81-F84 PolarHBondContact O-N 3.33Å; F84-I86 PolarHBondContact O-N 3.43Å; F84-N87 PolarHBondContact O-N 2.93Å; F84-F88 VanDerWaalsContact O-CB 3.31Å; F84-F88 WeakPolarHBondContact O-CB 3.31Å; F84-F88 PolarHBondContact O-N 3.16Å
85	V	95.8	Very high	95.1	Very high	17 Å²	17	83.4 Å²	83.4	10%	0.103	46%	0.464	C	S	.	.	H	α-helix	trans	-61	-46.3	179	168.2	0	0	0	0	111.2	A35 L81 H82 N87 F88 I89	A35-V85 HydrophobicContact CB-CG1 4.27Å; L81-V85 HydrophobicContact CD1-CG2 3.99Å; L81-V85 HydrophobicContact CG-CG2 4.36Å; L81-V85 VanDerWaalsContact O-CG2 3.29Å; L81-V85 WeakPolarHBondContact O-CG2 3.38Å; L81-V85 PolarHBondContact O-N 3.35Å; H82-V85 PolarHBondContact O-N 2.95Å; V85-N87 VanDerWaalsContact C-N 3.3Å; V85-N87 PolarHBondContact O-N 3.49Å; V85-F88 PolarHBondContact O-N 2.84Å; V85-I89 PolarHBondContact O-N 3.08Å
86	I	95.2	Very high	95	Very high	125 Å²	125	83.3 Å²	83.3	64%	0.641	47%	0.465	S	S	*	.	H	α-helix	trans	-66	-35.7	178.8	-66.9	165	0	0	0	110.8	H82 F84 F88 I89	H82-I86 WeakPolarHBondContact O-CB 3.46Å; H82-I86 WeakPolarHBondContact O-CD1 3.29Å; H82-I86 WeakPolarHBondContact O-CG1 2.99Å; H82-I86 PolarHBondContact O-N 3.45Å; F84-I86 PolarHBondContact O-N 3.43Å; I86-F88 VanDerWaalsContact C-N 3.34Å; I86-I89 WeakPolarHBondContact O-CG2 3.5Å
87	N	93.2	Very high	94.8	Very high	134 Å²	134	80.1 Å²	80.1	72%	0.717	45%	0.453	S	S	*	.	H	α-helix	trans	-68.8	-32.1	175.8	-174.1	-106.4	0	0	0	112.9	L83 F84 V85	L83-N87 WeakPolarHBondContact O-CB 3.31Å; L83-N87 PolarHBondContact O-N 3.25Å; L83-N87 VanDerWaalsContact O-N 3.16Å; F84-N87 PolarHBondContact O-N 2.93Å; V85-N87 VanDerWaalsContact C-N 3.3Å; V85-N87 PolarHBondContact O-N 3.49Å
88	F	92.1	Very high	94.6	Very high	92 Å²	92	83.5 Å²	83.5	40%	0.404	47%	0.466	S	S	.	.	H	α-helix	trans	-93.1	-9.8	-175.1	-167	-101.8	0	0	0	114.6	N31 L34 A35 F84 V85 I86 G90	N31-F88 HydrophobicContact CB-CE1 4.3Å; L34-F88 HydrophobicContact CB-CE1 3.81Å; A35-F88 HydrophobicContact CB-CD1 4.06Å; F84-F88 VanDerWaalsContact O-CB 3.31Å; F84-F88 WeakPolarHBondContact O-CB 3.31Å; F84-F88 PolarHBondContact O-N 3.16Å; V85-F88 PolarHBondContact O-N 2.84Å; I86-F88 VanDerWaalsContact C-N 3.34Å; F88-G90 VanDerWaalsContact C-N 3.26Å; F88-G90 PolarHBondContact O-N 3.3Å
89	I	91.3	Very high	94.3	Very high	86 Å²	86	88.5 Å²	88.5	44%	0.441	50%	0.495	S	S	.	.			trans	-69.4	-21	-173	-159.6	168.1	0	0	0	114.1	S32 A35 V85 I86	S32-I89 WeakPolarHBondContact CA-O 3.45Å; S32-I89 WeakPolarHBondContact CB-O 3.37Å; S32-I89 PolarHBondContact OG-O 2.75Å; A35-I89 HydrophobicContact CB-CB 3.92Å; A35-I89 HydrophobicContact CB-CG1 4.03Å; V85-I89 PolarHBondContact O-N 3.08Å; I86-I89 WeakPolarHBondContact O-CG2 3.5Å
90	G	83.7	Confident	94	Very high	94 Å²	94	87.9 Å²	87.9	97%	0.969	49%	0.488	S	S	*	.			trans	-92.9	0	178.7	0	0	0	0	0	114.6	N31 F88	N31-G90 WeakPolarHBondContact CB-OXT 3.42Å; N31-G90 PolarHBondContact ND2-OXT 3.43Å; N31-G90 VanDerWaalsContact ND2-OXT 3.08Å; F88-G90 VanDerWaalsContact C-N 3.26Å; F88-G90 PolarHBondContact O-N 3.3Å

Retrieved 90 of 90 residues in 121.1 ms (Link to these results)

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