X6RC30_HUMAN Loading...

Ubiquitin carboxyl-terminal hydrolase MINDY

Hydrolase that can remove 'Lys-48'-linked conjugated ubiquitin from proteins.

AlphaFold DB , UniProt , Accession X6RC30, Species HUMAN (Homo sapiens, Human), Gene MINDY3, Length 182 aa.

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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	L	58.9	Low	78.8	Confident	177 Å²	177	107.1 Å²	107.1	93%	0.927	57%	0.568	S	S	*	*				0	-53	0	-90.5	163.6	0	0	0	112.2	L4 K5	L1-L4 PolarHBondContact O-N 3.29Å; L1-K5 PolarHBondContact O-N 3.31Å; L1-K5 VanDerWaalsContact O-N 3.11Å
2	P	74.3	Confident	79.2	Confident	91 Å²	91	111.3 Å²	111.3	59%	0.591	57%	0.572	S	S	*	*	H	α-helix	trans	-59.3	-49.5	173.1	-21.7	33.3	0	0	0	111.9	L4 K5 D6	P2-L4 VanDerWaalsContact C-N 3.32Å; P2-L4 PolarHBondContact O-N 2.9Å; P2-K5 WeakPolarHBondContact O-CB 3.22Å; P2-K5 PolarHBondContact O-N 2.66Å; P2-D6 WeakPolarHBondContact O-CB 3.48Å; P2-D6 PolarHBondContact O-N 3.04Å
3	E	77.6	Confident	79.6	Confident	162 Å²	162	108.5 Å²	108.5	76%	0.757	57%	0.568	S	S	*	*	H	α-helix	trans	-57.9	-38.9	179	-64.4	168.5	177.5	0	0	113.8	A7	E3-A7 WeakPolarHBondContact O-CB 3.21Å; E3-A7 PolarHBondContact O-N 2.98Å
4	L	72.6	Confident	79.9	Confident	114 Å²	114	107.2 Å²	107.2	60%	0.597	56%	0.56	S	S	*	*	H	α-helix	trans	-68.7	-43	175.8	177.4	64.4	0	0	0	111.1	L1 P2 D6 A7 V8	L1-L4 PolarHBondContact O-N 3.29Å; P2-L4 VanDerWaalsContact C-N 3.32Å; P2-L4 PolarHBondContact O-N 2.9Å; L4-D6 VanDerWaalsContact C-N 3.31Å; L4-A7 PolarHBondContact O-N 3.35Å; L4-V8 HydrophobicContact CD1-CG2 4.22Å; L4-V8 WeakPolarHBondContact O-CB 3.39Å; L4-V8 VanDerWaalsContact O-CG2 3.24Å; L4-V8 WeakPolarHBondContact O-CG2 3.47Å; L4-V8 PolarHBondContact O-N 3.49Å
5	K	79.6	Confident	80	Confident	137 Å²	137	106.9 Å²	106.9	60%	0.596	55%	0.548	S	S	*	.	H	α-helix	trans	-61.8	-44.7	177.3	-178.1	-172.5	173.2	-170	0	110.3	L1 P2 V8 L9	L1-K5 PolarHBondContact O-N 3.31Å; L1-K5 VanDerWaalsContact O-N 3.11Å; P2-K5 WeakPolarHBondContact O-CB 3.22Å; P2-K5 PolarHBondContact O-N 2.66Å; K5-V8 PolarHBondContact O-N 3.29Å; K5-L9 HydrophobicContact CG-CD1 3.95Å; K5-L9 WeakPolarHBondContact O-CB 3.35Å; K5-L9 VanDerWaalsContact O-CG 3.27Å; K5-L9 WeakPolarHBondContact O-CG 3.4Å; K5-L9 PolarHBondContact O-N 3.23Å
6	D	88	Confident	80.2	Confident	83 Å²	83	103.9 Å²	103.9	44%	0.444	55%	0.552	S	S	.	*	H	α-helix	trans	-66.2	-46.3	179.9	-61.9	-21.6	0	0	0	110.1	P2 L4 V8 L9 D10	P2-D6 WeakPolarHBondContact O-CB 3.48Å; P2-D6 PolarHBondContact O-N 3.04Å; L4-D6 VanDerWaalsContact C-N 3.31Å; D6-V8 VanDerWaalsContact C-N 3.34Å; D6-V8 PolarHBondContact O-N 3.26Å; D6-L9 PolarHBondContact O-N 3.36Å; D6-D10 WeakPolarHBondContact O-CB 3.35Å; D6-D10 PolarHBondContact O-N 3.01Å
7	A	80.8	Confident	80.6	Confident	51 Å²	51	104.1 Å²	104.1	42%	0.421	55%	0.553	S	S	.	*	H	α-helix	trans	-58.2	-42.1	174.4	0	0	0	0	0	113	E3 L4 Q11	E3-A7 WeakPolarHBondContact O-CB 3.21Å; E3-A7 PolarHBondContact O-N 2.98Å; L4-A7 PolarHBondContact O-N 3.35Å; A7-Q11 VanDerWaalsContact O-CG 3.28Å; A7-Q11 WeakPolarHBondContact O-CG 3.23Å; A7-Q11 PolarHBondContact O-N 2.96Å
8	V	80.5	Confident	81	Confident	59 Å²	59	107.8 Å²	107.8	36%	0.358	56%	0.564	S	S	.	*	H	α-helix	trans	-66.5	-43.6	176.9	168.4	0	0	0	0	111.2	L4 K5 D6 Q11 Y12 W15	L4-V8 HydrophobicContact CD1-CG2 4.22Å; L4-V8 WeakPolarHBondContact O-CB 3.39Å; L4-V8 VanDerWaalsContact O-CG2 3.24Å; L4-V8 WeakPolarHBondContact O-CG2 3.47Å; L4-V8 PolarHBondContact O-N 3.49Å; K5-V8 PolarHBondContact O-N 3.29Å; D6-V8 VanDerWaalsContact C-N 3.34Å; D6-V8 PolarHBondContact O-N 3.26Å; V8-Q11 PolarHBondContact O-N 3.34Å; V8-Y12 WeakPolarHBondContact O-CB 3.5Å; V8-Y12 PolarHBondContact O-N 3.44Å; V8-W15 HydrophobicContact CG1-CZ3 4.18Å
9	L	85.4	Confident	81.4	Confident	100 Å²	100	108.9 Å²	108.9	52%	0.524	56%	0.564	S	S	.	*	H	α-helix	trans	-68.2	-37.5	179.8	-72.5	173.1	0	0	0	112.2	K5 D6 Q11 Y12	K5-L9 HydrophobicContact CG-CD1 3.95Å; K5-L9 WeakPolarHBondContact O-CB 3.35Å; K5-L9 VanDerWaalsContact O-CG 3.27Å; K5-L9 WeakPolarHBondContact O-CG 3.4Å; K5-L9 PolarHBondContact O-N 3.23Å; D6-L9 PolarHBondContact O-N 3.36Å; L9-Q11 VanDerWaalsContact C-N 3.32Å; L9-Q11 PolarHBondContact O-N 2.89Å; L9-Y12 WeakPolarHBondContact O-CB 3.32Å; L9-Y12 PolarHBondContact O-N 3.37Å
10	D	86.9	Confident	81.8	Confident	116 Å²	116	103.7 Å²	103.7	62%	0.62	54%	0.538	S	S	*	.	H	α-helix	trans	-64.1	-39	177	-74	-13.8	0	0	0	111.4	D6	D6-D10 WeakPolarHBondContact O-CB 3.35Å; D6-D10 PolarHBondContact O-N 3.01Å
11	Q	82.3	Confident	82.1	Confident	88 Å²	88	104 Å²	104	41%	0.411	54%	0.544	S	S	.	.	H	α-helix	trans	-85.4	-13.8	178.1	-60.4	-59.1	-48.2	0	0	113.5	A7 V8 L9 S13 M14 W15	A7-Q11 VanDerWaalsContact O-CG 3.28Å; A7-Q11 WeakPolarHBondContact O-CG 3.23Å; A7-Q11 PolarHBondContact O-N 2.96Å; V8-Q11 PolarHBondContact O-N 3.34Å; L9-Q11 VanDerWaalsContact C-N 3.32Å; L9-Q11 PolarHBondContact O-N 2.89Å; Q11-S13 VanDerWaalsContact C-N 3.27Å; Q11-S13 PolarHBondContact O-N 3.21Å; Q11-M14 WeakPolarHBondContact O-CB 3.34Å; Q11-M14 PolarHBondContact O-N 2.96Å; Q11-W15 HydrophobicContact CB-CZ2 4.04Å; Q11-W15 PolarHBondContact O-N 3.03Å; Q11-W15 VanDerWaalsContact O-N 3.1Å
12	Y	83.8	Confident	83.6	Confident	157 Å²	157	98.6 Å²	98.6	62%	0.616	52%	0.516	S	S	*	.	H	α-helix	trans	-56.2	-42	-175.7	-178.8	-98.6	0	0	0	112.5	V8 L9 M14 W15 G16	V8-Y12 WeakPolarHBondContact O-CB 3.5Å; V8-Y12 PolarHBondContact O-N 3.44Å; L9-Y12 WeakPolarHBondContact O-CB 3.32Å; L9-Y12 PolarHBondContact O-N 3.37Å; Y12-M14 VanDerWaalsContact C-N 3.29Å; Y12-M14 PolarHBondContact O-N 2.86Å; Y12-W15 PolarHBondContact O-N 3.01Å; Y12-G16 PolarHBondContact O-N 3.04Å
13	S	84.4	Confident	84.4	Confident	75 Å²	75	99.5 Å²	99.5	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-61.9	-37.2	178.3	65.9	0	0	0	0	112.2	Q11 N17	Q11-S13 VanDerWaalsContact C-N 3.27Å; Q11-S13 PolarHBondContact O-N 3.21Å; S13-N17 WeakPolarHBondContact O-CB 3.44Å; S13-N17 PolarHBondContact O-N 3.37Å; S13-N17 PolarHBondContact O-ND2 3.12Å
14	M	83.1	Confident	85	Confident	91 Å²	91	96.4 Å²	96.4	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-67.2	-42.2	175.7	-177.5	-175.8	74.9	0	0	111.6	Q11 Y12 N17 G20	Q11-M14 WeakPolarHBondContact O-CB 3.34Å; Q11-M14 PolarHBondContact O-N 2.96Å; Y12-M14 VanDerWaalsContact C-N 3.29Å; Y12-M14 PolarHBondContact O-N 2.86Å; M14-N17 PolarHBondContact O-N 2.85Å; M14-G20 WeakPolarHBondContact O-CA 3.22Å
15	W	81.3	Confident	86	Confident	102 Å²	102	92 Å²	92	39%	0.386	48%	0.477	S	S	.	.	H	α-helix	trans	-70.7	-36.2	178.3	-60.5	-18.9	0	0	0	112.8	V8 Q11 Y12 N17	V8-W15 HydrophobicContact CG1-CZ3 4.18Å; Q11-W15 HydrophobicContact CB-CZ2 4.04Å; Q11-W15 PolarHBondContact O-N 3.03Å; Q11-W15 VanDerWaalsContact O-N 3.1Å; Y12-W15 PolarHBondContact O-N 3.01Å; W15-N17 VanDerWaalsContact C-N 3.32Å
16	G	83.9	Confident	86.7	Confident	60 Å²	60	91.1 Å²	91.1	62%	0.619	47%	0.47	S	S	*	.	H	α-helix	trans	-77.4	-13.6	176.6	0	0	0	0	0	114.4	Y12	Y12-G16 PolarHBondContact O-N 3.04Å
17	N	86.8	Confident	87	Confident	106 Å²	106	89.8 Å²	89.8	57%	0.567	47%	0.467	S	S	*	.	S	Bend	trans	-67.4	160.2	176.4	-86.2	-32.6	0	0	0	111.8	S13 M14 W15 F19 G20	S13-N17 WeakPolarHBondContact O-CB 3.44Å; S13-N17 PolarHBondContact O-N 3.37Å; S13-N17 PolarHBondContact O-ND2 3.12Å; M14-N17 PolarHBondContact O-N 2.85Å; W15-N17 VanDerWaalsContact C-N 3.32Å; N17-F19 PolarHBondContact O-N 2.88Å; N17-F19 VanDerWaalsContact O-N 3.1Å; N17-G20 PolarHBondContact O-N 2.88Å
18	K	87.8	Confident	87.7	Confident	172 Å²	172	88.7 Å²	88.7	75%	0.748	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	121.1	175.4	-166.3	-174.8	-177.2	-177.7	0	109.5	G20	K18-G20 VanDerWaalsContact C-N 3.32Å; K18-G20 PolarHBondContact O-N 3.03Å
19	F	89	Confident	88.4	Confident	128 Å²	128	87.1 Å²	87.1	56%	0.561	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	11.3	-176.4	-43.8	-63.8	0	0	0	116.6	N17 V21 L22 L23	N17-F19 PolarHBondContact O-N 2.88Å; N17-F19 VanDerWaalsContact O-N 3.1Å; F19-V21 VanDerWaalsContact C-N 3.34Å; F19-V21 PolarHBondContact O-N 3.45Å; F19-L22 HydrophobicContact CB-CB 4.34Å; F19-L22 HydrophobicContact CD1-CD2 4.44Å; F19-L22 WeakPolarHBondContact O-CB 3.46Å; F19-L22 PolarHBondContact O-N 3.42Å; F19-L23 WeakPolarHBondContact O-CG 3.4Å; F19-L23 PolarHBondContact O-N 3.21Å
20	G	89.2	Confident	89	Confident	5 Å²	5	88.6 Å²	88.6	5%	0.052	45%	0.453	C	S	.	.	H	α-helix	trans	-54	-46.5	-177.7	0	0	0	0	0	113.7	M14 N17 K18 L22 L23 F24	M14-G20 WeakPolarHBondContact O-CA 3.22Å; N17-G20 PolarHBondContact O-N 2.88Å; K18-G20 VanDerWaalsContact C-N 3.32Å; K18-G20 PolarHBondContact O-N 3.03Å; G20-L22 VanDerWaalsContact C-N 3.34Å; G20-L22 PolarHBondContact O-N 2.87Å; G20-L23 PolarHBondContact O-N 3.15Å; G20-F24 PolarHBondContact O-N 3.2Å
21	V	88	Confident	89.4	Confident	110 Å²	110	89.1 Å²	89.1	67%	0.667	46%	0.46	S	S	*	.	H	α-helix	trans	-64	-37.7	176.1	179.6	0	0	0	0	112.2	F19 F24 L25	F19-V21 VanDerWaalsContact C-N 3.34Å; F19-V21 PolarHBondContact O-N 3.45Å; V21-F24 PolarHBondContact O-N 2.87Å; V21-L25 PolarHBondContact O-N 2.99Å
22	L	90.4	Very high	90.1	Very high	64 Å²	64	87.1 Å²	87.1	34%	0.335	45%	0.45	S	S	.	.	H	α-helix	trans	-69.6	-40.4	178.5	-176.6	65.2	0	0	0	111.6	F19 G20 F24 L25 Y26	F19-L22 HydrophobicContact CB-CB 4.34Å; F19-L22 HydrophobicContact CD1-CD2 4.44Å; F19-L22 WeakPolarHBondContact O-CB 3.46Å; F19-L22 PolarHBondContact O-N 3.42Å; G20-L22 VanDerWaalsContact C-N 3.34Å; G20-L22 PolarHBondContact O-N 2.87Å; L22-F24 VanDerWaalsContact C-N 3.33Å; L22-L25 HydrophobicContact CD1-CD2 4.43Å; L22-L25 WeakPolarHBondContact O-CB 3.24Å; L22-L25 PolarHBondContact O-N 3.11Å; L22-Y26 HydrophobicContact CD1-CE1 4.06Å; L22-Y26 HydrophobicContact CD1-CE2 4.36Å; L22-Y26 HydrophobicContact CD2-CE2 4.18Å; L22-Y26 HydrophobicContact CG-CD2 4.42Å; L22-Y26 HydrophobicContact CG-CE1 4.46Å; L22-Y26 HydrophobicContact CG-CE2 3.88Å; L22-Y26 PolarHBondContact O-N 3.46Å
23	L	91.4	Very high	90.7	Very high	109 Å²	109	80.7 Å²	80.7	57%	0.571	43%	0.432	S	S	*	.	H	α-helix	trans	-64.7	-39.9	174.5	-70.1	174.1	0	0	0	111.4	F19 G20 L25 Y26 S27	F19-L23 WeakPolarHBondContact O-CG 3.4Å; F19-L23 PolarHBondContact O-N 3.21Å; G20-L23 PolarHBondContact O-N 3.15Å; L23-L25 VanDerWaalsContact C-N 3.35Å; L23-Y26 PolarHBondContact O-N 3.19Å; L23-S27 PolarHBondContact O-N 3.47Å
24	F	90.4	Very high	91.2	Very high	97 Å²	97	80.8 Å²	80.8	43%	0.425	43%	0.426	S	S	.	.	H	α-helix	trans	-60.5	-46.2	172.5	175.9	-108.9	0	0	0	110.9	G20 V21 L22 Y26 S27 V28 L64	G20-F24 PolarHBondContact O-N 3.2Å; V21-F24 PolarHBondContact O-N 2.87Å; L22-F24 VanDerWaalsContact C-N 3.33Å; F24-Y26 PolarHBondContact O-N 2.99Å; F24-S27 WeakPolarHBondContact O-CB 3.49Å; F24-S27 PolarHBondContact O-N 3.43Å; F24-S27 VanDerWaalsContact O-N 3.07Å; F24-S27 PolarHBondContact O-OG 3.4Å; F24-V28 HydrophobicContact CE1-CG2 4.1Å; F24-V28 HydrophobicContact CE2-CG2 4.2Å; F24-V28 HydrophobicContact CZ-CG2 3.91Å; F24-V28 PolarHBondContact O-N 3.21Å; F24-L64 HydrophobicContact CE1-CD2 4.16Å
25	L	93	Very high	91.8	Very high	23 Å²	23	81.8 Å²	81.8	12%	0.12	43%	0.429	C	S	.	.	H	α-helix	trans	-56.8	-47.9	174.6	175.6	61.2	0	0	0	111.8	V21 L22 L23 S27 V28 L29 I49 L60	V21-L25 PolarHBondContact O-N 2.99Å; L22-L25 HydrophobicContact CD1-CD2 4.43Å; L22-L25 WeakPolarHBondContact O-CB 3.24Å; L22-L25 PolarHBondContact O-N 3.11Å; L23-L25 VanDerWaalsContact C-N 3.35Å; L25-S27 VanDerWaalsContact C-N 3.26Å; L25-S27 PolarHBondContact O-N 3.22Å; L25-V28 WeakPolarHBondContact O-CB 3.27Å; L25-V28 PolarHBondContact O-N 3.35Å; L25-V28 VanDerWaalsContact O-N 3.1Å; L25-L29 HydrophobicContact CD1-CD1 4.33Å; L25-L29 HydrophobicContact CD1-CD2 4.39Å; L25-L29 HydrophobicContact CD1-CG 4.12Å; L25-L29 HydrophobicContact CG-CD1 4.15Å; L25-L29 HydrophobicContact CG-CG 4.35Å; L25-L29 WeakPolarHBondContact O-CG 3.28Å; L25-L29 PolarHBondContact O-N 3.24Å; L25-I49 HydrophobicContact CD2-CD1 3.63Å; L25-L60 HydrophobicContact CD1-CD1 3.48Å; L25-L60 VanDerWaalsContact CD1-CD1 3.48Å; L25-L60 HydrophobicContact CD1-CD2 4.4Å
26	Y	94	Very high	92.4	Very high	117 Å²	117	81.1 Å²	81.1	46%	0.459	43%	0.433	S	S	.	.	H	α-helix	trans	-59.5	-37.8	175.9	-67.9	-24.7	0	0	0	112.5	L22 L23 F24 V28 L29 L30	L22-Y26 HydrophobicContact CD1-CE1 4.06Å; L22-Y26 HydrophobicContact CD1-CE2 4.36Å; L22-Y26 HydrophobicContact CD2-CE2 4.18Å; L22-Y26 HydrophobicContact CG-CD2 4.42Å; L22-Y26 HydrophobicContact CG-CE1 4.46Å; L22-Y26 HydrophobicContact CG-CE2 3.88Å; L22-Y26 PolarHBondContact O-N 3.46Å; L23-Y26 PolarHBondContact O-N 3.19Å; F24-Y26 PolarHBondContact O-N 2.99Å; Y26-V28 VanDerWaalsContact C-N 3.32Å; Y26-V28 PolarHBondContact O-N 2.85Å; Y26-L29 HydrophobicContact CD1-CD1 4.34Å; Y26-L29 PolarHBondContact O-N 3.36Å; Y26-L30 VanDerWaalsContact O-CB 3.31Å; Y26-L30 WeakPolarHBondContact O-CB 3.17Å; Y26-L30 WeakPolarHBondContact O-CG 3.22Å; Y26-L30 PolarHBondContact O-N 3.01Å
27	S	93.9	Very high	92.9	Very high	55 Å²	55	78.7 Å²	78.7	39%	0.385	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-40.3	175.2	79.5	0	0	0	0	112.1	L23 F24 L25 T31	L23-S27 PolarHBondContact O-N 3.47Å; F24-S27 WeakPolarHBondContact O-CB 3.49Å; F24-S27 PolarHBondContact O-N 3.43Å; F24-S27 VanDerWaalsContact O-N 3.07Å; F24-S27 PolarHBondContact O-OG 3.4Å; L25-S27 VanDerWaalsContact C-N 3.26Å; L25-S27 PolarHBondContact O-N 3.22Å; S27-T31 VanDerWaalsContact O-CB 3.25Å; S27-T31 WeakPolarHBondContact O-CB 3.29Å; S27-T31 PolarHBondContact O-N 3.4Å; S27-T31 PolarHBondContact O-OG1 3.17Å
28	V	95.8	Very high	93.2	Very high	29 Å²	29	78.3 Å²	78.3	18%	0.176	40%	0.399	C	S	.	.	H	α-helix	trans	-65	-49.7	176	173.9	0	0	0	0	110.7	F24 L25 Y26 L30 T31 K32 L63 L64	F24-V28 HydrophobicContact CE1-CG2 4.1Å; F24-V28 HydrophobicContact CE2-CG2 4.2Å; F24-V28 HydrophobicContact CZ-CG2 3.91Å; F24-V28 PolarHBondContact O-N 3.21Å; L25-V28 WeakPolarHBondContact O-CB 3.27Å; L25-V28 PolarHBondContact O-N 3.35Å; L25-V28 VanDerWaalsContact O-N 3.1Å; Y26-V28 VanDerWaalsContact C-N 3.32Å; Y26-V28 PolarHBondContact O-N 2.85Å; V28-L30 VanDerWaalsContact C-N 3.34Å; V28-L30 PolarHBondContact O-N 2.71Å; V28-T31 PolarHBondContact O-N 2.73Å; V28-K32 PolarHBondContact O-N 3.36Å; V28-L63 HydrophobicContact CG1-CD2 4.09Å; V28-L63 HydrophobicContact CG1-CG 4Å; V28-L64 HydrophobicContact CG1-CD2 4.26Å; V28-L64 HydrophobicContact CG2-CD2 4.1Å
29	L	96.2	Very high	93.4	Very high	25 Å²	25	75.9 Å²	75.9	13%	0.131	39%	0.394	C	S	.	.	H	α-helix	trans	-60.6	-42.7	-179.4	-63.6	178.2	0	0	0	112	L25 Y26 G33 I34 I37 L48 L63	L25-L29 HydrophobicContact CD1-CD1 4.33Å; L25-L29 HydrophobicContact CD1-CD2 4.39Å; L25-L29 HydrophobicContact CD1-CG 4.12Å; L25-L29 HydrophobicContact CG-CD1 4.15Å; L25-L29 HydrophobicContact CG-CG 4.35Å; L25-L29 WeakPolarHBondContact O-CG 3.28Å; L25-L29 PolarHBondContact O-N 3.24Å; Y26-L29 HydrophobicContact CD1-CD1 4.34Å; Y26-L29 PolarHBondContact O-N 3.36Å; L29-G33 WeakPolarHBondContact O-CA 3.44Å; L29-G33 PolarHBondContact O-N 3.1Å; L29-I34 HydrophobicContact CB-CD1 4.13Å; L29-I37 HydrophobicContact CB-CD1 4.29Å; L29-I37 HydrophobicContact CD2-CD1 3.49Å; L29-I37 VanDerWaalsContact CD2-CD1 3.49Å; L29-I37 HydrophobicContact CG-CD1 4.49Å; L29-L48 HydrophobicContact CD2-CD1 3.61Å; L29-L63 HydrophobicContact CD2-CD2 3.84Å
30	L	96.9	Very high	93.6	Very high	131 Å²	131	71.2 Å²	71.2	69%	0.686	37%	0.374	S	S	*	.	H	α-helix	trans	-71	-35.6	178.5	-69.1	173.2	0	0	0	112.3	Y26 V28 G33	Y26-L30 VanDerWaalsContact O-CB 3.31Å; Y26-L30 WeakPolarHBondContact O-CB 3.17Å; Y26-L30 WeakPolarHBondContact O-CG 3.22Å; Y26-L30 PolarHBondContact O-N 3.01Å; V28-L30 VanDerWaalsContact C-N 3.34Å; V28-L30 PolarHBondContact O-N 2.71Å; L30-G33 PolarHBondContact O-N 3.21Å
31	T	96.9	Very high	93.6	Very high	127 Å²	127	72 Å²	72	78%	0.779	38%	0.377	S	S	*	.	H	α-helix	trans	-66.9	-42.1	177.1	-60.1	0	0	0	0	111.4	S27 V28	S27-T31 VanDerWaalsContact O-CB 3.25Å; S27-T31 WeakPolarHBondContact O-CB 3.29Å; S27-T31 PolarHBondContact O-N 3.4Å; S27-T31 PolarHBondContact O-OG1 3.17Å; V28-T31 PolarHBondContact O-N 2.73Å
32	K	96.3	Very high	93.4	Very high	46 Å²	46	70.4 Å²	70.4	20%	0.2	36%	0.362	C	S	.	.	H	α-helix	trans	-71.4	-38	175.1	179.6	65.2	175.6	-165.3	0	112.2	V28 N36 I37 E40 L63 G67	V28-K32 PolarHBondContact O-N 3.36Å; K32-N36 HydrophobicContact CG-CB 4.45Å; K32-N36 PolarHBondContact O-ND2 2.78Å; K32-I37 HydrophobicContact CB-CD1 4.13Å; K32-I37 HydrophobicContact CB-CG1 4.15Å; K32-I37 HydrophobicContact CG-CD1 4.06Å; K32-I37 HydrophobicContact CG-CG1 3.52Å; K32-E40 WeakPolarHBondContact CE-OE1 3.21Å; K32-E40 WeakPolarHBondContact CE-OE2 3.45Å; K32-E40 VanDerWaalsContact NZ-CD 3.34Å; K32-E40 IonicContact NZ-OE1 3.84Å; K32-E40 PolarHBondContact NZ-OE1 3.37Å; K32-E40 IonicContact NZ-OE2 3.14Å; K32-E40 PolarHBondContact NZ-OE2 3.3Å; K32-L63 HydrophobicContact CB-CD1 4.19Å; K32-L63 HydrophobicContact CD-CD1 4.29Å; K32-L63 HydrophobicContact CG-CD1 3.92Å; K32-G67 WeakPolarHBondContact CD-O 3.02Å; K32-G67 VanDerWaalsContact CE-O 3.27Å; K32-G67 WeakPolarHBondContact CE-O 2.96Å; K32-G67 PolarHBondContact NZ-O 2.77Å
33	G	97	Very high	93.1	Very high	22 Å²	22	70.9 Å²	70.9	23%	0.227	37%	0.366	C	S	.	.			trans	91.9	131	-174.5	0	0	0	0	0	112.3	L29 L30 E35 N36 I37	L29-G33 WeakPolarHBondContact O-CA 3.44Å; L29-G33 PolarHBondContact O-N 3.1Å; L30-G33 PolarHBondContact O-N 3.21Å; G33-E35 PolarHBondContact O-N 3.2Å; G33-N36 WeakPolarHBondContact O-CB 3.44Å; G33-N36 PolarHBondContact O-N 2.86Å; G33-I37 WeakPolarHBondContact O-CG1 3.39Å; G33-I37 PolarHBondContact O-N 3.25Å; G33-I37 VanDerWaalsContact O-N 3.1Å
34	I	94.4	Very high	92.6	Very high	78 Å²	78	69.2 Å²	69.2	40%	0.4	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-41.9	-173.9	-57.8	-57.3	0	0	0	112.6	L29 N36 I37 K38	L29-I34 HydrophobicContact CB-CD1 4.13Å; I34-N36 VanDerWaalsContact C-N 3.34Å; I34-N36 PolarHBondContact O-N 2.99Å; I34-I37 PolarHBondContact O-N 3.28Å; I34-K38 HydrophobicContact CG2-CD 4.39Å; I34-K38 WeakPolarHBondContact O-CG 3.48Å; I34-K38 PolarHBondContact O-N 3.23Å
35	E	94.4	Very high	92.3	Very high	112 Å²	112	69.1 Å²	69.1	52%	0.523	38%	0.378	S	S	.	.	H	α-helix	trans	-68.3	-35.2	179.9	-62.2	-54.5	124.6	0	0	111.8	G33 I37 K38 N39	G33-E35 PolarHBondContact O-N 3.2Å; E35-I37 VanDerWaalsContact C-N 3.34Å; E35-I37 PolarHBondContact O-N 3.15Å; E35-K38 PolarHBondContact O-N 3.16Å; E35-K38 IonicContact OE1-NZ 2.94Å; E35-K38 PolarHBondContact OE1-NZ 3.38Å; E35-K38 IonicContact OE2-NZ 3.89Å; E35-N39 WeakPolarHBondContact O-CB 3.24Å; E35-N39 PolarHBondContact O-N 3.27Å; E35-N39 PolarHBondContact O-ND2 3.3Å; E35-N39 VanDerWaalsContact O-ND2 3.16Å
36	N	94.9	Very high	91.9	Very high	88 Å²	88	73.7 Å²	73.7	47%	0.471	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-41.4	174.1	-66.4	-26.4	0	0	0	111.3	K32 G33 I34 N39 E40	K32-N36 HydrophobicContact CG-CB 4.45Å; K32-N36 PolarHBondContact O-ND2 2.78Å; G33-N36 WeakPolarHBondContact O-CB 3.44Å; G33-N36 PolarHBondContact O-N 2.86Å; I34-N36 VanDerWaalsContact C-N 3.34Å; I34-N36 PolarHBondContact O-N 2.99Å; N36-N39 PolarHBondContact O-N 2.77Å; N36-E40 WeakPolarHBondContact O-CG 3.41Å; N36-E40 PolarHBondContact O-N 3Å
37	I	95	Very high	91.8	Very high	8 Å²	8	71.5 Å²	71.5	4%	0.041	40%	0.4	C	S	.	.	H	α-helix	trans	-62.4	-47.6	176.4	-67.2	171.6	0	0	0	110.5	L29 K32 G33 I34 E35 N39 E40 I41 L48 L63 A69	L29-I37 HydrophobicContact CB-CD1 4.29Å; L29-I37 HydrophobicContact CD2-CD1 3.49Å; L29-I37 VanDerWaalsContact CD2-CD1 3.49Å; L29-I37 HydrophobicContact CG-CD1 4.49Å; K32-I37 HydrophobicContact CB-CD1 4.13Å; K32-I37 HydrophobicContact CB-CG1 4.15Å; K32-I37 HydrophobicContact CG-CD1 4.06Å; K32-I37 HydrophobicContact CG-CG1 3.52Å; G33-I37 WeakPolarHBondContact O-CG1 3.39Å; G33-I37 PolarHBondContact O-N 3.25Å; G33-I37 VanDerWaalsContact O-N 3.1Å; I34-I37 PolarHBondContact O-N 3.28Å; E35-I37 VanDerWaalsContact C-N 3.34Å; E35-I37 PolarHBondContact O-N 3.15Å; I37-N39 PolarHBondContact O-N 2.93Å; I37-E40 PolarHBondContact O-N 3.04Å; I37-I41 HydrophobicContact CG2-CD1 3.59Å; I37-I41 HydrophobicContact CG2-CG1 4.3Å; I37-I41 WeakPolarHBondContact O-CG1 3.18Å; I37-I41 PolarHBondContact O-N 3.25Å; I37-I41 VanDerWaalsContact O-N 3.09Å; I37-L48 HydrophobicContact CG2-CD1 4.31Å; I37-L63 HydrophobicContact CD1-CD2 3.85Å; I37-L63 HydrophobicContact CG1-CD2 4.32Å; I37-A69 HydrophobicContact CB-CB 4.49Å; I37-A69 HydrophobicContact CG1-CB 4.49Å; I37-A69 HydrophobicContact CG2-CB 3.93Å
38	K	92.3	Very high	91.8	Very high	98 Å²	98	70.5 Å²	70.5	43%	0.426	39%	0.39	S	S	.	.	H	α-helix	trans	-60.3	-33.7	177.9	-72.5	175.2	-177.2	166.3	0	113.1	I34 E35 E40	I34-K38 HydrophobicContact CG2-CD 4.39Å; I34-K38 WeakPolarHBondContact O-CG 3.48Å; I34-K38 PolarHBondContact O-N 3.23Å; E35-K38 PolarHBondContact O-N 3.16Å; E35-K38 IonicContact OE1-NZ 2.94Å; E35-K38 PolarHBondContact OE1-NZ 3.38Å; E35-K38 IonicContact OE2-NZ 3.89Å; K38-E40 VanDerWaalsContact C-N 3.3Å
39	N	91.9	Very high	91.6	Very high	121 Å²	121	72.5 Å²	72.5	65%	0.647	40%	0.398	S	S	*	.	H	α-helix	trans	-74.9	-19.9	177.6	-68.5	-24.5	0	0	0	113.2	E35 N36 I37	E35-N39 WeakPolarHBondContact O-CB 3.24Å; E35-N39 PolarHBondContact O-N 3.27Å; E35-N39 PolarHBondContact O-ND2 3.3Å; E35-N39 VanDerWaalsContact O-ND2 3.16Å; N36-N39 PolarHBondContact O-N 2.77Å; I37-N39 PolarHBondContact O-N 2.93Å
40	E	92.8	Very high	91.4	Very high	30 Å²	30	74 Å²	74	14%	0.14	41%	0.407	C	S	.	.	H	α-helix	trans	-93.8	-23.1	179	-72.6	178	164.6	0	0	113.1	K32 N36 I37 K38 H68 A69	K32-E40 WeakPolarHBondContact CE-OE1 3.21Å; K32-E40 WeakPolarHBondContact CE-OE2 3.45Å; K32-E40 VanDerWaalsContact NZ-CD 3.34Å; K32-E40 IonicContact NZ-OE1 3.84Å; K32-E40 PolarHBondContact NZ-OE1 3.37Å; K32-E40 IonicContact NZ-OE2 3.14Å; K32-E40 PolarHBondContact NZ-OE2 3.3Å; N36-E40 WeakPolarHBondContact O-CG 3.41Å; N36-E40 PolarHBondContact O-N 3Å; I37-E40 PolarHBondContact O-N 3.04Å; K38-E40 VanDerWaalsContact C-N 3.3Å; E40-H68 IonicContact OE1-CE1 3.24Å; E40-H68 IonicContact OE1-CG 3.63Å; E40-H68 IonicContact OE1-ND1 3.1Å; E40-H68 PolarHBondContact OE1-ND1 2.94Å; E40-H68 WeakPolarHBondContact OE2-CA 3.27Å; E40-A69 HydrophobicContact CB-CB 4.22Å; E40-A69 PolarHBondContact OE2-N 3.2Å
41	I	90.5	Very high	91.1	Very high	22 Å²	22	73 Å²	73	11%	0.113	41%	0.408	C	S	.	.	S	Bend	trans	-83	131.1	176.5	-63.1	169.9	0	0	0	109.1	I37 D43 L48 A69	I37-I41 HydrophobicContact CG2-CD1 3.59Å; I37-I41 HydrophobicContact CG2-CG1 4.3Å; I37-I41 WeakPolarHBondContact O-CG1 3.18Å; I37-I41 PolarHBondContact O-N 3.25Å; I37-I41 VanDerWaalsContact O-N 3.09Å; I41-D43 VanDerWaalsContact CG2-O 3.25Å; I41-D43 WeakPolarHBondContact CG2-O 3.47Å; I41-L48 HydrophobicContact CD1-CD2 3.77Å; I41-L48 HydrophobicContact CD1-CG 4.41Å; I41-A69 HydrophobicContact CG1-CB 4.18Å; I41-A69 WeakPolarHBondContact CG1-O 3.18Å
42	E	82.3	Confident	90.8	Very high	76 Å²	76	72 Å²	72	36%	0.355	40%	0.402	S	S	.	.	S	Bend	trans	-66.9	-41.4	-179.1	-66.1	178.1	166.5	0	0	112.5	S71 N72 L85 L86	E42-S71 PolarHBondContact OE2-OG 2.88Å; E42-N72 PolarHBondContact OE1-ND2 3.26Å; E42-L85 WeakPolarHBondContact OE1-CA 3.32Å; E42-L85 WeakPolarHBondContact OE1-CD2 3.08Å; E42-L86 PolarHBondContact OE1-N 2.78Å
43	D	84.3	Confident	90.5	Very high	75 Å²	75	78 Å²	78	40%	0.401	43%	0.425	S	S	.	.			trans	-119.2	100.1	174	-173.9	-8	0	0	0	111	I41 S45 E46	I41-D43 VanDerWaalsContact CG2-O 3.25Å; I41-D43 WeakPolarHBondContact CG2-O 3.47Å; D43-S45 PolarHBondContact O-N 2.83Å; D43-S45 WeakPolarHBondContact OD1-CA 3.36Å; D43-S45 WeakPolarHBondContact OD1-CB 3.24Å; D43-S45 PolarHBondContact OD1-N 3.47Å; D43-S45 PolarHBondContact OD1-OG 2.88Å; D43-S45 PolarHBondContact OD2-OG 2.9Å; D43-S45 VanDerWaalsContact OD2-OG 3.11Å; D43-E46 HydrophobicContact CB-CG 4.11Å; D43-E46 WeakPolarHBondContact O-CB 3.3Å; D43-E46 PolarHBondContact O-N 2.83Å
44	A	80.9	Confident	90.1	Very high	73 Å²	73	79.3 Å²	79.3	60%	0.603	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-6.7	179.3	0	0	0	0	0	114.2
45	S	84.9	Confident	89.8	Confident	95 Å²	95	79.3 Å²	79.3	66%	0.664	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-18.8	171.1	79.2	0	0	0	0	112.9	D43	D43-S45 PolarHBondContact O-N 2.83Å; D43-S45 WeakPolarHBondContact OD1-CA 3.36Å; D43-S45 WeakPolarHBondContact OD1-CB 3.24Å; D43-S45 PolarHBondContact OD1-N 3.47Å; D43-S45 PolarHBondContact OD1-OG 2.88Å; D43-S45 PolarHBondContact OD2-OG 2.9Å; D43-S45 VanDerWaalsContact OD2-OG 3.11Å
46	E	84.9	Confident	89.7	Confident	119 Å²	119	75.7 Å²	75.7	56%	0.556	43%	0.428	S	S	*	.	S	Bend	trans	-74.2	125.9	175.9	-70.8	-162.4	159.7	0	0	111.4	D43	D43-E46 HydrophobicContact CB-CG 4.11Å; D43-E46 WeakPolarHBondContact O-CB 3.3Å; D43-E46 PolarHBondContact O-N 2.83Å
47	P	91.3	Very high	89.6	Confident	72 Å²	72	72.9 Å²	72.9	47%	0.468	42%	0.415	S	S	.	.			trans	-76.3	142.9	179.7	32	-34.3	0	0	0	111.2	I49	P47-I49 WeakPolarHBondContact CB-O 3.49Å; P47-I49 PolarHBondContact O-N 3.19Å
48	L	93.1	Very high	89.6	Confident	34 Å²	34	74.9 Å²	74.9	18%	0.178	43%	0.425	C	S	.	.	S	Bend	trans	-64	-23.2	173.5	-71.9	-179.5	0	0	0	113.6	L29 I37 I41 S57 L60	L29-L48 HydrophobicContact CD2-CD1 3.61Å; I37-L48 HydrophobicContact CG2-CD1 4.31Å; I41-L48 HydrophobicContact CD1-CD2 3.77Å; I41-L48 HydrophobicContact CD1-CG 4.41Å; L48-S57 PolarHBondContact O-N 2.87Å; L48-S57 PolarHBondContact O-OG 3.3Å; L48-L60 HydrophobicContact CB-CB 4.28Å; L48-L60 HydrophobicContact CD2-CB 4.17Å; L48-L60 WeakPolarHBondContact O-CD2 3.42Å
49	I	93.3	Very high	89.8	Confident	70 Å²	70	70.5 Å²	70.5	36%	0.359	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-127.1	125	175.3	-61.4	176.6	0	0	0	107.2	L25 P47 H55 L60	L25-I49 HydrophobicContact CD2-CD1 3.63Å; P47-I49 WeakPolarHBondContact CB-O 3.49Å; P47-I49 PolarHBondContact O-N 3.19Å; I49-H55 CarbonylContact C-O 3.53Å; I49-H55 WeakPolarHBondContact CA-O 3.4Å; I49-L60 HydrophobicContact CG1-CD2 3.92Å
50	D	90.8	Very high	89.9	Confident	56 Å²	56	65.3 Å²	65.3	30%	0.299	38%	0.379	S	S	.	.			trans	-56.5	125.3	176.2	-177.6	-82.7	0	0	0	110.4	V52 Y53 G54 H55	D50-V52 PolarHBondContact O-N 3.34Å; D50-V52 WeakPolarHBondContact OD1-CA 3.36Å; D50-V52 WeakPolarHBondContact OD1-CB 3.45Å; D50-V52 PolarHBondContact OD1-N 3.38Å; D50-Y53 WeakPolarHBondContact OD1-CD2 3.21Å; D50-Y53 PolarHBondContact OD1-N 2.91Å; D50-G54 WeakPolarHBondContact O-CA 3.32Å; D50-G54 PolarHBondContact O-N 2.93Å; D50-H55 HydrophobicContact CB-CB 4.26Å; D50-H55 PolarHBondContact N-O 2.7Å
51	P	90.6	Very high	90.1	Very high	110 Å²	110	64.8 Å²	64.8	71%	0.714	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-14.8	-173	28.5	-34.5	0	0	0	113.5
52	V	91.1	Very high	90.4	Very high	108 Å²	108	63.8 Å²	63.8	66%	0.655	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-48.8	-176.1	-178.6	0	0	0	0	110.7	D50	D50-V52 PolarHBondContact O-N 3.34Å; D50-V52 WeakPolarHBondContact OD1-CA 3.36Å; D50-V52 WeakPolarHBondContact OD1-CB 3.45Å; D50-V52 PolarHBondContact OD1-N 3.38Å
53	Y	89.4	Confident	91.1	Very high	172 Å²	172	60.4 Å²	60.4	68%	0.675	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-13.7	-171.6	-55.4	-70.6	0	0	0	113.3	D50 H55	D50-Y53 WeakPolarHBondContact OD1-CD2 3.21Å; D50-Y53 PolarHBondContact OD1-N 2.91Å; Y53-H55 VanDerWaalsContact C-N 3.31Å; Y53-H55 WeakPolarHBondContact CB-CD2 3.49Å; Y53-H55 WeakPolarHBondContact CB-NE2 3.45Å; Y53-H55 PolarHBondContact O-N 2.85Å
54	G	88.3	Confident	91.6	Very high	48 Å²	48	61.2 Å²	61.2	50%	0.495	36%	0.359	S	S	.	.			trans	75.7	15.6	177.2	0	0	0	0	0	114.6	D50	D50-G54 WeakPolarHBondContact O-CA 3.32Å; D50-G54 PolarHBondContact O-N 2.93Å
55	H	89.8	Confident	92.3	Very high	79 Å²	79	59.2 Å²	59.2	37%	0.366	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-72.6	138.8	177.5	-60.5	-51.1	0	0	0	111.2	I49 D50 Y53 T126	I49-H55 CarbonylContact C-O 3.53Å; I49-H55 WeakPolarHBondContact CA-O 3.4Å; D50-H55 HydrophobicContact CB-CB 4.26Å; D50-H55 PolarHBondContact N-O 2.7Å; Y53-H55 VanDerWaalsContact C-N 3.31Å; Y53-H55 WeakPolarHBondContact CB-CD2 3.49Å; Y53-H55 WeakPolarHBondContact CB-NE2 3.45Å; Y53-H55 PolarHBondContact O-N 2.85Å; H55-T126 PolarHBondContact CE1-O 2.9Å
56	G	91.3	Very high	92.8	Very high	36 Å²	36	55.3 Å²	55.3	37%	0.371	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-71	134.8	170.5	0	0	0	0	0	110.7
57	S	93.4	Very high	93.3	Very high	28 Å²	28	51.2 Å²	51.2	20%	0.196	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-68.4	164.7	174.5	74.5	0	0	0	0	111.6	L48 S59 L60 I61	L48-S57 PolarHBondContact O-N 2.87Å; L48-S57 PolarHBondContact O-OG 3.3Å; S57-S59 PolarHBondContact O-N 3.04Å; S57-L60 WeakPolarHBondContact O-CB 3.2Å; S57-L60 PolarHBondContact O-N 2.96Å; S57-L60 PolarHBondContact OG-N 2.89Å; S57-I61 WeakPolarHBondContact O-CG1 3.24Å; S57-I61 PolarHBondContact O-N 3.14Å
58	Q	94.4	Very high	93.5	Very high	51 Å²	51	50.9 Å²	50.9	24%	0.238	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-36.6	175.5	-170.6	60.9	53.5	0	0	111.7	L60 I61 N62 S71 V73 F96	Q58-L60 VanDerWaalsContact C-N 3.32Å; Q58-L60 PolarHBondContact O-N 3.35Å; Q58-I61 PolarHBondContact O-N 2.72Å; Q58-N62 PolarHBondContact NE2-OD1 2.93Å; Q58-N62 WeakPolarHBondContact O-CB 3.42Å; Q58-N62 PolarHBondContact O-N 2.77Å; Q58-S71 WeakPolarHBondContact CG-O 3.29Å; Q58-V73 HydrophobicContact CG-CG1 3.84Å; Q58-F96 VanDerWaalsContact OE1-CZ 3.25Å
59	S	95.7	Very high	93.6	Very high	5 Å²	5	49.2 Å²	49.2	4%	0.035	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-40.8	172.1	-70.4	0	0	0	0	112.8	S57 L63 A69 V70 S71	S57-S59 PolarHBondContact O-N 3.04Å; S59-L63 VanDerWaalsContact O-CB 3.29Å; S59-L63 WeakPolarHBondContact O-CB 3.4Å; S59-L63 PolarHBondContact O-N 3.19Å; S59-A69 WeakPolarHBondContact CB-O 3.41Å; S59-A69 PolarHBondContact OG-O 3Å; S59-V70 WeakPolarHBondContact CA-O 3.27Å; S59-S71 WeakPolarHBondContact OG-CA 3.34Å; S59-S71 PolarHBondContact OG-N 3.09Å
60	L	95.6	Very high	93.7	Very high	13 Å²	13	46.1 Å²	46.1	7%	0.068	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-41.3	175.8	179.3	56	0	0	0	111.6	L25 L48 I49 S57 Q58 L63 L64	L25-L60 HydrophobicContact CD1-CD1 3.48Å; L25-L60 VanDerWaalsContact CD1-CD1 3.48Å; L25-L60 HydrophobicContact CD1-CD2 4.4Å; L48-L60 HydrophobicContact CB-CB 4.28Å; L48-L60 HydrophobicContact CD2-CB 4.17Å; L48-L60 WeakPolarHBondContact O-CD2 3.42Å; I49-L60 HydrophobicContact CG1-CD2 3.92Å; S57-L60 WeakPolarHBondContact O-CB 3.2Å; S57-L60 PolarHBondContact O-N 2.96Å; S57-L60 PolarHBondContact OG-N 2.89Å; Q58-L60 VanDerWaalsContact C-N 3.32Å; Q58-L60 PolarHBondContact O-N 3.35Å; L60-L63 PolarHBondContact O-N 2.74Å; L60-L64 HydrophobicContact CD1-CD1 4.35Å; L60-L64 HydrophobicContact CD1-CG 4.41Å; L60-L64 HydrophobicContact CG-CD1 4.36Å; L60-L64 WeakPolarHBondContact O-CG 3.42Å; L60-L64 PolarHBondContact O-N 2.76Å; L60-L64 VanDerWaalsContact O-N 3.11Å
61	I	95.6	Very high	93.8	Very high	19 Å²	19	44.8 Å²	44.8	10%	0.097	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-49.9	176.7	-65.8	167.3	0	0	0	109.9	S57 Q58 L63 L64 L65 F96 L128	S57-I61 WeakPolarHBondContact O-CG1 3.24Å; S57-I61 PolarHBondContact O-N 3.14Å; Q58-I61 PolarHBondContact O-N 2.72Å; I61-L63 VanDerWaalsContact C-N 3.34Å; I61-L63 PolarHBondContact O-N 3.11Å; I61-L64 PolarHBondContact O-N 3.2Å; I61-L64 VanDerWaalsContact O-N 3.17Å; I61-L65 HydrophobicContact CG2-CD1 3.77Å; I61-L65 HydrophobicContact CG2-CG 4.35Å; I61-L65 WeakPolarHBondContact O-CG 3.22Å; I61-L65 PolarHBondContact O-N 3.31Å; I61-F96 HydrophobicContact CD1-CE2 4.37Å; I61-F96 HydrophobicContact CG2-CD2 3.92Å; I61-F96 HydrophobicContact CG2-CE2 3.97Å; I61-L128 HydrophobicContact CD1-CD1 3.97Å; I61-L128 HydrophobicContact CD1-CD2 4.04Å; I61-L128 HydrophobicContact CG1-CD1 4.23Å
62	N	96.8	Very high	94	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-40.9	178.8	-73.9	-9.9	0	0	0	111.5	Q58 L64 L65 T66 H68 V70 N72 I88	Q58-N62 PolarHBondContact NE2-OD1 2.93Å; Q58-N62 WeakPolarHBondContact O-CB 3.42Å; Q58-N62 PolarHBondContact O-N 2.77Å; N62-L64 VanDerWaalsContact C-N 3.26Å; N62-L64 PolarHBondContact O-N 2.85Å; N62-L65 PolarHBondContact O-N 3.37Å; N62-L65 VanDerWaalsContact O-N 3.09Å; N62-T66 PolarHBondContact O-N 3.13Å; N62-T66 PolarHBondContact O-OG1 2.66Å; N62-H68 CarbonylContact C-O 3.58Å; N62-H68 WeakPolarHBondContact CB-O 3.21Å; N62-V70 WeakPolarHBondContact CB-O 3.19Å; N62-V70 PolarHBondContact ND2-O 3.03Å; N62-N72 PolarHBondContact ND2-O 2.8Å; N62-I88 HydrophobicContact CB-CD1 4.48Å
63	L	96.8	Very high	94.3	Very high	6 Å²	6	36 Å²	36	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-57.4	-41	175.3	178.2	60.3	0	0	0	111.9	V28 L29 K32 I37 S59 L60 I61 G67 H68 A69	V28-L63 HydrophobicContact CG1-CD2 4.09Å; V28-L63 HydrophobicContact CG1-CG 4Å; L29-L63 HydrophobicContact CD2-CD2 3.84Å; K32-L63 HydrophobicContact CB-CD1 4.19Å; K32-L63 HydrophobicContact CD-CD1 4.29Å; K32-L63 HydrophobicContact CG-CD1 3.92Å; I37-L63 HydrophobicContact CD1-CD2 3.85Å; I37-L63 HydrophobicContact CG1-CD2 4.32Å; S59-L63 VanDerWaalsContact O-CB 3.29Å; S59-L63 WeakPolarHBondContact O-CB 3.4Å; S59-L63 PolarHBondContact O-N 3.19Å; L60-L63 PolarHBondContact O-N 2.74Å; I61-L63 VanDerWaalsContact C-N 3.34Å; I61-L63 PolarHBondContact O-N 3.11Å; L63-G67 WeakPolarHBondContact O-CA 3.35Å; L63-G67 PolarHBondContact O-N 2.86Å; L63-H68 WeakPolarHBondContact CA-O 3.16Å; L63-H68 PolarHBondContact N-O 2.79Å; L63-H68 VanDerWaalsContact N-O 3.08Å; L63-A69 HydrophobicContact CB-CB 4.2Å; L63-A69 HydrophobicContact CD1-CB 4.48Å
64	L	95.8	Very high	94.5	Very high	91 Å²	91	29.5 Å²	29.5	48%	0.476	18%	0.181	S	C	.	.	H	α-helix	trans	-72.4	-31.5	177.9	-69	169.2	0	0	0	113	F24 V28 L60 I61 N62	F24-L64 HydrophobicContact CE1-CD2 4.16Å; V28-L64 HydrophobicContact CG1-CD2 4.26Å; V28-L64 HydrophobicContact CG2-CD2 4.1Å; L60-L64 HydrophobicContact CD1-CD1 4.35Å; L60-L64 HydrophobicContact CD1-CG 4.41Å; L60-L64 HydrophobicContact CG-CD1 4.36Å; L60-L64 WeakPolarHBondContact O-CG 3.42Å; L60-L64 PolarHBondContact O-N 2.76Å; L60-L64 VanDerWaalsContact O-N 3.11Å; I61-L64 PolarHBondContact O-N 3.2Å; I61-L64 VanDerWaalsContact O-N 3.17Å; N62-L64 VanDerWaalsContact C-N 3.26Å; N62-L64 PolarHBondContact O-N 2.85Å
65	L	95.6	Very high	94.7	Very high	32 Å²	32	28.5 Å²	28.5	17%	0.168	16%	0.164	C	C	.	.	H	α-helix	trans	-85.1	-37.2	-177.3	-69.9	179.1	0	0	0	113.6	I61 N62 V94 F96 I121	I61-L65 HydrophobicContact CG2-CD1 3.77Å; I61-L65 HydrophobicContact CG2-CG 4.35Å; I61-L65 WeakPolarHBondContact O-CG 3.22Å; I61-L65 PolarHBondContact O-N 3.31Å; N62-L65 PolarHBondContact O-N 3.37Å; N62-L65 VanDerWaalsContact O-N 3.09Å; L65-V94 HydrophobicContact CD2-CB 3.92Å; L65-V94 HydrophobicContact CD2-CG1 3.81Å; L65-F96 HydrophobicContact CD1-CB 3.79Å; L65-F96 HydrophobicContact CD1-CD2 4.35Å; L65-F96 HydrophobicContact CD1-CG 4.41Å; L65-I121 HydrophobicContact CD2-CG1 4.09Å
66	T	95.3	Very high	94.8	Very high	13 Å²	13	25.9 Å²	25.9	8%	0.08	16%	0.158	C	C	.	.	H	α-helix	trans	-127.1	-9.8	-168.2	72.6	0	0	0	0	113.2	N62 H68 I88 A92 L112	N62-T66 PolarHBondContact O-N 3.13Å; N62-T66 PolarHBondContact O-OG1 2.66Å; T66-H68 PolarHBondContact O-CD2 3.16Å; T66-H68 PolarHBondContact O-N 3.39Å; T66-H68 PolarHBondContact OG1-N 3.41Å; T66-I88 HydrophobicContact CG2-CD1 4.3Å; T66-I88 HydrophobicContact CG2-CG2 4.38Å; T66-A92 HydrophobicContact CG2-CB 4.07Å; T66-L112 HydrophobicContact CG2-CD2 4.12Å
67	G	95.1	Very high	94.8	Very high	32 Å²	32	26.6 Å²	26.6	33%	0.33	15%	0.154	S	C	.	.	S	Bend	trans	75.5	6.9	-171.9	0	0	0	0	0	114	K32 L63	K32-G67 WeakPolarHBondContact CD-O 3.02Å; K32-G67 VanDerWaalsContact CE-O 3.27Å; K32-G67 WeakPolarHBondContact CE-O 2.96Å; K32-G67 PolarHBondContact NZ-O 2.77Å; L63-G67 WeakPolarHBondContact O-CA 3.35Å; L63-G67 PolarHBondContact O-N 2.86Å
68	H	95.4	Very high	94.5	Very high	65 Å²	65	28.8 Å²	28.8	30%	0.301	16%	0.158	S	C	.	.			trans	-121.3	129.8	177.3	-67.6	-82.9	0	0	0	111.4	E40 N62 L63 T66 V70	E40-H68 IonicContact OE1-CE1 3.24Å; E40-H68 IonicContact OE1-CG 3.63Å; E40-H68 IonicContact OE1-ND1 3.1Å; E40-H68 PolarHBondContact OE1-ND1 2.94Å; E40-H68 WeakPolarHBondContact OE2-CA 3.27Å; N62-H68 CarbonylContact C-O 3.58Å; N62-H68 WeakPolarHBondContact CB-O 3.21Å; L63-H68 WeakPolarHBondContact CA-O 3.16Å; L63-H68 PolarHBondContact N-O 2.79Å; L63-H68 VanDerWaalsContact N-O 3.08Å; T66-H68 PolarHBondContact O-CD2 3.16Å; T66-H68 PolarHBondContact O-N 3.39Å; T66-H68 PolarHBondContact OG1-N 3.41Å; H68-V70 VanDerWaalsContact C-N 3.27Å; H68-V70 PolarHBondContact O-N 2.95Å
69	A	95.9	Very high	94.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.176	C	C	.	.			trans	-88.6	24.5	-173.2	0	0	0	0	0	114.4	I37 E40 I41 S59 L63	I37-A69 HydrophobicContact CB-CB 4.49Å; I37-A69 HydrophobicContact CG1-CB 4.49Å; I37-A69 HydrophobicContact CG2-CB 3.93Å; E40-A69 HydrophobicContact CB-CB 4.22Å; E40-A69 PolarHBondContact OE2-N 3.2Å; I41-A69 HydrophobicContact CG1-CB 4.18Å; I41-A69 WeakPolarHBondContact CG1-O 3.18Å; S59-A69 WeakPolarHBondContact CB-O 3.41Å; S59-A69 PolarHBondContact OG-O 3Å; L63-A69 HydrophobicContact CB-CB 4.2Å; L63-A69 HydrophobicContact CD1-CB 4.48Å
70	V	95.4	Very high	93.4	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.03	20%	0.197	C	C	.	.			trans	-63.1	143.9	175.9	-59.9	0	0	0	0	110.7	S59 N62 H68 L86 I88	S59-V70 WeakPolarHBondContact CA-O 3.27Å; N62-V70 WeakPolarHBondContact CB-O 3.19Å; N62-V70 PolarHBondContact ND2-O 3.03Å; H68-V70 VanDerWaalsContact C-N 3.27Å; H68-V70 PolarHBondContact O-N 2.95Å; V70-L86 HydrophobicContact CB-CB 4.37Å; V70-L86 HydrophobicContact CG1-CB 3.64Å; V70-L86 HydrophobicContact CG1-CD1 4.41Å; V70-I88 HydrophobicContact CG2-CD1 3.64Å
71	S	93.6	Very high	92.7	Very high	28 Å²	28	41.7 Å²	41.7	20%	0.196	24%	0.239	C	C	.	.	S	Bend	trans	-77.5	-23.2	178.8	47.9	0	0	0	0	112.8	E42 Q58 S59	E42-S71 PolarHBondContact OE2-OG 2.88Å; Q58-S71 WeakPolarHBondContact CG-O 3.29Å; S59-S71 WeakPolarHBondContact OG-CA 3.34Å; S59-S71 PolarHBondContact OG-N 3.09Å
72	N	94.9	Very high	92	Very high	21 Å²	21	43.9 Å²	43.9	11%	0.112	27%	0.266	C	S	.	.			trans	-90.3	154.5	-170.3	-57.3	-51.1	0	0	0	113	E42 N62 W74 L86	E42-N72 PolarHBondContact OE1-ND2 3.26Å; N62-N72 PolarHBondContact ND2-O 2.8Å; N72-W74 HydrophobicContact CB-CD2 3.76Å; N72-W74 HydrophobicContact CB-CE3 3.77Å; N72-W74 HydrophobicContact CB-CH2 3.49Å; N72-W74 VanDerWaalsContact CB-CH2 3.49Å; N72-W74 HydrophobicContact CB-CZ2 3.42Å; N72-W74 VanDerWaalsContact CB-CZ2 3.42Å; N72-W74 HydrophobicContact CB-CZ3 3.63Å; N72-W74 VanDerWaalsContact ND2-CZ2 3.32Å; N72-W74 WeakPolarHBondContact ND2-CZ2 3.38Å; N72-W74 WeakPolarHBondContact OD1-CH2 3.19Å; N72-W74 WeakPolarHBondContact OD1-CZ3 3.25Å; N72-L86 WeakPolarHBondContact CB-O 3.41Å; N72-L86 PolarHBondContact ND2-O 2.85Å
73	V	95.8	Very high	91.4	Very high	11 Å²	11	48.8 Å²	48.8	7%	0.067	29%	0.291	C	S	.	.			trans	-114.4	5.2	-174.1	-64.9	0	0	0	0	113.7	Q58 F96 V108 G109 L112	Q58-V73 HydrophobicContact CG-CG1 3.84Å; V73-F96 HydrophobicContact CG1-CD1 4.05Å; V73-F96 HydrophobicContact CG1-CE1 4.05Å; V73-V108 HydrophobicContact CB-CG1 4.4Å; V73-V108 HydrophobicContact CB-CG2 4.41Å; V73-V108 HydrophobicContact CG2-CG2 3.99Å; V73-V108 CarbonylContact O-C 3.56Å; V73-V108 WeakPolarHBondContact O-CA 3.38Å; V73-G109 PolarHBondContact O-N 3.45Å; V73-L112 HydrophobicContact CB-CD1 4Å; V73-L112 HydrophobicContact CG1-CD1 4.25Å
74	W	94.1	Very high	90.9	Very high	37 Å²	37	54.8 Å²	54.8	14%	0.14	32%	0.316	C	S	.	.	S	Bend	trans	-91.3	166.1	175	58.5	76.5	0	0	0	112	N72 G76 R78 L85 I88	N72-W74 HydrophobicContact CB-CD2 3.76Å; N72-W74 HydrophobicContact CB-CE3 3.77Å; N72-W74 HydrophobicContact CB-CH2 3.49Å; N72-W74 VanDerWaalsContact CB-CH2 3.49Å; N72-W74 HydrophobicContact CB-CZ2 3.42Å; N72-W74 VanDerWaalsContact CB-CZ2 3.42Å; N72-W74 HydrophobicContact CB-CZ3 3.63Å; N72-W74 VanDerWaalsContact ND2-CZ2 3.32Å; N72-W74 WeakPolarHBondContact ND2-CZ2 3.38Å; N72-W74 WeakPolarHBondContact OD1-CH2 3.19Å; N72-W74 WeakPolarHBondContact OD1-CZ3 3.25Å; W74-G76 PolarHBondContact NE1-O 3.16Å; W74-R78 VanDerWaalsContact CD1-NE 3.26Å; W74-L85 HydrophobicContact CH2-CD1 4.43Å; W74-L85 HydrophobicContact CZ2-CB 3.94Å; W74-L85 HydrophobicContact CZ2-CD1 4.28Å; W74-I88 PolarHBondContact O-N 3.06Å
75	D	92.6	Very high	90.6	Very high	27 Å²	27	52 Å²	52	14%	0.144	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-81.6	137.5	177.1	-45.6	-46.2	0	0	0	111.1	I88 G109 S110 Y111 R150	D75-I88 CarbonylContact C-O 3.54Å; D75-I88 WeakPolarHBondContact CA-O 3.44Å; D75-G109 VanDerWaalsContact CG-CA 3.44Å; D75-G109 VanDerWaalsContact OD1-C 3.23Å; D75-G109 WeakPolarHBondContact OD1-CA 3.28Å; D75-G109 VanDerWaalsContact OD2-CA 3.27Å; D75-G109 WeakPolarHBondContact OD2-CA 3.33Å; D75-S110 VanDerWaalsContact CG-N 3.29Å; D75-S110 PolarHBondContact OD1-N 2.62Å; D75-S110 VanDerWaalsContact OD1-N 3.11Å; D75-S110 PolarHBondContact OD2-N 2.95Å; D75-S110 PolarHBondContact OD2-OG 2.99Å; D75-Y111 HydrophobicContact CB-CD2 3.83Å; D75-Y111 HydrophobicContact CB-CE2 3.94Å; D75-Y111 HydrophobicContact CB-CG 4.35Å; D75-Y111 WeakPolarHBondContact OD1-CB 3.45Å; D75-Y111 WeakPolarHBondContact OD1-CD2 3.37Å; D75-Y111 VanDerWaalsContact OD1-CG 3.23Å; D75-Y111 PolarHBondContact OD1-N 3.4Å; D75-R150 HydrophobicContact CB-CG 4.36Å
76	G	91.4	Very high	90.5	Very high	23 Å²	23	52.6 Å²	52.6	24%	0.237	31%	0.305	C	S	.	.	S	Bend	trans	68.6	165.9	175.5	0	0	0	0	0	114.5	W74 G87 I88	W74-G76 PolarHBondContact NE1-O 3.16Å; G76-G87 VanDerWaalsContact O-CA 3.31Å; G76-G87 WeakPolarHBondContact O-CA 2.88Å; G76-I88 PolarHBondContact N-O 3.47Å
77	D	91.8	Very high	90.5	Very high	52 Å²	52	52 Å²	52	28%	0.278	30%	0.301	S	S	.	.			trans	-72.1	147.6	174.2	-63.7	-21	0	0	0	110.9	K84 L85 L86 G87 H89	D77-K84 HydrophobicContact CB-CG 4.5Å; D77-K84 WeakPolarHBondContact OD2-CE 3.27Å; D77-K84 IonicContact OD2-NZ 3.99Å; D77-K84 PolarHBondContact OD2-NZ 3.21Å; D77-L85 CarbonylContact C-O 3.53Å; D77-L85 WeakPolarHBondContact CA-O 3.42Å; D77-L86 VanDerWaalsContact OD1-CA 3.24Å; D77-L86 WeakPolarHBondContact OD1-CA 3.33Å; D77-L86 WeakPolarHBondContact OD1-CD2 3.24Å; D77-G87 PolarHBondContact OD1-N 3.29Å; D77-G87 VanDerWaalsContact OD1-N 3.09Å; D77-H89 IonicContact OD1-CE1 3.16Å; D77-H89 PolarHBondContact OD1-CE1 3.43Å; D77-H89 IonicContact OD1-NE2 3.38Å; D77-H89 PolarHBondContact OD1-NE2 2.87Å; D77-H89 VanDerWaalsContact OD1-NE2 3.16Å; D77-H89 IonicContact OD2-NE2 3.01Å
78	R	87.4	Confident	90.5	Very high	74 Å²	74	50.6 Å²	50.6	28%	0.279	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	150.1	173.7	-66.5	-177.8	-175.1	-160.4	-5.2	110	W74 L85	W74-R78 VanDerWaalsContact CD1-NE 3.26Å; R78-L85 PolarHBondContact N-O 2.9Å; R78-L85 PolarHBondContact O-N 2.83Å
79	E	85.7	Confident	90.4	Very high	134 Å²	134	52.2 Å²	52.2	63%	0.626	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.8	171.7	-168.6	172.9	165.7	0	0	109.1	M83	E79-M83 WeakPolarHBondContact CA-O 3.38Å
80	C	79.9	Confident	90.2	Very high	71 Å²	71	57 Å²	57	48%	0.48	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	111.6	179.6	-178.8	0	0	0	0	108.9	G82 M83 L85	C80-G82 PolarHBondContact O-N 3.21Å; C80-M83 PolarHBondContact N-O 2.78Å; C80-M83 WeakPolarHBondContact O-CB 3.31Å; C80-M83 PolarHBondContact O-N 2.7Å; C80-L85 HydrophobicContact CB-CD1 3.97Å
81	S	81.2	Confident	90.1	Very high	134 Å²	134	59.3 Å²	59.3	94%	0.937	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	37.5	178.2	-58.2	0	0	0	0	114.1	M83	S81-M83 VanDerWaalsContact C-N 3.29Å; S81-M83 PolarHBondContact O-N 2.69Å
82	G	82	Confident	90.1	Very high	66 Å²	66	58 Å²	58	68%	0.68	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	3.5	-177.5	0	0	0	0	0	114.9	C80	C80-G82 PolarHBondContact O-N 3.21Å
83	M	83.4	Confident	90.1	Very high	103 Å²	103	59 Å²	59	51%	0.507	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.5	169.8	-173.9	172.8	177.4	0	0	109.9	E79 C80 S81 L85	E79-M83 WeakPolarHBondContact CA-O 3.38Å; C80-M83 PolarHBondContact N-O 2.78Å; C80-M83 WeakPolarHBondContact O-CB 3.31Å; C80-M83 PolarHBondContact O-N 2.7Å; S81-M83 VanDerWaalsContact C-N 3.29Å; S81-M83 PolarHBondContact O-N 2.69Å; M83-L85 HydrophobicContact CE-CD2 3.83Å; M83-L85 HydrophobicContact CG-CD2 3.95Å; M83-L85 HydrophobicContact SD-CD2 3.94Å
84	K	87.3	Confident	90.1	Very high	132 Å²	132	60.5 Å²	60.5	57%	0.574	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	116	173.4	-169.1	-178.8	-177	-160.5	0	109.4	D77 L86	D77-K84 HydrophobicContact CB-CG 4.5Å; D77-K84 WeakPolarHBondContact OD2-CE 3.27Å; D77-K84 IonicContact OD2-NZ 3.99Å; D77-K84 PolarHBondContact OD2-NZ 3.21Å; K84-L86 HydrophobicContact CD-CD2 4.39Å; K84-L86 HydrophobicContact CG-CD2 4.47Å
85	L	89.6	Confident	90.3	Very high	32 Å²	32	58.8 Å²	58.8	17%	0.168	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.1	177.2	-55.5	177.7	0	0	0	109.1	E42 W74 D77 R78 C80 M83	E42-L85 WeakPolarHBondContact OE1-CA 3.32Å; E42-L85 WeakPolarHBondContact OE1-CD2 3.08Å; W74-L85 HydrophobicContact CH2-CD1 4.43Å; W74-L85 HydrophobicContact CZ2-CB 3.94Å; W74-L85 HydrophobicContact CZ2-CD1 4.28Å; D77-L85 CarbonylContact C-O 3.53Å; D77-L85 WeakPolarHBondContact CA-O 3.42Å; R78-L85 PolarHBondContact N-O 2.9Å; R78-L85 PolarHBondContact O-N 2.83Å; C80-L85 HydrophobicContact CB-CD1 3.97Å; M83-L85 HydrophobicContact CE-CD2 3.83Å; M83-L85 HydrophobicContact CG-CD2 3.95Å; M83-L85 HydrophobicContact SD-CD2 3.94Å
86	L	92.9	Very high	90.5	Very high	44 Å²	44	57.6 Å²	57.6	23%	0.23	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-84.5	134.3	-173.1	-60	-178.1	0	0	0	111.4	E42 V70 N72 D77 K84	E42-L86 PolarHBondContact OE1-N 2.78Å; V70-L86 HydrophobicContact CB-CB 4.37Å; V70-L86 HydrophobicContact CG1-CB 3.64Å; V70-L86 HydrophobicContact CG1-CD1 4.41Å; N72-L86 WeakPolarHBondContact CB-O 3.41Å; N72-L86 PolarHBondContact ND2-O 2.85Å; D77-L86 VanDerWaalsContact OD1-CA 3.24Å; D77-L86 WeakPolarHBondContact OD1-CA 3.33Å; D77-L86 WeakPolarHBondContact OD1-CD2 3.24Å; K84-L86 HydrophobicContact CD-CD2 4.39Å; K84-L86 HydrophobicContact CG-CD2 4.47Å
87	G	94.6	Very high	90.8	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.01	33%	0.326	C	S	.	.			trans	-115.1	-167.1	178.6	0	0	0	0	0	114.5	G76 D77 H89	G76-G87 VanDerWaalsContact O-CA 3.31Å; G76-G87 WeakPolarHBondContact O-CA 2.88Å; D77-G87 PolarHBondContact OD1-N 3.29Å; D77-G87 VanDerWaalsContact OD1-N 3.09Å; G87-H89 PolarHBondContact O-CE1 2.85Å; G87-H89 PolarHBondContact O-ND1 2.9Å
88	I	95.8	Very high	91	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.015	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-85.3	131.7	176.3	-54.2	-64.8	0	0	0	109.2	N62 T66 V70 W74 D75 G76 E90 Y111 L112	N62-I88 HydrophobicContact CB-CD1 4.48Å; T66-I88 HydrophobicContact CG2-CD1 4.3Å; T66-I88 HydrophobicContact CG2-CG2 4.38Å; V70-I88 HydrophobicContact CG2-CD1 3.64Å; W74-I88 PolarHBondContact O-N 3.06Å; D75-I88 CarbonylContact C-O 3.54Å; D75-I88 WeakPolarHBondContact CA-O 3.44Å; G76-I88 PolarHBondContact N-O 3.47Å; I88-E90 WeakPolarHBondContact CG2-O 3.27Å; I88-Y111 HydrophobicContact CB-CD2 4.46Å; I88-Y111 HydrophobicContact CG2-CD2 4.12Å; I88-Y111 HydrophobicContact CG2-CG 4.5Å; I88-Y111 VanDerWaalsContact O-CD2 3.24Å; I88-Y111 WeakPolarHBondContact O-CD2 3.18Å; I88-Y111 WeakPolarHBondContact O-CE2 3.43Å; I88-L112 HydrophobicContact CD1-CD1 4.24Å; I88-L112 HydrophobicContact CG1-CD1 3.82Å; I88-L112 HydrophobicContact CG1-CG 4.08Å; I88-L112 HydrophobicContact CG2-CG 4.44Å
89	H	93	Very high	91.4	Very high	99 Å²	99	57.5 Å²	57.5	46%	0.458	33%	0.325	S	S	.	.			trans	-106.5	-13.7	-171.8	-69.3	85	0	0	0	114.3	D77 G87 Y111	D77-H89 IonicContact OD1-CE1 3.16Å; D77-H89 PolarHBondContact OD1-CE1 3.43Å; D77-H89 IonicContact OD1-NE2 3.38Å; D77-H89 PolarHBondContact OD1-NE2 2.87Å; D77-H89 VanDerWaalsContact OD1-NE2 3.16Å; D77-H89 IonicContact OD2-NE2 3.01Å; G87-H89 PolarHBondContact O-CE1 2.85Å; G87-H89 PolarHBondContact O-ND1 2.9Å; H89-Y111 VanDerWaalsContact C-CE2 3.42Å; H89-Y111 WeakPolarHBondContact O-CE2 3.45Å
90	E	91.7	Very high	91.9	Very high	99 Å²	99	53.2 Å²	53.2	46%	0.463	31%	0.305	S	S	.	.	S	Bend	trans	-143.8	150.6	-177.6	59.1	167.8	-148.4	0	0	112.4	I88 A92 Y111	I88-E90 WeakPolarHBondContact CG2-O 3.27Å; E90-A92 PolarHBondContact O-N 3.18Å; E90-Y111 WeakPolarHBondContact O-CB 3.49Å
91	Q	92.6	Very high	92.6	Very high	54 Å²	54	52.2 Å²	52.2	25%	0.252	29%	0.293	S	S	.	.			trans	-63.2	117	175.5	-170.2	-176	39.6	0	0	110.7	Y111 S114 K116	Q91-Y111 HydrophobicContact CB-CD1 4.36Å; Q91-S114 VanDerWaalsContact CG-O 3.29Å; Q91-S114 WeakPolarHBondContact CG-O 3.42Å; Q91-S114 PolarHBondContact NE2-O 3.46Å; Q91-K116 HydrophobicContact CG-CG 4.31Å; Q91-K116 WeakPolarHBondContact O-CE 3.35Å; Q91-K116 PolarHBondContact O-NZ 2.91Å
92	A	94.8	Very high	93.2	Very high	2 Å²	2	49.6 Å²	49.6	2%	0.017	28%	0.28	C	S	.	.			trans	-71.3	153.9	-176.8	0	0	0	0	0	111.8	T66 E90 V94 Y111 L112 P115 K116	T66-A92 HydrophobicContact CG2-CB 4.07Å; E90-A92 PolarHBondContact O-N 3.18Å; A92-V94 VanDerWaalsContact CB-O 3.22Å; A92-V94 WeakPolarHBondContact CB-O 3.35Å; A92-Y111 PolarHBondContact N-O 2.97Å; A92-L112 HydrophobicContact CB-CD2 3.98Å; A92-P115 CarbonylContact O-C 3.11Å; A92-P115 VanDerWaalsContact O-CA 3.22Å; A92-P115 WeakPolarHBondContact O-CA 3.49Å; A92-P115 WeakPolarHBondContact O-CB 3.09Å; A92-K116 PolarHBondContact O-N 3.48Å
93	A	94.5	Very high	93.8	Very high	42 Å²	42	50.5 Å²	50.5	35%	0.347	27%	0.269	S	S	.	.	S	Bend	trans	-71.6	-37.9	173.5	0	0	0	0	0	112	F117	A93-F117 HydrophobicContact CB-CD2 4.28Å; A93-F117 HydrophobicContact CB-CE2 4.45Å; A93-F117 WeakPolarHBondContact O-CD2 3.34Å; A93-F117 PolarHBondContact O-N 3.36Å
94	V	96.7	Very high	94.3	Very high	42 Å²	42	56.6 Å²	56.6	26%	0.255	29%	0.286	S	S	.	.	S	Bend	trans	-118.2	133.6	174.4	175.5	0	0	0	0	107.6	L65 A92 I119 I121	L65-V94 HydrophobicContact CD2-CB 3.92Å; L65-V94 HydrophobicContact CD2-CG1 3.81Å; A92-V94 VanDerWaalsContact CB-O 3.22Å; A92-V94 WeakPolarHBondContact CB-O 3.35Å; V94-I119 HydrophobicContact CG1-CB 4.44Å; V94-I119 HydrophobicContact CG1-CG2 4.06Å; V94-I119 HydrophobicContact CG2-CG2 4.46Å; V94-I121 HydrophobicContact CG1-CG1 4.25Å
95	G	96.8	Very high	94.5	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	173.4	-175.4	0	0	0	0	0	113.4	L112 I119 W120 I121	G95-L112 CarbonylContact C-O 3.54Å; G95-L112 WeakPolarHBondContact CA-O 3.39Å; G95-I119 PolarHBondContact N-O 2.9Å; G95-W120 WeakPolarHBondContact O-CA 3.49Å; G95-I121 PolarHBondContact O-N 3.29Å
96	F	97.9	Very high	94.6	Very high	3 Å²	3	59.6 Å²	59.6	1%	0.013	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.8	171.2	-177.2	-104.9	0	0	0	109.6	Q58 I61 L65 V73 T98 L112 I121 L128	Q58-F96 VanDerWaalsContact OE1-CZ 3.25Å; I61-F96 HydrophobicContact CD1-CE2 4.37Å; I61-F96 HydrophobicContact CG2-CD2 3.92Å; I61-F96 HydrophobicContact CG2-CE2 3.97Å; L65-F96 HydrophobicContact CD1-CB 3.79Å; L65-F96 HydrophobicContact CD1-CD2 4.35Å; L65-F96 HydrophobicContact CD1-CG 4.41Å; V73-F96 HydrophobicContact CG1-CD1 4.05Å; V73-F96 HydrophobicContact CG1-CE1 4.05Å; F96-T98 HydrophobicContact CE1-CG2 4.04Å; F96-L112 HydrophobicContact CB-CB 4.28Å; F96-L112 HydrophobicContact CB-CD1 4.19Å; F96-L112 HydrophobicContact CB-CD2 4.39Å; F96-L112 PolarHBondContact N-O 3.27Å; F96-I121 CarbonylContact C-O 3.58Å; F96-I121 VanDerWaalsContact CA-O 3.3Å; F96-I121 WeakPolarHBondContact CA-O 3.38Å; F96-I121 HydrophobicContact CD2-CB 4.09Å; F96-I121 HydrophobicContact CD2-CG2 4.13Å; F96-I121 HydrophobicContact CE2-CG2 4.29Å; F96-L128 HydrophobicContact CE2-CD2 4.34Å
97	L	97.1	Very high	94.6	Very high	48 Å²	48	61 Å²	61	25%	0.251	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.2	172.6	-59	174.6	0	0	0	107.9	K113 W120 I121 V122 G123	L97-K113 HydrophobicContact CD2-CB 4.46Å; L97-K113 HydrophobicContact CD2-CG 3.91Å; L97-W120 HydrophobicContact CD1-CB 4.18Å; L97-W120 HydrophobicContact CD1-CG 3.98Å; L97-W120 HydrophobicContact CG-CB 4.27Å; L97-W120 HydrophobicContact CG-CG 4.16Å; L97-I121 PolarHBondContact N-O 3.32Å; L97-V122 HydrophobicContact CB-CG1 4.42Å; L97-V122 HydrophobicContact CB-CG2 4.3Å; L97-V122 HydrophobicContact CD1-CG2 4.44Å; L97-V122 CarbonylContact O-C 3.56Å; L97-V122 VanDerWaalsContact O-CA 3.28Å; L97-V122 WeakPolarHBondContact O-CA 3.41Å; L97-G123 PolarHBondContact O-N 3.21Å
98	T	96.5	Very high	94.7	Very high	21 Å²	21	60.9 Å²	60.9	13%	0.129	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.8	178.8	177	0	0	0	0	112	F96 M100 E101 V108 G123	F96-T98 HydrophobicContact CE1-CG2 4.04Å; T98-M100 HydrophobicContact CG2-CB 4.08Å; T98-M100 PolarHBondContact O-N 3.09Å; T98-M100 PolarHBondContact OG1-N 3.28Å; T98-M100 VanDerWaalsContact OG1-N 3.16Å; T98-E101 HydrophobicContact CG2-CB 4.24Å; T98-E101 PolarHBondContact O-N 3.01Å; T98-E101 VanDerWaalsContact O-N 3.12Å; T98-V108 HydrophobicContact CG2-CG2 3.77Å; T98-G123 CarbonylContact C-O 3.59Å; T98-G123 WeakPolarHBondContact CA-O 3.49Å
99	L	95.8	Very high	94.6	Very high	78 Å²	78	61 Å²	61	41%	0.408	31%	0.305	S	S	.	.	H	α-helix	trans	-55.3	-30.3	170.2	179.6	62.6	0	0	0	111.5	E101 A102 L103 G123	L99-E101 PolarHBondContact O-N 3.17Å; L99-A102 HydrophobicContact CD1-CB 4.44Å; L99-A102 WeakPolarHBondContact O-CB 3.3Å; L99-A102 PolarHBondContact O-N 3.02Å; L99-A102 VanDerWaalsContact O-N 3.09Å; L99-L103 HydrophobicContact CD1-CG 4.37Å; L99-L103 HydrophobicContact CD2-CD1 4.37Å; L99-L103 HydrophobicContact CG-CD1 3.99Å; L99-L103 HydrophobicContact CG-CG 4.23Å; L99-L103 WeakPolarHBondContact O-CG 3.41Å; L99-L103 PolarHBondContact O-N 2.77Å; L99-G123 PolarHBondContact N-O 3.09Å
100	M	94.9	Very high	94.5	Very high	44 Å²	44	57 Å²	57	22%	0.217	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-31.3	178.9	-63.3	-57.5	108.4	0	0	112.6	T98 L103 R104 Y105 E125	T98-M100 HydrophobicContact CG2-CB 4.08Å; T98-M100 PolarHBondContact O-N 3.09Å; T98-M100 PolarHBondContact OG1-N 3.28Å; T98-M100 VanDerWaalsContact OG1-N 3.16Å; M100-L103 HydrophobicContact CE-CD1 3.88Å; M100-L103 CarbonylContact O-C 3.55Å; M100-L103 PolarHBondContact O-N 2.95Å; M100-R104 PolarHBondContact O-N 3.11Å; M100-R104 VanDerWaalsContact O-N 3.11Å; M100-Y105 PolarHBondContact O-N 2.96Å; M100-Y105 HydrophobicContact SD-CD2 3.87Å; M100-E125 HydrophobicContact CE-CG 3.57Å
101	E	95.9	Very high	94.6	Very high	49 Å²	49	54.2 Å²	54.2	23%	0.229	27%	0.273	C	S	.	.	H	α-helix	trans	-70.5	-42.8	174.3	-177.5	176.7	-142.1	0	0	111.2	T98 L99 L103 R104 C106 V108 K113	T98-E101 HydrophobicContact CG2-CB 4.24Å; T98-E101 PolarHBondContact O-N 3.01Å; T98-E101 VanDerWaalsContact O-N 3.12Å; L99-E101 PolarHBondContact O-N 3.17Å; E101-L103 PolarHBondContact O-N 2.84Å; E101-R104 WeakPolarHBondContact O-CA 3.44Å; E101-R104 PolarHBondContact O-N 3.44Å; E101-C106 WeakPolarHBondContact CA-O 3.43Å; E101-V108 HydrophobicContact CB-CG2 4.12Å; E101-V108 HydrophobicContact CG-CG2 4.46Å; E101-V108 PolarHBondContact OE1-N 3.04Å; E101-K113 IonicContact OE1-NZ 2.85Å; E101-K113 PolarHBondContact OE1-NZ 2.8Å; E101-K113 VanDerWaalsContact OE1-NZ 3.14Å
102	A	93.9	Very high	94.7	Very high	79 Å²	79	51.7 Å²	51.7	65%	0.653	26%	0.261	S	S	*	.	H	α-helix	trans	-62.8	-31.9	176	0	0	0	0	0	112.3	L99 R104	L99-A102 HydrophobicContact CD1-CB 4.44Å; L99-A102 WeakPolarHBondContact O-CB 3.3Å; L99-A102 PolarHBondContact O-N 3.02Å; L99-A102 VanDerWaalsContact O-N 3.09Å; A102-R104 VanDerWaalsContact C-N 3.29Å
103	L	95.1	Very high	94.7	Very high	86 Å²	86	55 Å²	55	45%	0.45	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1	173.4	-63.1	177.8	0	0	0	113.7	L99 M100 E101 Y105	L99-L103 HydrophobicContact CD1-CG 4.37Å; L99-L103 HydrophobicContact CD2-CD1 4.37Å; L99-L103 HydrophobicContact CG-CD1 3.99Å; L99-L103 HydrophobicContact CG-CG 4.23Å; L99-L103 WeakPolarHBondContact O-CG 3.41Å; L99-L103 PolarHBondContact O-N 2.77Å; M100-L103 HydrophobicContact CE-CD1 3.88Å; M100-L103 CarbonylContact O-C 3.55Å; M100-L103 PolarHBondContact O-N 2.95Å; E101-L103 PolarHBondContact O-N 2.84Å; L103-Y105 VanDerWaalsContact C-N 3.31Å; L103-Y105 HydrophobicContact CB-CD2 3.54Å; L103-Y105 HydrophobicContact CB-CE2 3.68Å; L103-Y105 HydrophobicContact CD1-CD2 4.26Å; L103-Y105 HydrophobicContact CD1-CE2 4Å; L103-Y105 HydrophobicContact CG-CE2 4.48Å; L103-Y105 PolarHBondContact O-N 3.1Å
104	R	92.8	Very high	94.6	Very high	230 Å²	230	54.3 Å²	54.3	87%	0.868	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	25	178.6	-48.6	178.5	178.1	-177.5	-2.2	114.9	M100 E101 A102	M100-R104 PolarHBondContact O-N 3.11Å; M100-R104 VanDerWaalsContact O-N 3.11Å; E101-R104 WeakPolarHBondContact O-CA 3.44Å; E101-R104 PolarHBondContact O-N 3.44Å; A102-R104 VanDerWaalsContact C-N 3.29Å
105	Y	92.1	Very high	94.5	Very high	182 Å²	182	52.3 Å²	52.3	71%	0.714	26%	0.256	S	S	*	.	S	Bend	trans	-81.3	-26.1	172.7	-70.9	-65.5	0	0	0	113	M100 L103	M100-Y105 PolarHBondContact O-N 2.96Å; M100-Y105 HydrophobicContact SD-CD2 3.87Å; L103-Y105 VanDerWaalsContact C-N 3.31Å; L103-Y105 HydrophobicContact CB-CD2 3.54Å; L103-Y105 HydrophobicContact CB-CE2 3.68Å; L103-Y105 HydrophobicContact CD1-CD2 4.26Å; L103-Y105 HydrophobicContact CD1-CE2 4Å; L103-Y105 HydrophobicContact CG-CE2 4.48Å; L103-Y105 PolarHBondContact O-N 3.1Å
106	C	92.2	Very high	94.3	Very high	46 Å²	46	57.4 Å²	57.4	31%	0.311	28%	0.278	S	S	.	.			trans	-147.1	173.5	175.3	69.2	0	0	0	0	111	E101	E101-C106 WeakPolarHBondContact CA-O 3.43Å
107	K	92.4	Very high	94.2	Very high	72 Å²	72	62.7 Å²	62.7	31%	0.313	30%	0.301	S	S	.	.			trans	-125.2	119	173.7	-176.9	-177.6	-179.2	-171.9	0	108.1
108	V	95.4	Very high	94.1	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.292	C	S	.	.			trans	-81.9	139.5	175.5	-173.7	0	0	0	0	108.3	V73 T98 E101 L112 K113	V73-V108 HydrophobicContact CB-CG1 4.4Å; V73-V108 HydrophobicContact CB-CG2 4.41Å; V73-V108 HydrophobicContact CG2-CG2 3.99Å; V73-V108 CarbonylContact O-C 3.56Å; V73-V108 WeakPolarHBondContact O-CA 3.38Å; T98-V108 HydrophobicContact CG2-CG2 3.77Å; E101-V108 HydrophobicContact CB-CG2 4.12Å; E101-V108 HydrophobicContact CG-CG2 4.46Å; E101-V108 PolarHBondContact OE1-N 3.04Å; V108-L112 HydrophobicContact CG1-CB 3.72Å; V108-L112 HydrophobicContact CG1-CD1 4.3Å; V108-K113 HydrophobicContact CB-CD 4.09Å; V108-K113 HydrophobicContact CB-CG 3.91Å; V108-K113 HydrophobicContact CG1-CD 4.44Å; V108-K113 HydrophobicContact CG1-CG 3.72Å; V108-K113 WeakPolarHBondContact O-CE 3.29Å; V108-K113 PolarHBondContact O-NZ 2.84Å
109	G	93.4	Very high	94.1	Very high	5 Å²	5	63 Å²	63	5%	0.052	30%	0.302	C	S	.	.			trans	-76.3	161.8	179.8	0	0	0	0	0	113.6	V73 D75 Y111 L112 K113	V73-G109 PolarHBondContact O-N 3.45Å; D75-G109 VanDerWaalsContact CG-CA 3.44Å; D75-G109 VanDerWaalsContact OD1-C 3.23Å; D75-G109 WeakPolarHBondContact OD1-CA 3.28Å; D75-G109 VanDerWaalsContact OD2-CA 3.27Å; D75-G109 WeakPolarHBondContact OD2-CA 3.33Å; G109-Y111 PolarHBondContact O-N 2.92Å; G109-L112 PolarHBondContact O-N 3.08Å; G109-K113 WeakPolarHBondContact O-CB 3.42Å; G109-K113 WeakPolarHBondContact O-CG 3.48Å; G109-K113 PolarHBondContact O-N 2.87Å
110	S	91.7	Very high	94.2	Very high	14 Å²	14	59.9 Å²	59.9	10%	0.098	29%	0.285	C	S	.	.	H	α-helix	trans	-60.6	-31.7	176.6	73.7	0	0	0	0	112	D75 L112 K113 S114 E142	D75-S110 VanDerWaalsContact CG-N 3.29Å; D75-S110 PolarHBondContact OD1-N 2.62Å; D75-S110 VanDerWaalsContact OD1-N 3.11Å; D75-S110 PolarHBondContact OD2-N 2.95Å; D75-S110 PolarHBondContact OD2-OG 2.99Å; S110-L112 VanDerWaalsContact C-N 3.26Å; S110-L112 PolarHBondContact O-N 2.95Å; S110-K113 PolarHBondContact O-N 3.39Å; S110-S114 PolarHBondContact O-N 2.75Å; S110-E142 PolarHBondContact OG-OE1 3.24Å
111	Y	93.4	Very high	94.4	Very high	42 Å²	42	59.5 Å²	59.5	17%	0.165	28%	0.284	C	S	.	.	H	α-helix	trans	-66.4	-25.2	-180	-65.9	-16.4	0	0	0	113.9	D75 I88 H89 E90 Q91 A92 G109	D75-Y111 HydrophobicContact CB-CD2 3.83Å; D75-Y111 HydrophobicContact CB-CE2 3.94Å; D75-Y111 HydrophobicContact CB-CG 4.35Å; D75-Y111 WeakPolarHBondContact OD1-CB 3.45Å; D75-Y111 WeakPolarHBondContact OD1-CD2 3.37Å; D75-Y111 VanDerWaalsContact OD1-CG 3.23Å; D75-Y111 PolarHBondContact OD1-N 3.4Å; I88-Y111 HydrophobicContact CB-CD2 4.46Å; I88-Y111 HydrophobicContact CG2-CD2 4.12Å; I88-Y111 HydrophobicContact CG2-CG 4.5Å; I88-Y111 VanDerWaalsContact O-CD2 3.24Å; I88-Y111 WeakPolarHBondContact O-CD2 3.18Å; I88-Y111 WeakPolarHBondContact O-CE2 3.43Å; H89-Y111 VanDerWaalsContact C-CE2 3.42Å; H89-Y111 WeakPolarHBondContact O-CE2 3.45Å; E90-Y111 WeakPolarHBondContact O-CB 3.49Å; Q91-Y111 HydrophobicContact CB-CD1 4.36Å; A92-Y111 PolarHBondContact N-O 2.97Å; G109-Y111 PolarHBondContact O-N 2.92Å
112	L	95.6	Very high	94.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-100.7	-30.6	173.5	-67.2	179.7	0	0	0	112.7	T66 V73 I88 A92 G95 F96 V108 G109 S110	T66-L112 HydrophobicContact CG2-CD2 4.12Å; V73-L112 HydrophobicContact CB-CD1 4Å; V73-L112 HydrophobicContact CG1-CD1 4.25Å; I88-L112 HydrophobicContact CD1-CD1 4.24Å; I88-L112 HydrophobicContact CG1-CD1 3.82Å; I88-L112 HydrophobicContact CG1-CG 4.08Å; I88-L112 HydrophobicContact CG2-CG 4.44Å; A92-L112 HydrophobicContact CB-CD2 3.98Å; G95-L112 CarbonylContact C-O 3.54Å; G95-L112 WeakPolarHBondContact CA-O 3.39Å; F96-L112 HydrophobicContact CB-CB 4.28Å; F96-L112 HydrophobicContact CB-CD1 4.19Å; F96-L112 HydrophobicContact CB-CD2 4.39Å; F96-L112 PolarHBondContact N-O 3.27Å; V108-L112 HydrophobicContact CG1-CB 3.72Å; V108-L112 HydrophobicContact CG1-CD1 4.3Å; G109-L112 PolarHBondContact O-N 3.08Å; S110-L112 VanDerWaalsContact C-N 3.26Å; S110-L112 PolarHBondContact O-N 2.95Å
113	K	94	Very high	94.4	Very high	73 Å²	73	55.6 Å²	55.6	32%	0.317	26%	0.255	S	S	.	.	H	α-helix	trans	-76.1	-35.7	179.7	-73.3	-169.4	-63.2	-152.4	0	113.6	L97 E101 V108 G109 S110 P115 W120	L97-K113 HydrophobicContact CD2-CB 4.46Å; L97-K113 HydrophobicContact CD2-CG 3.91Å; E101-K113 IonicContact OE1-NZ 2.85Å; E101-K113 PolarHBondContact OE1-NZ 2.8Å; E101-K113 VanDerWaalsContact OE1-NZ 3.14Å; V108-K113 HydrophobicContact CB-CD 4.09Å; V108-K113 HydrophobicContact CB-CG 3.91Å; V108-K113 HydrophobicContact CG1-CD 4.44Å; V108-K113 HydrophobicContact CG1-CG 3.72Å; V108-K113 WeakPolarHBondContact O-CE 3.29Å; V108-K113 PolarHBondContact O-NZ 2.84Å; G109-K113 WeakPolarHBondContact O-CB 3.42Å; G109-K113 WeakPolarHBondContact O-CG 3.48Å; G109-K113 PolarHBondContact O-N 2.87Å; S110-K113 PolarHBondContact O-N 3.39Å; K113-P115 WeakPolarHBondContact O-CD 3.46Å; K113-W120 PolarHBondContact O-NE1 3.49Å
114	S	92.6	Very high	94.2	Very high	27 Å²	27	53.9 Å²	53.9	19%	0.189	25%	0.251	C	S	.	.	S	Bend	trans	-114.4	72	177.2	-160.1	0	0	0	0	109.6	Q91 S110 A140	Q91-S114 VanDerWaalsContact CG-O 3.29Å; Q91-S114 WeakPolarHBondContact CG-O 3.42Å; Q91-S114 PolarHBondContact NE2-O 3.46Å; S110-S114 PolarHBondContact O-N 2.75Å; S114-A140 PolarHBondContact OG-N 3.2Å; S114-A140 PolarHBondContact OG-O 2.98Å
115	P	94.9	Very high	93.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.243	C	C	.	.			trans	-67.9	169.8	178.8	30.4	-38	0	0	0	112.6	A92 K113 F117 W120 V139	A92-P115 CarbonylContact O-C 3.11Å; A92-P115 VanDerWaalsContact O-CA 3.22Å; A92-P115 WeakPolarHBondContact O-CA 3.49Å; A92-P115 WeakPolarHBondContact O-CB 3.09Å; K113-P115 WeakPolarHBondContact O-CD 3.46Å; P115-F117 VanDerWaalsContact C-N 3.27Å; P115-F117 WeakPolarHBondContact CG-O 3.32Å; P115-F117 PolarHBondContact O-N 3.19Å; P115-W120 HydrophobicContact CG-CD2 4.35Å; P115-W120 HydrophobicContact CG-CG 4.5Å; P115-W120 HydrophobicContact CG-CZ2 4.11Å; P115-V139 HydrophobicContact CG-CG1 3.94Å; P115-V139 WeakPolarHBondContact O-CB 3.48Å; P115-V139 VanDerWaalsContact O-CG1 3.27Å; P115-V139 WeakPolarHBondContact O-CG1 3.42Å
116	K	93.3	Very high	93.1	Very high	106 Å²	106	45 Å²	45	46%	0.461	23%	0.231	S	C	.	.	S	Bend	trans	-67	-26.7	178.9	-62.1	171.5	178.7	159.7	0	113.5	Q91 A92 M136	Q91-K116 HydrophobicContact CG-CG 4.31Å; Q91-K116 WeakPolarHBondContact O-CE 3.35Å; Q91-K116 PolarHBondContact O-NZ 2.91Å; A92-K116 PolarHBondContact O-N 3.48Å; K116-M136 WeakPolarHBondContact O-CE 3.28Å
117	F	94.2	Very high	92.9	Very high	115 Å²	115	49.3 Å²	49.3	50%	0.504	25%	0.246	S	C	.	.	S	Bend	trans	-124.6	145.3	176.3	-59.2	-72.9	0	0	0	109.7	A93 P115 I119	A93-F117 HydrophobicContact CB-CD2 4.28Å; A93-F117 HydrophobicContact CB-CE2 4.45Å; A93-F117 WeakPolarHBondContact O-CD2 3.34Å; A93-F117 PolarHBondContact O-N 3.36Å; P115-F117 VanDerWaalsContact C-N 3.27Å; P115-F117 WeakPolarHBondContact CG-O 3.32Å; P115-F117 PolarHBondContact O-N 3.19Å; F117-I119 HydrophobicContact CB-CD1 4.34Å; F117-I119 HydrophobicContact CB-CG1 4.37Å; F117-I119 PolarHBondContact O-N 3.1Å
118	P	95.8	Very high	93	Very high	10 Å²	10	50.7 Å²	50.7	7%	0.065	26%	0.256	C	S	.	.	S	Bend	trans	-75	61.7	-176.8	32	-36.2	0	0	0	111.5	W120 F132 A133 M136 V139	P118-W120 VanDerWaalsContact C-CE3 3.49Å; P118-W120 VanDerWaalsContact CA-CH2 3.41Å; P118-W120 VanDerWaalsContact CA-CZ3 3.41Å; P118-W120 HydrophobicContact CB-CH2 3.66Å; P118-W120 HydrophobicContact CB-CZ3 3.77Å; P118-W120 VanDerWaalsContact O-CZ3 3.29Å; P118-W120 WeakPolarHBondContact O-CZ3 2.89Å; P118-F132 CarbonylContact O-C 3.48Å; P118-F132 WeakPolarHBondContact O-CA 3.31Å; P118-F132 WeakPolarHBondContact O-CB 3.49Å; P118-A133 HydrophobicContact CB-CB 4.3Å; P118-A133 VanDerWaalsContact CG-O 3.24Å; P118-A133 WeakPolarHBondContact CG-O 3.46Å; P118-A133 PolarHBondContact O-N 3.5Å; P118-M136 WeakPolarHBondContact CD-SD 3.46Å; P118-M136 HydrophobicContact CG-SD 3.93Å; P118-V139 HydrophobicContact CB-CG1 4.09Å; P118-V139 HydrophobicContact CB-CG2 3.97Å; P118-V139 HydrophobicContact CG-CG2 4.23Å
119	I	97	Very high	93	Very high	65 Å²	65	55 Å²	55	33%	0.333	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	127.4	-179.7	-52.1	174.8	0	0	0	106.2	V94 G95 F117 V130 F131 F132	V94-I119 HydrophobicContact CG1-CB 4.44Å; V94-I119 HydrophobicContact CG1-CG2 4.06Å; V94-I119 HydrophobicContact CG2-CG2 4.46Å; G95-I119 PolarHBondContact N-O 2.9Å; F117-I119 HydrophobicContact CB-CD1 4.34Å; F117-I119 HydrophobicContact CB-CG1 4.37Å; F117-I119 PolarHBondContact O-N 3.1Å; I119-V130 HydrophobicContact CG2-CG1 3.99Å; I119-F131 CarbonylContact C-O 3.56Å; I119-F131 WeakPolarHBondContact CA-O 3.43Å; I119-F132 HydrophobicContact CB-CB 4.5Å; I119-F132 HydrophobicContact CG1-CB 4.18Å; I119-F132 HydrophobicContact CG2-CB 4.47Å
120	W	97.8	Very high	93.2	Very high	13 Å²	13	58.8 Å²	58.8	5%	0.049	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141.5	179.9	-61	-99.9	0	0	0	110	G95 L97 K113 P115 P118 V122 V130 F131 L138 V139	G95-W120 WeakPolarHBondContact O-CA 3.49Å; L97-W120 HydrophobicContact CD1-CB 4.18Å; L97-W120 HydrophobicContact CD1-CG 3.98Å; L97-W120 HydrophobicContact CG-CB 4.27Å; L97-W120 HydrophobicContact CG-CG 4.16Å; K113-W120 PolarHBondContact O-NE1 3.49Å; P115-W120 HydrophobicContact CG-CD2 4.35Å; P115-W120 HydrophobicContact CG-CG 4.5Å; P115-W120 HydrophobicContact CG-CZ2 4.11Å; P118-W120 VanDerWaalsContact C-CE3 3.49Å; P118-W120 VanDerWaalsContact CA-CH2 3.41Å; P118-W120 VanDerWaalsContact CA-CZ3 3.41Å; P118-W120 HydrophobicContact CB-CH2 3.66Å; P118-W120 HydrophobicContact CB-CZ3 3.77Å; P118-W120 VanDerWaalsContact O-CZ3 3.29Å; P118-W120 WeakPolarHBondContact O-CZ3 2.89Å; W120-V122 HydrophobicContact CB-CG2 4.46Å; W120-V130 WeakPolarHBondContact O-CA 3.4Å; W120-F131 HydrophobicContact CD2-CD1 4.33Å; W120-F131 AromaticContact CE3-CD1 3.62Å; W120-F131 HydrophobicContact CE3-CD1 3.62Å; W120-F131 HydrophobicContact CE3-CE1 4.08Å; W120-F131 HydrophobicContact CZ3-CD1 4.09Å; W120-F131 HydrophobicContact CZ3-CE1 4.09Å; W120-F131 PolarHBondContact N-O 2.98Å; W120-F131 PolarHBondContact O-N 3.37Å; W120-L138 HydrophobicContact CH2-CB 4.2Å; W120-V139 HydrophobicContact CH2-CG1 3.72Å; W120-V139 HydrophobicContact CZ2-CG1 3.43Å; W120-V139 VanDerWaalsContact CZ2-CG1 3.43Å
121	I	97.7	Very high	93.4	Very high	36 Å²	36	63.3 Å²	63.3	19%	0.185	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	128.9	157	-55.9	-54.2	0	0	0	107.4	L65 V94 G95 F96 L97 L128 T129 V130	L65-I121 HydrophobicContact CD2-CG1 4.09Å; V94-I121 HydrophobicContact CG1-CG1 4.25Å; G95-I121 PolarHBondContact O-N 3.29Å; F96-I121 CarbonylContact C-O 3.58Å; F96-I121 VanDerWaalsContact CA-O 3.3Å; F96-I121 WeakPolarHBondContact CA-O 3.38Å; F96-I121 HydrophobicContact CD2-CB 4.09Å; F96-I121 HydrophobicContact CD2-CG2 4.13Å; F96-I121 HydrophobicContact CE2-CG2 4.29Å; L97-I121 PolarHBondContact N-O 3.32Å; I121-L128 HydrophobicContact CG2-CB 4.16Å; I121-L128 HydrophobicContact CG2-CD1 4.44Å; I121-L128 HydrophobicContact CG2-CD2 4.02Å; I121-L128 HydrophobicContact CG2-CG 4.43Å; I121-T129 CarbonylContact C-O 3.58Å; I121-T129 WeakPolarHBondContact CA-O 3.37Å; I121-V130 HydrophobicContact CD1-CG2 3.85Å
122	V	97.3	Very high	93.5	Very high	41 Å²	41	67.7 Å²	67.7	25%	0.248	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117	177.1	-172.2	0	0	0	0	108.6	L97 W120 L128 T129 F131	L97-V122 HydrophobicContact CB-CG1 4.42Å; L97-V122 HydrophobicContact CB-CG2 4.3Å; L97-V122 HydrophobicContact CD1-CG2 4.44Å; L97-V122 CarbonylContact O-C 3.56Å; L97-V122 VanDerWaalsContact O-CA 3.28Å; L97-V122 WeakPolarHBondContact O-CA 3.41Å; W120-V122 HydrophobicContact CB-CG2 4.46Å; V122-L128 WeakPolarHBondContact O-CA 3.38Å; V122-T129 HydrophobicContact CB-CG2 3.84Å; V122-T129 PolarHBondContact N-O 3.16Å; V122-T129 PolarHBondContact O-N 3.2Å; V122-F131 HydrophobicContact CG2-CB 3.58Å
123	G	94.6	Very high	93.5	Very high	4 Å²	4	68.9 Å²	68.9	4%	0.041	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	135.7	177.8	0	0	0	0	0	113.5	L97 T98 L99	L97-G123 PolarHBondContact O-N 3.21Å; T98-G123 CarbonylContact C-O 3.59Å; T98-G123 WeakPolarHBondContact CA-O 3.49Å; L99-G123 PolarHBondContact N-O 3.09Å
124	S	89	Confident	93.4	Very high	50 Å²	50	74.9 Å²	74.9	35%	0.35	38%	0.379	S	S	.	.			trans	-103.6	-167.6	158.9	75.7	0	0	0	0	109.7	T126 H127	S124-T126 PolarHBondContact O-N 3.06Å; S124-T126 PolarHBondContact OG-N 3.3Å; S124-H127 PolarHBondContact N-O 2.86Å; S124-H127 PolarHBondContact OG-N 3.48Å; S124-H127 VanDerWaalsContact OG-N 3.13Å; S124-H127 PolarHBondContact OG-O 2.92Å
125	E	80.6	Confident	93.5	Very high	152 Å²	152	77.9 Å²	77.9	71%	0.71	39%	0.392	S	S	*	.	S	Bend	trans	-59.2	-31.8	175.8	-67.1	178	178	0	0	113.5	M100	M100-E125 HydrophobicContact CE-CG 3.57Å
126	T	81.9	Confident	93.3	Very high	75 Å²	75	82.7 Å²	82.7	46%	0.46	42%	0.416	S	S	.	.	S	Bend	trans	-137.5	-7	-170.9	52.8	0	0	0	0	114.4	H55 S124	H55-T126 PolarHBondContact CE1-O 2.9Å; S124-T126 PolarHBondContact O-N 3.06Å; S124-T126 PolarHBondContact OG-N 3.3Å
127	H	89.1	Confident	93	Very high	136 Å²	136	81.3 Å²	81.3	63%	0.63	43%	0.425	S	S	*	.			trans	-131.5	142.7	-173.4	-70	72	0	0	0	111.5	S124	S124-H127 PolarHBondContact N-O 2.86Å; S124-H127 PolarHBondContact OG-N 3.48Å; S124-H127 VanDerWaalsContact OG-N 3.13Å; S124-H127 PolarHBondContact OG-O 2.92Å
128	L	93.6	Very high	92.7	Very high	101 Å²	101	80.4 Å²	80.4	53%	0.529	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137.4	168.2	-60.6	177.2	0	0	0	108.7	I61 F96 I121 V122	I61-L128 HydrophobicContact CD1-CD1 3.97Å; I61-L128 HydrophobicContact CD1-CD2 4.04Å; I61-L128 HydrophobicContact CG1-CD1 4.23Å; F96-L128 HydrophobicContact CE2-CD2 4.34Å; I121-L128 HydrophobicContact CG2-CB 4.16Å; I121-L128 HydrophobicContact CG2-CD1 4.44Å; I121-L128 HydrophobicContact CG2-CD2 4.02Å; I121-L128 HydrophobicContact CG2-CG 4.43Å; V122-L128 WeakPolarHBondContact O-CA 3.38Å
129	T	95.6	Very high	92.3	Very high	89 Å²	89	80.5 Å²	80.5	55%	0.546	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	162.2	171.2	-171	0	0	0	0	110.5	I121 V122	I121-T129 CarbonylContact C-O 3.58Å; I121-T129 WeakPolarHBondContact CA-O 3.37Å; V122-T129 HydrophobicContact CB-CG2 3.84Å; V122-T129 PolarHBondContact N-O 3.16Å; V122-T129 PolarHBondContact O-N 3.2Å
130	V	96.6	Very high	91.2	Very high	85 Å²	85	79.7 Å²	79.7	52%	0.515	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.3	175.2	-174.9	0	0	0	0	108.6	I119 W120 I121	I119-V130 HydrophobicContact CG2-CG1 3.99Å; W120-V130 WeakPolarHBondContact O-CA 3.4Å; I121-V130 HydrophobicContact CD1-CG2 3.85Å
131	F	96.1	Very high	89.9	Confident	110 Å²	110	84.2 Å²	84.2	48%	0.482	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.6	168.2	178.2	-109.4	0	0	0	108.7	I119 W120 V122	I119-F131 CarbonylContact C-O 3.56Å; I119-F131 WeakPolarHBondContact CA-O 3.43Å; W120-F131 HydrophobicContact CD2-CD1 4.33Å; W120-F131 AromaticContact CE3-CD1 3.62Å; W120-F131 HydrophobicContact CE3-CD1 3.62Å; W120-F131 HydrophobicContact CE3-CE1 4.08Å; W120-F131 HydrophobicContact CZ3-CD1 4.09Å; W120-F131 HydrophobicContact CZ3-CE1 4.09Å; W120-F131 PolarHBondContact N-O 2.98Å; W120-F131 PolarHBondContact O-N 3.37Å; V122-F131 HydrophobicContact CG2-CB 3.58Å
132	F	96.9	Very high	88.7	Confident	134 Å²	134	84.7 Å²	84.7	59%	0.588	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.7	155.1	177.1	72.3	-83.3	0	0	0	111.2	P118 I119	P118-F132 CarbonylContact O-C 3.48Å; P118-F132 WeakPolarHBondContact O-CA 3.31Å; P118-F132 WeakPolarHBondContact O-CB 3.49Å; I119-F132 HydrophobicContact CB-CB 4.5Å; I119-F132 HydrophobicContact CG1-CB 4.18Å; I119-F132 HydrophobicContact CG2-CB 4.47Å
133	A	95	Very high	87.9	Confident	24 Å²	24	84.9 Å²	84.9	20%	0.198	47%	0.466	C	S	.	.			trans	-131.9	168.1	173.6	0	0	0	0	0	110.1	P118 L138	P118-A133 HydrophobicContact CB-CB 4.3Å; P118-A133 VanDerWaalsContact CG-O 3.24Å; P118-A133 WeakPolarHBondContact CG-O 3.46Å; P118-A133 PolarHBondContact O-N 3.5Å; A133-L138 HydrophobicContact CB-CD1 3.5Å
134	K	92.7	Very high	87.4	Confident	200 Å²	200	89.7 Å²	89.7	87%	0.87	50%	0.497	S	S	*	.	S	Bend	trans	-97.7	-12.7	173.3	-66.1	-177.7	179.2	178.4	0	112.8	M136	K134-M136 PolarHBondContact O-N 3.02Å
135	D	93.1	Very high	87.1	Confident	89 Å²	89	90.9 Å²	90.9	48%	0.476	51%	0.505	S	S	.	.			trans	-85.4	111.8	-176.6	-171.2	-1.3	0	0	0	110	A137 L138	D135-A137 PolarHBondContact O-N 2.78Å; D135-A137 WeakPolarHBondContact OD1-CB 3.34Å; D135-A137 PolarHBondContact OD1-N 3.47Å; D135-L138 HydrophobicContact CB-CD1 4.16Å; D135-L138 HydrophobicContact CB-CG 4.2Å; D135-L138 PolarHBondContact O-N 2.91Å
136	M	90.5	Very high	87.2	Confident	101 Å²	101	87.1 Å²	87.1	50%	0.498	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-69.1	-18.6	175.6	-69.5	-61	-66	0	0	112.1	K116 P118 K134 L138 V139	K116-M136 WeakPolarHBondContact O-CE 3.28Å; P118-M136 WeakPolarHBondContact CD-SD 3.46Å; P118-M136 HydrophobicContact CG-SD 3.93Å; K134-M136 PolarHBondContact O-N 3.02Å; M136-L138 PolarHBondContact O-N 2.82Å; M136-V139 HydrophobicContact CE-CG2 3.91Å; M136-V139 CarbonylContact O-C 3.33Å; M136-V139 VanDerWaalsContact O-CG2 3.28Å; M136-V139 WeakPolarHBondContact O-CG2 3.45Å; M136-V139 PolarHBondContact O-N 2.87Å; M136-V139 HydrophobicContact SD-CG2 4.11Å
137	A	88.7	Confident	87.3	Confident	78 Å²	78	87.3 Å²	87.3	65%	0.645	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-66.6	-18.8	177.1	0	0	0	0	0	112.9	D135 V139	D135-A137 PolarHBondContact O-N 2.78Å; D135-A137 WeakPolarHBondContact OD1-CB 3.34Å; D135-A137 PolarHBondContact OD1-N 3.47Å; A137-V139 PolarHBondContact O-N 3.12Å
138	L	86.6	Confident	87.3	Confident	95 Å²	95	82.4 Å²	82.4	50%	0.497	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-72	-15.9	172.3	-62.8	174	0	0	0	112.8	W120 A133 D135 M136	W120-L138 HydrophobicContact CH2-CB 4.2Å; A133-L138 HydrophobicContact CB-CD1 3.5Å; D135-L138 HydrophobicContact CB-CD1 4.16Å; D135-L138 HydrophobicContact CB-CG 4.2Å; D135-L138 PolarHBondContact O-N 2.91Å; M136-L138 PolarHBondContact O-N 2.82Å
139	V	88.8	Confident	87	Confident	13 Å²	13	84.5 Å²	84.5	8%	0.079	47%	0.467	C	S	.	.	S	Bend	trans	-126.1	92.2	178.8	-73.4	0	0	0	0	109.7	P115 P118 W120 M136 A137	P115-V139 HydrophobicContact CG-CG1 3.94Å; P115-V139 WeakPolarHBondContact O-CB 3.48Å; P115-V139 VanDerWaalsContact O-CG1 3.27Å; P115-V139 WeakPolarHBondContact O-CG1 3.42Å; P118-V139 HydrophobicContact CB-CG1 4.09Å; P118-V139 HydrophobicContact CB-CG2 3.97Å; P118-V139 HydrophobicContact CG-CG2 4.23Å; W120-V139 HydrophobicContact CH2-CG1 3.72Å; W120-V139 HydrophobicContact CZ2-CG1 3.43Å; W120-V139 VanDerWaalsContact CZ2-CG1 3.43Å; M136-V139 HydrophobicContact CE-CG2 3.91Å; M136-V139 CarbonylContact O-C 3.33Å; M136-V139 VanDerWaalsContact O-CG2 3.28Å; M136-V139 WeakPolarHBondContact O-CG2 3.45Å; M136-V139 PolarHBondContact O-N 2.87Å; M136-V139 HydrophobicContact SD-CG2 4.11Å; A137-V139 PolarHBondContact O-N 3.12Å
140	A	73	Confident	86.6	Confident	48 Å²	48	83 Å²	83	40%	0.397	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-103.7	156.1	175	0	0	0	0	0	110.1	S114	S114-A140 PolarHBondContact OG-N 3.2Å; S114-A140 PolarHBondContact OG-O 2.98Å
141	P	70.2	Confident	86.2	Confident	108 Å²	108	79.7 Å²	79.7	70%	0.701	43%	0.431	S	S	*	.	S	Bend	trans	-48	148.8	157.2	-20.9	32	0	0	0	109.9	A143	P141-A143 PolarHBondContact O-N 3.46Å; P141-A143 VanDerWaalsContact O-N 3.12Å
142	E	73.9	Confident	86	Confident	45 Å²	45	77.2 Å²	77.2	21%	0.21	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-46.5	121.3	-180	-174.9	172.4	-125.1	0	0	110.5	S110 E146 Q147 R150	S110-E142 PolarHBondContact OG-OE1 3.24Å; E142-E146 HydrophobicContact CG-CB 3.81Å; E142-Q147 HydrophobicContact CG-CB 4.08Å; E142-Q147 WeakPolarHBondContact OE2-CA 3.39Å; E142-R150 IonicContact OE1-NE 2.82Å; E142-R150 PolarHBondContact OE1-NE 3.31Å; E142-R150 VanDerWaalsContact OE1-NE 3.1Å; E142-R150 IonicContact OE2-CZ 2.7Å; E142-R150 IonicContact OE2-NE 3.21Å; E142-R150 PolarHBondContact OE2-NE 3.09Å; E142-R150 IonicContact OE2-NH2 2.69Å; E142-R150 PolarHBondContact OE2-NH2 3.27Å
143	A	78.9	Confident	85.5	Confident	45 Å²	45	73.3 Å²	73.3	37%	0.372	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-64.1	149.3	178.2	0	0	0	0	0	109.6	P141 S145 E146 Q147	P141-A143 PolarHBondContact O-N 3.46Å; P141-A143 VanDerWaalsContact O-N 3.12Å; A143-S145 PolarHBondContact O-N 2.92Å; A143-E146 PolarHBondContact O-N 3.38Å; A143-Q147 PolarHBondContact O-N 2.99Å
144	P	84.7	Confident	85.1	Confident	106 Å²	106	76.8 Å²	76.8	69%	0.688	42%	0.423	S	S	*	.	H	α-helix	trans	-53	-33.9	-179.5	-28.5	34.9	0	0	0	113.8	A148	P144-A148 WeakPolarHBondContact O-CB 3.43Å; P144-A148 PolarHBondContact O-N 2.87Å
145	S	83.7	Confident	84.9	Confident	75 Å²	75	70 Å²	70	52%	0.524	39%	0.392	S	S	.	.	H	α-helix	trans	-68.4	-36.6	175.6	56.7	0	0	0	0	113.7	A143 R149	A143-S145 PolarHBondContact O-N 2.92Å; S145-R149 WeakPolarHBondContact O-CG 3.43Å; S145-R149 PolarHBondContact O-N 3.04Å
146	E	81.8	Confident	84.6	Confident	72 Å²	72	66.2 Å²	66.2	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-75	-38.6	177.2	-70.1	-60.7	127.4	0	0	110.4	E142 A143 A148 R149 R150	E142-E146 HydrophobicContact CG-CB 3.81Å; A143-E146 PolarHBondContact O-N 3.38Å; E146-A148 VanDerWaalsContact C-N 3.33Å; E146-A148 PolarHBondContact O-N 3.16Å; E146-R149 PolarHBondContact O-N 2.85Å; E146-R149 IonicContact OE1-NH1 2.66Å; E146-R149 PolarHBondContact OE1-NH1 3.11Å; E146-R150 WeakPolarHBondContact O-CB 3.33Å; E146-R150 PolarHBondContact O-N 3.02Å
147	Q	84.9	Confident	84.1	Confident	80 Å²	80	66.2 Å²	66.2	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-57.6	-46.7	169.2	-176.2	-178.3	0.1	0	0	110.8	E142 A143 R149 R150 V151 L175	E142-Q147 HydrophobicContact CG-CB 4.08Å; E142-Q147 WeakPolarHBondContact OE2-CA 3.39Å; A143-Q147 PolarHBondContact O-N 2.99Å; Q147-R149 VanDerWaalsContact C-N 3.35Å; Q147-R149 PolarHBondContact O-N 3.23Å; Q147-R150 PolarHBondContact O-N 3.23Å; Q147-V151 HydrophobicContact CG-CG2 4.48Å; Q147-V151 WeakPolarHBondContact O-CG2 3.33Å; Q147-V151 PolarHBondContact O-N 3.1Å; Q147-L175 HydrophobicContact CG-CD2 4.3Å
148	A	88.7	Confident	83.8	Confident	32 Å²	32	69.7 Å²	69.7	26%	0.264	38%	0.382	S	S	.	.	H	α-helix	trans	-56.6	-45.7	174.9	0	0	0	0	0	112.5	P144 E146 F152 L175	P144-A148 WeakPolarHBondContact O-CB 3.43Å; P144-A148 PolarHBondContact O-N 2.87Å; E146-A148 VanDerWaalsContact C-N 3.33Å; E146-A148 PolarHBondContact O-N 3.16Å; A148-F152 VanDerWaalsContact O-CB 3.23Å; A148-F152 WeakPolarHBondContact O-CB 3.43Å; A148-F152 PolarHBondContact O-N 2.96Å; A148-L175 HydrophobicContact CB-CD1 4.07Å; A148-L175 HydrophobicContact CB-CD2 4.2Å
149	R	87	Confident	83.5	Confident	145 Å²	145	69.6 Å²	69.6	55%	0.547	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-37.3	177.1	-72.8	173.4	97.1	-179.8	9.1	112.7	S145 E146 Q147 Q153	S145-R149 WeakPolarHBondContact O-CG 3.43Å; S145-R149 PolarHBondContact O-N 3.04Å; E146-R149 PolarHBondContact O-N 2.85Å; E146-R149 IonicContact OE1-NH1 2.66Å; E146-R149 PolarHBondContact OE1-NH1 3.11Å; Q147-R149 VanDerWaalsContact C-N 3.35Å; Q147-R149 PolarHBondContact O-N 3.23Å; R149-Q153 WeakPolarHBondContact O-CB 3.43Å; R149-Q153 VanDerWaalsContact O-CG 3.3Å; R149-Q153 WeakPolarHBondContact O-CG 3.47Å; R149-Q153 PolarHBondContact O-N 3Å; R149-Q153 PolarHBondContact O-NE2 2.91Å
150	R	85.9	Confident	83.5	Confident	59 Å²	59	72.6 Å²	72.6	22%	0.223	40%	0.398	C	S	.	.	H	α-helix	trans	-68.7	-48	178.4	-176.8	176	57.2	76.4	-0.7	111	D75 E142 E146 Q147 Q153 T154	D75-R150 HydrophobicContact CB-CG 4.36Å; E142-R150 IonicContact OE1-NE 2.82Å; E142-R150 PolarHBondContact OE1-NE 3.31Å; E142-R150 VanDerWaalsContact OE1-NE 3.1Å; E142-R150 IonicContact OE2-CZ 2.7Å; E142-R150 IonicContact OE2-NE 3.21Å; E142-R150 PolarHBondContact OE2-NE 3.09Å; E142-R150 IonicContact OE2-NH2 2.69Å; E142-R150 PolarHBondContact OE2-NH2 3.27Å; E146-R150 WeakPolarHBondContact O-CB 3.33Å; E146-R150 PolarHBondContact O-N 3.02Å; Q147-R150 PolarHBondContact O-N 3.23Å; R150-Q153 WeakPolarHBondContact O-CB 3.48Å; R150-Q153 PolarHBondContact O-N 3.39Å; R150-T154 PolarHBondContact O-N 3.46Å
151	V	89.4	Confident	84.3	Confident	14 Å²	14	72.6 Å²	72.6	9%	0.085	40%	0.402	C	S	.	.	H	α-helix	trans	-61.8	-47.3	174.9	176.4	0	0	0	0	109.8	Q147 Q153 T154 Y155 A174 L175	Q147-V151 HydrophobicContact CG-CG2 4.48Å; Q147-V151 WeakPolarHBondContact O-CG2 3.33Å; Q147-V151 PolarHBondContact O-N 3.1Å; V151-Q153 VanDerWaalsContact C-N 3.27Å; V151-Q153 PolarHBondContact O-N 3.42Å; V151-T154 PolarHBondContact O-N 3.38Å; V151-T154 PolarHBondContact O-OG1 3.46Å; V151-Y155 HydrophobicContact CG1-CE2 4.04Å; V151-Y155 VanDerWaalsContact O-CD2 3.24Å; V151-Y155 WeakPolarHBondContact O-CD2 3.03Å; V151-A174 HydrophobicContact CG1-CB 3.64Å; V151-L175 HydrophobicContact CB-CD2 3.73Å; V151-L175 HydrophobicContact CB-CG 4Å; V151-L175 HydrophobicContact CG1-CD2 4.2Å; V151-L175 HydrophobicContact CG1-CG 3.93Å; V151-L175 HydrophobicContact CG2-CD2 3.63Å; V151-L175 HydrophobicContact CG2-CG 4.28Å
152	F	91.1	Very high	85.3	Confident	59 Å²	59	75 Å²	75	26%	0.259	40%	0.402	S	S	.	.	H	α-helix	trans	-55.4	-43	176.3	-175	-84.5	0	0	0	112.4	A148 T154 Y155 D156 I163	A148-F152 VanDerWaalsContact O-CB 3.23Å; A148-F152 WeakPolarHBondContact O-CB 3.43Å; A148-F152 PolarHBondContact O-N 2.96Å; F152-T154 PolarHBondContact O-N 3.42Å; F152-Y155 WeakPolarHBondContact O-CA 3.37Å; F152-Y155 PolarHBondContact O-N 2.92Å; F152-D156 HydrophobicContact CD1-CB 4.22Å; F152-D156 HydrophobicContact CE1-CB 3.92Å; F152-D156 PolarHBondContact O-N 3.2Å; F152-D156 VanDerWaalsContact O-N 3.15Å; F152-I163 HydrophobicContact CD2-CD1 4.1Å; F152-I163 HydrophobicContact CE1-CG2 4Å; F152-I163 HydrophobicContact CE2-CB 4.46Å; F152-I163 HydrophobicContact CE2-CD1 3.64Å; F152-I163 HydrophobicContact CE2-CG1 3.77Å; F152-I163 HydrophobicContact CE2-CG2 3.94Å; F152-I163 HydrophobicContact CZ-CB 4.36Å; F152-I163 HydrophobicContact CZ-CD1 4.37Å; F152-I163 HydrophobicContact CZ-CG1 4.05Å; F152-I163 HydrophobicContact CZ-CG2 3.66Å
153	Q	87.2	Confident	86.2	Confident	52 Å²	52	74.5 Å²	74.5	24%	0.243	40%	0.401	C	S	.	.	H	α-helix	trans	-60.6	-26.5	177.2	-85.8	161.2	62.5	0	0	113.6	R149 R150 V151 Y155 D156	R149-Q153 WeakPolarHBondContact O-CB 3.43Å; R149-Q153 VanDerWaalsContact O-CG 3.3Å; R149-Q153 WeakPolarHBondContact O-CG 3.47Å; R149-Q153 PolarHBondContact O-N 3Å; R149-Q153 PolarHBondContact O-NE2 2.91Å; R150-Q153 WeakPolarHBondContact O-CB 3.48Å; R150-Q153 PolarHBondContact O-N 3.39Å; V151-Q153 VanDerWaalsContact C-N 3.27Å; V151-Q153 PolarHBondContact O-N 3.42Å; Q153-Y155 PolarHBondContact O-N 3.34Å; Q153-D156 PolarHBondContact O-N 3.05Å
154	T	86.5	Confident	86.9	Confident	97 Å²	97	75.7 Å²	75.7	60%	0.595	41%	0.405	S	S	*	.	H	α-helix	trans	-71	-14.4	174.3	66.3	0	0	0	0	112.8	R150 V151 F152	R150-T154 PolarHBondContact O-N 3.46Å; V151-T154 PolarHBondContact O-N 3.38Å; V151-T154 PolarHBondContact O-OG1 3.46Å; F152-T154 PolarHBondContact O-N 3.42Å
155	Y	88.4	Confident	87.3	Confident	58 Å²	58	77.7 Å²	77.7	23%	0.227	41%	0.409	C	S	.	.	H	α-helix	trans	-107.5	-6.8	176.9	-63.7	-100.9	0	0	0	113	V151 F152 Q153 P157 I163 L167 D170 V171 A174	V151-Y155 HydrophobicContact CG1-CE2 4.04Å; V151-Y155 VanDerWaalsContact O-CD2 3.24Å; V151-Y155 WeakPolarHBondContact O-CD2 3.03Å; F152-Y155 WeakPolarHBondContact O-CA 3.37Å; F152-Y155 PolarHBondContact O-N 2.92Å; Q153-Y155 PolarHBondContact O-N 3.34Å; Y155-P157 VanDerWaalsContact C-CD 3.42Å; Y155-P157 WeakPolarHBondContact O-CD 3.21Å; Y155-I163 VanDerWaalsContact O-CG2 3.32Å; Y155-I163 WeakPolarHBondContact O-CG2 3.25Å; Y155-L167 HydrophobicContact CD1-CB 4.14Å; Y155-L167 HydrophobicContact CD1-CD1 4.22Å; Y155-D170 HydrophobicContact CE1-CB 3.7Å; Y155-V171 HydrophobicContact CD1-CG2 3.85Å; Y155-V171 HydrophobicContact CD2-CG2 3.43Å; Y155-V171 VanDerWaalsContact CD2-CG2 3.43Å; Y155-V171 HydrophobicContact CE1-CG2 4.21Å; Y155-V171 HydrophobicContact CE2-CG2 3.84Å; Y155-V171 HydrophobicContact CG-CG2 3.44Å; Y155-V171 VanDerWaalsContact CG-CG2 3.44Å; Y155-A174 HydrophobicContact CE2-CB 4.48Å
156	D	87.8	Confident	87.8	Confident	8 Å²	8	78.1 Å²	78.1	4%	0.043	41%	0.413	C	S	.	.			trans	-112.5	74.8	174.3	178.1	12	0	0	0	109.9	F152 Q153 E158 D159 N160 G161 I163	F152-D156 HydrophobicContact CD1-CB 4.22Å; F152-D156 HydrophobicContact CE1-CB 3.92Å; F152-D156 PolarHBondContact O-N 3.2Å; F152-D156 VanDerWaalsContact O-N 3.15Å; Q153-D156 PolarHBondContact O-N 3.05Å; D156-E158 PolarHBondContact O-N 3.07Å; D156-D159 PolarHBondContact O-N 3.4Å; D156-D159 VanDerWaalsContact O-N 3.16Å; D156-D159 PolarHBondContact OD1-N 2.91Å; D156-N160 PolarHBondContact OD1-N 3.27Å; D156-N160 VanDerWaalsContact OD1-N 3.16Å; D156-N160 PolarHBondContact OD1-OD1 3.39Å; D156-N160 PolarHBondContact OD2-N 3.31Å; D156-G161 VanDerWaalsContact OD2-CA 3.27Å; D156-G161 WeakPolarHBondContact OD2-CA 3.49Å; D156-G161 PolarHBondContact OD2-N 3.33Å; D156-I163 HydrophobicContact CB-CG2 3.92Å
157	P	79.3	Confident	88.3	Confident	101 Å²	101	77.2 Å²	77.2	66%	0.656	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.9	-177.3	28.8	-36	0	0	0	112.9	Y155 D159	Y155-P157 VanDerWaalsContact C-CD 3.42Å; Y155-P157 WeakPolarHBondContact O-CD 3.21Å; P157-D159 VanDerWaalsContact C-N 3.35Å
158	E	81.2	Confident	88.6	Confident	152 Å²	152	78 Å²	78	71%	0.71	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-6.2	178.9	-62.8	-172.5	176.1	0	0	113	D156 N160	D156-E158 PolarHBondContact O-N 3.07Å; E158-N160 HydrophobicContact CB-CB 4.24Å; E158-N160 PolarHBondContact O-N 3.27Å; E158-N160 VanDerWaalsContact O-N 3.13Å; E158-N160 PolarHBondContact OE2-ND2 3.44Å
159	D	82.1	Confident	88.8	Confident	93 Å²	93	82.1 Å²	82.1	50%	0.497	43%	0.43	S	S	.	.			trans	49	34.8	-174.8	-160.7	29.4	0	0	0	112	D156 P157	D156-D159 PolarHBondContact O-N 3.4Å; D156-D159 VanDerWaalsContact O-N 3.16Å; D156-D159 PolarHBondContact OD1-N 2.91Å; P157-D159 VanDerWaalsContact C-N 3.35Å
160	N	87.3	Confident	89	Confident	75 Å²	75	78.6 Å²	78.6	40%	0.401	42%	0.422	S	S	.	.	S	Bend	trans	-95.1	-5.2	-175.1	72.5	20	0	0	0	112.4	D156 E158 F162	D156-N160 PolarHBondContact OD1-N 3.27Å; D156-N160 VanDerWaalsContact OD1-N 3.16Å; D156-N160 PolarHBondContact OD1-OD1 3.39Å; D156-N160 PolarHBondContact OD2-N 3.31Å; E158-N160 HydrophobicContact CB-CB 4.24Å; E158-N160 PolarHBondContact O-N 3.27Å; E158-N160 VanDerWaalsContact O-N 3.13Å; E158-N160 PolarHBondContact OE2-ND2 3.44Å; N160-F162 WeakPolarHBondContact O-CD2 3.45Å; N160-F162 WeakPolarHBondContact O-CE2 3.36Å; N160-F162 WeakPolarHBondContact OD1-CA 3.49Å; N160-F162 WeakPolarHBondContact OD1-CB 3.22Å; N160-F162 PolarHBondContact OD1-N 3.33Å; N160-F162 PolarHBondContact OD1-O 2.82Å
161	G	89.8	Confident	89.4	Confident	48 Å²	48	76.1 Å²	76.1	50%	0.495	41%	0.413	S	S	.	.	S	Bend	trans	87	8.7	-180	0	0	0	0	0	114.4	D156	D156-G161 VanDerWaalsContact OD2-CA 3.27Å; D156-G161 WeakPolarHBondContact OD2-CA 3.49Å; D156-G161 PolarHBondContact OD2-N 3.33Å
162	F	92.3	Very high	89.5	Confident	159 Å²	159	78.8 Å²	78.8	70%	0.697	43%	0.426	S	S	*	.			trans	-129.6	146.7	-176.4	-57.6	-85	0	0	0	111.8	N160	N160-F162 WeakPolarHBondContact O-CD2 3.45Å; N160-F162 WeakPolarHBondContact O-CE2 3.36Å; N160-F162 WeakPolarHBondContact OD1-CA 3.49Å; N160-F162 WeakPolarHBondContact OD1-CB 3.22Å; N160-F162 PolarHBondContact OD1-N 3.33Å; N160-F162 PolarHBondContact OD1-O 2.82Å
163	I	93.2	Very high	89.4	Confident	34 Å²	34	81 Å²	81	17%	0.174	44%	0.435	C	S	.	.			trans	-127.6	151.6	170.1	62.2	176.4	0	0	0	109.2	F152 Y155 D156 V171	F152-I163 HydrophobicContact CD2-CD1 4.1Å; F152-I163 HydrophobicContact CE1-CG2 4Å; F152-I163 HydrophobicContact CE2-CB 4.46Å; F152-I163 HydrophobicContact CE2-CD1 3.64Å; F152-I163 HydrophobicContact CE2-CG1 3.77Å; F152-I163 HydrophobicContact CE2-CG2 3.94Å; F152-I163 HydrophobicContact CZ-CB 4.36Å; F152-I163 HydrophobicContact CZ-CD1 4.37Å; F152-I163 HydrophobicContact CZ-CG1 4.05Å; F152-I163 HydrophobicContact CZ-CG2 3.66Å; Y155-I163 VanDerWaalsContact O-CG2 3.32Å; Y155-I163 WeakPolarHBondContact O-CG2 3.25Å; D156-I163 HydrophobicContact CB-CG2 3.92Å; I163-V171 HydrophobicContact CD1-CB 4.47Å; I163-V171 HydrophobicContact CD1-CG2 3.72Å
164	P	92.3	Very high	89.6	Confident	71 Å²	71	80.8 Å²	80.8	46%	0.461	44%	0.443	S	S	.	.			trans	-55.5	143.8	167	-23.6	33.4	0	0	0	111.4	S166 L167	P164-S166 PolarHBondContact O-N 2.85Å; P164-L167 HydrophobicContact CB-CG 4.43Å; P164-L167 HydrophobicContact CG-CD1 4.27Å; P164-L167 PolarHBondContact O-N 3.46Å
165	D	93.1	Very high	89.8	Confident	147 Å²	147	77.5 Å²	77.5	79%	0.786	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-57.2	-32.6	176.8	65.8	-46.1	0	0	0	112.1	L167 L168	D165-L167 PolarHBondContact O-N 3.13Å; D165-L168 WeakPolarHBondContact O-CB 3.48Å; D165-L168 PolarHBondContact O-N 3.45Å; D165-L168 VanDerWaalsContact O-N 3.15Å
166	S	93.8	Very high	89.8	Confident	85 Å²	85	81.5 Å²	81.5	59%	0.594	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-59	-25.4	175	62.5	0	0	0	0	114.5	P164	P164-S166 PolarHBondContact O-N 2.85Å
167	L	93.4	Very high	89.7	Confident	52 Å²	52	86 Å²	86	27%	0.272	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-92.4	-9	-179.6	-61.2	-175.4	0	0	0	113.2	Y155 P164 D165 E169 D170 V171	Y155-L167 HydrophobicContact CD1-CB 4.14Å; Y155-L167 HydrophobicContact CD1-CD1 4.22Å; P164-L167 HydrophobicContact CB-CG 4.43Å; P164-L167 HydrophobicContact CG-CD1 4.27Å; P164-L167 PolarHBondContact O-N 3.46Å; D165-L167 PolarHBondContact O-N 3.13Å; L167-E169 VanDerWaalsContact C-N 3.33Å; L167-E169 PolarHBondContact O-N 2.88Å; L167-D170 PolarHBondContact O-N 3Å; L167-V171 WeakPolarHBondContact O-CG2 3.44Å; L167-V171 PolarHBondContact O-N 3.29Å
168	L	92.1	Very high	89.8	Confident	96 Å²	96	84.7 Å²	84.7	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-61.8	-41.3	-175	-179.3	61.1	0	0	0	111.9	D165 D170 V171 M172	D165-L168 WeakPolarHBondContact O-CB 3.48Å; D165-L168 PolarHBondContact O-N 3.45Å; D165-L168 VanDerWaalsContact O-N 3.15Å; L168-D170 VanDerWaalsContact C-N 3.31Å; L168-D170 PolarHBondContact O-N 3.29Å; L168-V171 PolarHBondContact O-N 3.46Å; L168-M172 HydrophobicContact CD1-CG 4.31Å; L168-M172 HydrophobicContact CG-CG 4.46Å; L168-M172 VanDerWaalsContact O-CG 3.22Å; L168-M172 WeakPolarHBondContact O-CG 3.18Å; L168-M172 PolarHBondContact O-N 2.8Å
169	E	91.1	Very high	89	Confident	120 Å²	120	82.8 Å²	82.8	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-62.1	-40.6	178.6	-167.8	-175.9	155.1	0	0	111.6	L167 M172 K173	L167-E169 VanDerWaalsContact C-N 3.33Å; L167-E169 PolarHBondContact O-N 2.88Å; E169-M172 PolarHBondContact O-N 3.25Å; E169-K173 WeakPolarHBondContact O-CG 3.34Å; E169-K173 PolarHBondContact O-N 2.98Å; E169-K173 WeakPolarHBondContact OE1-CE 3.41Å; E169-K173 IonicContact OE1-NZ 3Å; E169-K173 PolarHBondContact OE1-NZ 2.87Å
170	D	92.4	Very high	88.2	Confident	71 Å²	71	85.5 Å²	85.5	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-67.3	-40.4	178.5	-65.6	-32.5	0	0	0	111.7	Y155 L167 L168 K173 A174	Y155-D170 HydrophobicContact CE1-CB 3.7Å; L167-D170 PolarHBondContact O-N 3Å; L168-D170 VanDerWaalsContact C-N 3.31Å; L168-D170 PolarHBondContact O-N 3.29Å; D170-K173 PolarHBondContact O-N 3.05Å; D170-A174 WeakPolarHBondContact O-CB 3.44Å; D170-A174 PolarHBondContact O-N 3.11Å
171	V	92.8	Very high	87	Confident	6 Å²	6	87.8 Å²	87.8	4%	0.036	50%	0.497	C	S	.	.	H	α-helix	trans	-60.7	-45.4	173.6	172	0	0	0	0	111	Y155 I163 L167 L168 K173 A174 L175	Y155-V171 HydrophobicContact CD1-CG2 3.85Å; Y155-V171 HydrophobicContact CD2-CG2 3.43Å; Y155-V171 VanDerWaalsContact CD2-CG2 3.43Å; Y155-V171 HydrophobicContact CE1-CG2 4.21Å; Y155-V171 HydrophobicContact CE2-CG2 3.84Å; Y155-V171 HydrophobicContact CG-CG2 3.44Å; Y155-V171 VanDerWaalsContact CG-CG2 3.44Å; I163-V171 HydrophobicContact CD1-CB 4.47Å; I163-V171 HydrophobicContact CD1-CG2 3.72Å; L167-V171 WeakPolarHBondContact O-CG2 3.44Å; L167-V171 PolarHBondContact O-N 3.29Å; L168-V171 PolarHBondContact O-N 3.46Å; V171-K173 PolarHBondContact O-N 3.1Å; V171-A174 PolarHBondContact O-N 2.87Å; V171-L175 HydrophobicContact CG1-CD1 3.98Å; V171-L175 WeakPolarHBondContact O-CG 3.39Å; V171-L175 PolarHBondContact O-N 2.86Å
172	M	92.1	Very high	85	Confident	71 Å²	71	98.4 Å²	98.4	35%	0.35	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-39.9	179.6	-67.9	-67.9	-73.8	0	0	111.6	L168 E169 L175 D176 L177	L168-M172 HydrophobicContact CD1-CG 4.31Å; L168-M172 HydrophobicContact CG-CG 4.46Å; L168-M172 VanDerWaalsContact O-CG 3.22Å; L168-M172 WeakPolarHBondContact O-CG 3.18Å; L168-M172 PolarHBondContact O-N 2.8Å; E169-M172 PolarHBondContact O-N 3.25Å; M172-L175 PolarHBondContact O-N 2.64Å; M172-D176 PolarHBondContact O-N 3.47Å; M172-L177 HydrophobicContact CE-CB 3.65Å; M172-L177 HydrophobicContact CE-CD1 4.48Å; M172-L177 WeakPolarHBondContact CE-O 3.44Å; M172-L177 PolarHBondContact O-N 3.3Å; M172-L177 HydrophobicContact SD-CB 4.11Å; M172-L177 HydrophobicContact SD-CD1 4.23Å
173	K	90.4	Very high	84.6	Confident	104 Å²	104	95.4 Å²	95.4	45%	0.452	53%	0.526	S	S	.	.	H	α-helix	trans	-63.3	-45.5	172.6	-75.3	172.6	-175	161.7	0	112	E169 D170 V171 L175 D176 V178	E169-K173 WeakPolarHBondContact O-CG 3.34Å; E169-K173 PolarHBondContact O-N 2.98Å; E169-K173 WeakPolarHBondContact OE1-CE 3.41Å; E169-K173 IonicContact OE1-NZ 3Å; E169-K173 PolarHBondContact OE1-NZ 2.87Å; D170-K173 PolarHBondContact O-N 3.05Å; V171-K173 PolarHBondContact O-N 3.1Å; K173-L175 PolarHBondContact O-N 3.41Å; K173-D176 PolarHBondContact O-N 2.9Å; K173-V178 HydrophobicContact CG-CG1 3.6Å; K173-V178 HydrophobicContact CG-CG2 4.46Å
174	A	90.4	Very high	84.1	Confident	49 Å²	49	98.6 Å²	98.6	41%	0.405	54%	0.544	S	S	.	.	H	α-helix	trans	-63.8	-25.3	178.8	0	0	0	0	0	112.9	V151 Y155 D170 V171	V151-A174 HydrophobicContact CG1-CB 3.64Å; Y155-A174 HydrophobicContact CE2-CB 4.48Å; D170-A174 WeakPolarHBondContact O-CB 3.44Å; D170-A174 PolarHBondContact O-N 3.11Å; V171-A174 PolarHBondContact O-N 2.87Å
175	L	90.6	Very high	83.7	Confident	28 Å²	28	100.2 Å²	100.2	15%	0.147	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	0.4	174.5	-72.6	170.9	0	0	0	114.7	Q147 A148 V151 V171 M172 K173 L177	Q147-L175 HydrophobicContact CG-CD2 4.3Å; A148-L175 HydrophobicContact CB-CD1 4.07Å; A148-L175 HydrophobicContact CB-CD2 4.2Å; V151-L175 HydrophobicContact CB-CD2 3.73Å; V151-L175 HydrophobicContact CB-CG 4Å; V151-L175 HydrophobicContact CG1-CD2 4.2Å; V151-L175 HydrophobicContact CG1-CG 3.93Å; V151-L175 HydrophobicContact CG2-CD2 3.63Å; V151-L175 HydrophobicContact CG2-CG 4.28Å; V171-L175 HydrophobicContact CG1-CD1 3.98Å; V171-L175 WeakPolarHBondContact O-CG 3.39Å; V171-L175 PolarHBondContact O-N 2.86Å; M172-L175 PolarHBondContact O-N 2.64Å; K173-L175 PolarHBondContact O-N 3.41Å; L175-L177 HydrophobicContact CB-CB 4.39Å; L175-L177 HydrophobicContact CB-CD1 3.72Å; L175-L177 HydrophobicContact CB-CG 3.75Å; L175-L177 HydrophobicContact CD1-CD1 4.01Å; L175-L177 HydrophobicContact CG-CD1 4.48Å; L175-L177 PolarHBondContact O-N 2.85Å
176	D	88.3	Confident	83.1	Confident	142 Å²	142	97.4 Å²	97.4	76%	0.759	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	36.5	-173.9	-159.2	34.9	0	0	0	112.2	M172 K173	M172-D176 PolarHBondContact O-N 3.47Å; K173-D176 PolarHBondContact O-N 2.9Å
177	L	86.9	Confident	82.5	Confident	101 Å²	101	98.2 Å²	98.2	53%	0.529	53%	0.531	S	S	.	.			trans	-104.4	14.2	179.6	-64.9	176.9	0	0	0	112.6	M172 L175	M172-L177 HydrophobicContact CE-CB 3.65Å; M172-L177 HydrophobicContact CE-CD1 4.48Å; M172-L177 WeakPolarHBondContact CE-O 3.44Å; M172-L177 PolarHBondContact O-N 3.3Å; M172-L177 HydrophobicContact SD-CB 4.11Å; M172-L177 HydrophobicContact SD-CD1 4.23Å; L175-L177 HydrophobicContact CB-CB 4.39Å; L175-L177 HydrophobicContact CB-CD1 3.72Å; L175-L177 HydrophobicContact CB-CG 3.75Å; L175-L177 HydrophobicContact CD1-CD1 4.01Å; L175-L177 HydrophobicContact CG-CD1 4.48Å; L175-L177 PolarHBondContact O-N 2.85Å
178	V	80.9	Confident	81.7	Confident	75 Å²	75	101.3 Å²	101.3	46%	0.455	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-77.3	132.6	175.4	-85.7	0	0	0	0	110.7	K173	K173-V178 HydrophobicContact CG-CG1 3.6Å; K173-V178 HydrophobicContact CG-CG2 4.46Å
179	S	64.7	Low	81	Confident	111 Å²	111	101.6 Å²	101.6	78%	0.776	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-73.5	140.1	165.7	36.3	0	0	0	0	110
180	D	64.3	Low	80.2	Confident	151 Å²	151	100.2 Å²	100.2	81%	0.807	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-50.2	139.1	174.5	-77.1	-42.7	0	0	0	110.5	E182	D180-E182 PolarHBondContact O-N 2.72Å
181	P	61.9	Low	79.2	Confident	123 Å²	123	102.7 Å²	102.7	80%	0.799	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-62.1	126.6	174.6	25	-31.5	0	0	0	109.8
182	E	47.3	Very low	78	Confident	271 Å²	271	111.5 Å²	111.5	100%	1.266	61%	0.613	S	S	*	*			trans	-60.8	0	170.4	-73.7	-170.8	159.2	0	0	112.6	D180	D180-E182 PolarHBondContact O-N 2.72Å

Retrieved 182 of 182 residues in 62.8 ms (Link to these results)

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