G4VLF9_SCHMA Loading...

Ribonuclease P protein component 4

AlphaFold DB , UniProt , Accession G4VLF9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 140 aa.

						>G4VLF9_SCHMA|G4VLF9
MTKKKYSTNNVTHFSPIHHHMNLLYQQISLFMNLKPTLQNEAFTALLCRTTSQNLQILGKKSQTRLSFAIRRSLCTKCLVPLQLWGKVRVRKRHIHLSCALCNHRSIISYPVNKWHASYSESVLPDSLCCNENIEKSNNE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.4	Very low	49.8	Very low	243 Å²	243	162.1 Å²	162.1	100%	1.197	82%	0.821	S	S	*	*				0	100.7	0	-79.7	176.6	144.8	0	0	109.5	K3	M1-K3 PolarHBondContact O-N 3.4Å
2	T	45.5	Very low	50.5	Low	147 Å²	147	158 Å²	158	90%	0.902	81%	0.81	S	S	*	*			trans	-80.3	104	178.2	36.4	0	0	0	0	109.8	K4	T2-K4 PolarHBondContact O-N 3.14Å; T2-K4 VanDerWaalsContact O-N 3.13Å
3	K	47	Very low	51.3	Low	206 Å²	206	158.7 Å²	158.7	90%	0.896	81%	0.807	S	S	*	*			trans	-62.3	111.2	171.6	-75.8	179.8	175.4	178.3	0	108.8	M1 K5	M1-K3 PolarHBondContact O-N 3.4Å; K3-K5 PolarHBondContact O-N 3.38Å; K3-K5 VanDerWaalsContact O-N 3.11Å
4	K	55.6	Low	52.6	Low	176 Å²	176	158.1 Å²	158.1	77%	0.765	80%	0.797	S	S	*	*			trans	-60.6	111.8	166.1	-82.9	178.6	175.6	175.6	0	107.9	T2 Y6	T2-K4 PolarHBondContact O-N 3.14Å; T2-K4 VanDerWaalsContact O-N 3.13Å; K4-Y6 HydrophobicContact CB-CE2 4.48Å; K4-Y6 PolarHBondContact O-N 2.81Å
5	K	49.1	Very low	54.7	Low	209 Å²	209	150.4 Å²	150.4	91%	0.909	76%	0.763	S	S	*	*			trans	-65.2	97.5	166.2	-91.1	-179.7	171.5	178.6	0	107.8	K3 S7	K3-K5 PolarHBondContact O-N 3.38Å; K3-K5 VanDerWaalsContact O-N 3.11Å; K5-S7 PolarHBondContact O-N 2.99Å; K5-S7 VanDerWaalsContact O-N 3.14Å
6	Y	54.9	Low	56.8	Low	186 Å²	186	147.3 Å²	147.3	73%	0.729	76%	0.756	S	S	*	*			trans	-69.1	104.6	158.3	-75.8	-80.1	0	0	0	106.7	K4 T8	K4-Y6 HydrophobicContact CB-CE2 4.48Å; K4-Y6 PolarHBondContact O-N 2.81Å; Y6-T8 PolarHBondContact O-N 2.84Å
7	S	50.5	Low	58.9	Low	83 Å²	83	141.9 Å²	141.9	58%	0.58	73%	0.729	S	S	*	*			trans	-60.6	106.7	168.9	148.4	0	0	0	0	107.9	K5 N9	K5-S7 PolarHBondContact O-N 2.99Å; K5-S7 VanDerWaalsContact O-N 3.14Å; S7-N9 PolarHBondContact O-N 3.47Å; S7-N9 WeakPolarHBondContact OG-CB 3.45Å; S7-N9 VanDerWaalsContact OG-CG 3.29Å; S7-N9 PolarHBondContact OG-N 3.19Å; S7-N9 PolarHBondContact OG-ND2 3.27Å
8	T	52.4	Low	60.6	Low	134 Å²	134	138.9 Å²	138.9	82%	0.822	71%	0.711	S	S	*	*			trans	-72.3	43.3	168	46.5	0	0	0	0	111.5	Y6 N10	Y6-T8 PolarHBondContact O-N 2.84Å; T8-N10 PolarHBondContact O-N 3.44Å
9	N	48.9	Very low	62.2	Low	122 Å²	122	137.3 Å²	137.3	65%	0.652	70%	0.7	S	S	*	*			trans	-79.5	108.3	167.6	-75.6	-6.8	0	0	0	106.3	S7 V11	S7-N9 PolarHBondContact O-N 3.47Å; S7-N9 WeakPolarHBondContact OG-CB 3.45Å; S7-N9 VanDerWaalsContact OG-CG 3.29Å; S7-N9 PolarHBondContact OG-N 3.19Å; S7-N9 PolarHBondContact OG-ND2 3.27Å; N9-V11 WeakPolarHBondContact O-CG2 3.47Å; N9-V11 PolarHBondContact O-N 3.3Å
10	N	46.8	Very low	63.7	Low	148 Å²	148	135.3 Å²	135.3	79%	0.791	69%	0.687	S	S	*	*			trans	-43.5	99.3	169.9	-73.4	-26.1	0	0	0	110	T8 T12	T8-N10 PolarHBondContact O-N 3.44Å; N10-T12 PolarHBondContact O-N 2.98Å
11	V	54.4	Low	65.2	Low	129 Å²	129	129.3 Å²	129.3	78%	0.782	66%	0.657	S	S	*	*			trans	-79.5	68.3	-179.8	-170.7	0	0	0	0	108.4	N9	N9-V11 WeakPolarHBondContact O-CG2 3.47Å; N9-V11 PolarHBondContact O-N 3.3Å
12	T	58.1	Low	67.5	Low	113 Å²	113	121 Å²	121	69%	0.693	62%	0.618	S	S	*	*			trans	-108.9	-1.9	172.6	53	0	0	0	0	112.8	N10 F14	N10-T12 PolarHBondContact O-N 2.98Å; T12-F14 VanDerWaalsContact C-N 3.31Å; T12-F14 PolarHBondContact O-N 2.7Å
13	H	61	Low	69.9	Low	167 Å²	167	117.9 Å²	117.9	77%	0.773	60%	0.595	S	S	*	*			trans	-84	75.4	174.8	-159.5	-78.8	0	0	0	111.1	S15	H13-S15 PolarHBondContact O-N 2.99Å
14	F	69.5	Low	72.2	Confident	151 Å²	151	108.8 Å²	108.8	66%	0.662	56%	0.556	S	S	*	*			trans	-64.2	128.3	168.6	-66.1	-77	0	0	0	109.3	T12	T12-F14 VanDerWaalsContact C-N 3.31Å; T12-F14 PolarHBondContact O-N 2.7Å
15	S	84.1	Confident	74	Confident	42 Å²	42	103.6 Å²	103.6	29%	0.294	53%	0.532	S	S	.	.			trans	-57.8	140	172.3	150.9	0	0	0	0	109.5	H13 I17 H18 H19	H13-S15 PolarHBondContact O-N 2.99Å; S15-I17 PolarHBondContact O-N 3.2Å; S15-I17 PolarHBondContact OG-N 2.96Å; S15-H18 WeakPolarHBondContact O-CB 3.16Å; S15-H18 PolarHBondContact O-N 3.17Å; S15-H19 PolarHBondContact O-N 3.37Å
16	P	89.3	Confident	76.2	Confident	100 Å²	100	98.2 Å²	98.2	65%	0.649	51%	0.51	S	S	*	.	H	α-helix	trans	-50.7	-29.9	-179.9	-29.1	34.7	0	0	0	113.8	H19 H20	P16-H19 PolarHBondContact O-N 3.4Å; P16-H20 PolarHBondContact O-N 2.99Å
17	I	91.8	Very high	78.1	Confident	56 Å²	56	93.2 Å²	93.2	29%	0.287	49%	0.493	S	S	.	.	H	α-helix	trans	-64.3	-43.4	176.1	-65.4	153.7	0	0	0	111.5	S15 H19 H20 M21 S62 T64	S15-I17 PolarHBondContact O-N 3.2Å; S15-I17 PolarHBondContact OG-N 2.96Å; I17-H19 VanDerWaalsContact C-N 3.31Å; I17-H19 PolarHBondContact O-N 3.39Å; I17-H20 PolarHBondContact O-N 3.07Å; I17-M21 HydrophobicContact CG2-CE 4.21Å; I17-M21 WeakPolarHBondContact O-CG 3.33Å; I17-M21 PolarHBondContact O-N 2.89Å; I17-S62 WeakPolarHBondContact CG2-OG 3.34Å; I17-T64 HydrophobicContact CG2-CG2 4.01Å
18	H	89.5	Confident	80.2	Confident	88 Å²	88	89.3 Å²	89.3	41%	0.407	47%	0.466	S	S	.	.	H	α-helix	trans	-66.9	-36.9	178	-66.7	85	0	0	0	111.1	S15 M21 N22	S15-H18 WeakPolarHBondContact O-CB 3.16Å; S15-H18 PolarHBondContact O-N 3.17Å; H18-M21 PolarHBondContact O-N 3.27Å; H18-N22 WeakPolarHBondContact O-CB 2.87Å; H18-N22 PolarHBondContact O-N 3.46Å
19	H	90.1	Very high	82.2	Confident	108 Å²	108	85 Å²	85	50%	0.5	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-47.4	172.6	-174.6	73.9	0	0	0	111.1	S15 P16 I17 M21 N22 L23	S15-H19 PolarHBondContact O-N 3.37Å; P16-H19 PolarHBondContact O-N 3.4Å; I17-H19 VanDerWaalsContact C-N 3.31Å; I17-H19 PolarHBondContact O-N 3.39Å; H19-M21 PolarHBondContact O-N 2.92Å; H19-N22 WeakPolarHBondContact O-CB 3.18Å; H19-N22 PolarHBondContact O-N 3.27Å; H19-N22 VanDerWaalsContact O-N 3.13Å; H19-L23 WeakPolarHBondContact O-CG 3.44Å; H19-L23 PolarHBondContact O-N 3.18Å
20	H	93.8	Very high	84.3	Confident	98 Å²	98	84.3 Å²	84.3	45%	0.454	44%	0.437	S	S	.	.	H	α-helix	trans	-61	-43.4	176.9	-163.8	129.3	0	0	0	111.9	P16 I17 N22 L23 L24 L58	P16-H20 PolarHBondContact O-N 2.99Å; I17-H20 PolarHBondContact O-N 3.07Å; H20-N22 VanDerWaalsContact C-N 3.29Å; H20-N22 PolarHBondContact O-N 3.29Å; H20-L23 PolarHBondContact O-N 2.97Å; H20-L24 PolarHBondContact O-N 3.22Å; H20-L58 HydrophobicContact CB-CD2 4.01Å
21	M	93.6	Very high	86.5	Confident	9 Å²	9	78.7 Å²	78.7	4%	0.044	41%	0.406	C	S	.	.	H	α-helix	trans	-58.6	-42	173.9	-74.4	-174.3	168.7	0	0	112.4	I17 H18 H19 L24 Y25 L55 L58 T64 L66	I17-M21 HydrophobicContact CG2-CE 4.21Å; I17-M21 WeakPolarHBondContact O-CG 3.33Å; I17-M21 PolarHBondContact O-N 2.89Å; H18-M21 PolarHBondContact O-N 3.27Å; H19-M21 PolarHBondContact O-N 2.92Å; M21-L24 PolarHBondContact O-N 3.04Å; M21-Y25 PolarHBondContact O-N 3.26Å; M21-L55 HydrophobicContact CB-CD1 3.7Å; M21-L55 HydrophobicContact CG-CD1 3.79Å; M21-L55 WeakPolarHBondContact O-CD1 3.42Å; M21-L58 HydrophobicContact CE-CG 4.32Å; M21-L58 HydrophobicContact CG-CD2 3.8Å; M21-L58 HydrophobicContact CG-CG 4.4Å; M21-T64 WeakPolarHBondContact CE-OG1 3.28Å; M21-L66 HydrophobicContact CE-CD2 3.93Å; M21-L66 HydrophobicContact SD-CD2 3.84Å
22	N	92.1	Very high	88.2	Confident	70 Å²	70	73.4 Å²	73.4	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-42.7	176.8	-176.6	61.6	0	0	0	111.7	H18 H19 H20 L24 Y25 Q26	H18-N22 WeakPolarHBondContact O-CB 2.87Å; H18-N22 PolarHBondContact O-N 3.46Å; H19-N22 WeakPolarHBondContact O-CB 3.18Å; H19-N22 PolarHBondContact O-N 3.27Å; H19-N22 VanDerWaalsContact O-N 3.13Å; H20-N22 VanDerWaalsContact C-N 3.29Å; H20-N22 PolarHBondContact O-N 3.29Å; N22-L24 PolarHBondContact O-N 3.46Å; N22-Y25 PolarHBondContact O-N 3.01Å; N22-Q26 PolarHBondContact ND2-NE2 2.91Å; N22-Q26 VanDerWaalsContact ND2-NE2 3.15Å; N22-Q26 WeakPolarHBondContact O-CG 3.49Å; N22-Q26 PolarHBondContact O-N 3.18Å
23	L	94.8	Very high	89.6	Confident	80 Å²	80	72.8 Å²	72.8	42%	0.419	37%	0.365	S	S	.	.	H	α-helix	trans	-59.8	-45.6	175.9	-70	177.1	0	0	0	111.9	H19 H20 Y25 Q26 Q27	H19-L23 WeakPolarHBondContact O-CG 3.44Å; H19-L23 PolarHBondContact O-N 3.18Å; H20-L23 PolarHBondContact O-N 2.97Å; L23-Y25 VanDerWaalsContact C-N 3.29Å; L23-Y25 PolarHBondContact O-N 3.41Å; L23-Q26 PolarHBondContact O-N 3.4Å; L23-Q27 WeakPolarHBondContact O-CB 3.36Å; L23-Q27 PolarHBondContact O-N 3.45Å
24	L	95.9	Very high	90.9	Very high	16 Å²	16	68.7 Å²	68.7	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-39.7	175.6	-72	172.2	0	0	0	111.7	H20 M21 N22 Q27 I28 T51 N54 L55 L58	H20-L24 PolarHBondContact O-N 3.22Å; M21-L24 PolarHBondContact O-N 3.04Å; N22-L24 PolarHBondContact O-N 3.46Å; L24-Q27 WeakPolarHBondContact O-CB 3.41Å; L24-Q27 PolarHBondContact O-N 3.43Å; L24-I28 WeakPolarHBondContact O-CG1 3.48Å; L24-I28 PolarHBondContact O-N 3.02Å; L24-I28 VanDerWaalsContact O-N 3.11Å; L24-T51 HydrophobicContact CB-CG2 4.3Å; L24-T51 HydrophobicContact CD2-CG2 3.97Å; L24-T51 WeakPolarHBondContact O-CG2 3.44Å; L24-N54 HydrophobicContact CD1-CB 4.46Å; L24-N54 HydrophobicContact CD2-CB 4.49Å; L24-L55 HydrophobicContact CB-CB 4.38Å; L24-L55 HydrophobicContact CB-CD1 4.14Å; L24-L55 HydrophobicContact CD1-CB 4.22Å; L24-L55 HydrophobicContact CD1-CD1 4.22Å; L24-L58 HydrophobicContact CD1-CD2 3.99Å
25	Y	94.6	Very high	91.5	Very high	67 Å²	67	64.4 Å²	64.4	26%	0.263	33%	0.329	S	S	.	.	H	α-helix	trans	-67.5	-40.6	176.3	-173	-107.5	0	0	0	112.7	M21 N22 L23 Q27 I28 S29 I70 S73	M21-Y25 PolarHBondContact O-N 3.26Å; N22-Y25 PolarHBondContact O-N 3.01Å; L23-Y25 VanDerWaalsContact C-N 3.29Å; L23-Y25 PolarHBondContact O-N 3.41Å; Y25-Q27 VanDerWaalsContact C-N 3.32Å; Y25-Q27 PolarHBondContact O-N 2.99Å; Y25-I28 WeakPolarHBondContact O-CB 3.32Å; Y25-I28 PolarHBondContact O-N 3.46Å; Y25-S29 PolarHBondContact O-N 2.91Å; Y25-S29 VanDerWaalsContact O-N 3.14Å; Y25-I70 HydrophobicContact CD1-CG1 4.34Å; Y25-I70 HydrophobicContact CD2-CB 4.42Å; Y25-I70 HydrophobicContact CD2-CD1 4.29Å; Y25-I70 HydrophobicContact CD2-CG1 3.75Å; Y25-I70 HydrophobicContact CD2-CG2 4.14Å; Y25-I70 HydrophobicContact CE2-CB 4.46Å; Y25-I70 HydrophobicContact CE2-CG1 3.97Å; Y25-I70 HydrophobicContact CE2-CG2 4.42Å; Y25-I70 HydrophobicContact CG-CD1 4.13Å; Y25-I70 HydrophobicContact CG-CG1 3.94Å; Y25-S73 WeakPolarHBondContact CE2-OG 3.24Å; Y25-S73 PolarHBondContact OH-OG 3.36Å
26	Q	94.6	Very high	91.2	Very high	95 Å²	95	67.1 Å²	67.1	44%	0.444	35%	0.346	S	S	.	.	H	α-helix	trans	-63.2	-39.2	173.6	-72.7	175.3	-17.8	0	0	111.5	N22 L23 I28 S29 L30	N22-Q26 PolarHBondContact ND2-NE2 2.91Å; N22-Q26 VanDerWaalsContact ND2-NE2 3.15Å; N22-Q26 WeakPolarHBondContact O-CG 3.49Å; N22-Q26 PolarHBondContact O-N 3.18Å; L23-Q26 PolarHBondContact O-N 3.4Å; Q26-I28 VanDerWaalsContact C-N 3.33Å; Q26-I28 PolarHBondContact O-N 3.47Å; Q26-S29 WeakPolarHBondContact O-CA 3.28Å; Q26-S29 VanDerWaalsContact O-CB 3.3Å; Q26-S29 WeakPolarHBondContact O-CB 3.46Å; Q26-S29 PolarHBondContact O-N 3.07Å; Q26-S29 VanDerWaalsContact O-N 3.09Å; Q26-L30 WeakPolarHBondContact O-CG 3.24Å; Q26-L30 PolarHBondContact O-N 3.43Å
27	Q	95.3	Very high	90.7	Very high	81 Å²	81	67.1 Å²	67.1	38%	0.379	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-40.9	175.4	-170.1	-179.3	10.8	0	0	111.9	L23 L24 Y25 S29 L30 F31 T51	L23-Q27 WeakPolarHBondContact O-CB 3.36Å; L23-Q27 PolarHBondContact O-N 3.45Å; L24-Q27 WeakPolarHBondContact O-CB 3.41Å; L24-Q27 PolarHBondContact O-N 3.43Å; Y25-Q27 VanDerWaalsContact C-N 3.32Å; Y25-Q27 PolarHBondContact O-N 2.99Å; Q27-S29 VanDerWaalsContact C-N 3.32Å; Q27-S29 PolarHBondContact O-N 2.74Å; Q27-L30 WeakPolarHBondContact O-CB 3.44Å; Q27-L30 PolarHBondContact O-N 3.11Å; Q27-F31 HydrophobicContact CG-CD2 4.32Å; Q27-F31 HydrophobicContact CG-CE1 4.22Å; Q27-F31 HydrophobicContact CG-CE2 3.6Å; Q27-F31 HydrophobicContact CG-CZ 3.55Å; Q27-F31 WeakPolarHBondContact O-CD2 3.41Å; Q27-F31 WeakPolarHBondContact O-CG 3.49Å; Q27-F31 PolarHBondContact O-N 3.46Å; Q27-T51 HydrophobicContact CB-CG2 4.3Å; Q27-T51 HydrophobicContact CG-CG2 4.43Å
28	I	94.6	Very high	90	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-45.4	172.1	-67.4	165.4	0	0	0	110.8	L24 Y25 Q26 L30 F31 M32 T51 S52 L55 P81	L24-I28 WeakPolarHBondContact O-CG1 3.48Å; L24-I28 PolarHBondContact O-N 3.02Å; L24-I28 VanDerWaalsContact O-N 3.11Å; Y25-I28 WeakPolarHBondContact O-CB 3.32Å; Y25-I28 PolarHBondContact O-N 3.46Å; Q26-I28 VanDerWaalsContact C-N 3.33Å; Q26-I28 PolarHBondContact O-N 3.47Å; I28-L30 VanDerWaalsContact C-N 3.34Å; I28-L30 PolarHBondContact O-N 3.29Å; I28-F31 PolarHBondContact O-N 3.4Å; I28-M32 HydrophobicContact CG2-CE 4.3Å; I28-M32 WeakPolarHBondContact O-CG 3.32Å; I28-M32 PolarHBondContact O-N 3.49Å; I28-T51 HydrophobicContact CD1-CG2 4.14Å; I28-T51 HydrophobicContact CG1-CG2 3.6Å; I28-S52 WeakPolarHBondContact CD1-OG 3.44Å; I28-L55 HydrophobicContact CD1-CD2 4.49Å; I28-P81 HydrophobicContact CG2-CB 4.37Å; I28-P81 HydrophobicContact CG2-CG 3.26Å
29	S	92.8	Very high	89.4	Confident	44 Å²	44	72 Å²	72	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-59.4	-43.7	176.9	-167.2	0	0	0	0	112.2	Y25 Q26 Q27 F31 M32 N33	Y25-S29 PolarHBondContact O-N 2.91Å; Y25-S29 VanDerWaalsContact O-N 3.14Å; Q26-S29 WeakPolarHBondContact O-CA 3.28Å; Q26-S29 VanDerWaalsContact O-CB 3.3Å; Q26-S29 WeakPolarHBondContact O-CB 3.46Å; Q26-S29 PolarHBondContact O-N 3.07Å; Q26-S29 VanDerWaalsContact O-N 3.09Å; Q27-S29 VanDerWaalsContact C-N 3.32Å; Q27-S29 PolarHBondContact O-N 2.74Å; S29-F31 PolarHBondContact O-N 2.85Å; S29-M32 PolarHBondContact O-N 3.09Å; S29-N33 VanDerWaalsContact O-CG 3.28Å; S29-N33 PolarHBondContact O-N 3.46Å; S29-N33 PolarHBondContact O-ND2 3.36Å
30	L	93.5	Very high	89.2	Confident	107 Å²	107	70.7 Å²	70.7	56%	0.56	37%	0.365	S	S	*	.	H	α-helix	trans	-59.7	-45.5	175.4	-69.9	172.2	0	0	0	111.8	Q26 Q27 I28 M32 N33 L34	Q26-L30 WeakPolarHBondContact O-CG 3.24Å; Q26-L30 PolarHBondContact O-N 3.43Å; Q27-L30 WeakPolarHBondContact O-CB 3.44Å; Q27-L30 PolarHBondContact O-N 3.11Å; I28-L30 VanDerWaalsContact C-N 3.34Å; I28-L30 PolarHBondContact O-N 3.29Å; L30-M32 VanDerWaalsContact C-N 3.32Å; L30-M32 PolarHBondContact O-N 3.14Å; L30-N33 PolarHBondContact O-N 3.1Å; L30-L34 WeakPolarHBondContact O-CG 3.38Å; L30-L34 PolarHBondContact O-N 3.28Å
31	F	92.7	Very high	88.7	Confident	31 Å²	31	70.2 Å²	70.2	14%	0.136	36%	0.363	C	S	.	.	H	α-helix	trans	-61.4	-39.6	176.6	-62.3	-32.4	0	0	0	112.8	Q27 I28 S29 N33 L34 K35 T44 L47 T51	Q27-F31 HydrophobicContact CG-CD2 4.32Å; Q27-F31 HydrophobicContact CG-CE1 4.22Å; Q27-F31 HydrophobicContact CG-CE2 3.6Å; Q27-F31 HydrophobicContact CG-CZ 3.55Å; Q27-F31 WeakPolarHBondContact O-CD2 3.41Å; Q27-F31 WeakPolarHBondContact O-CG 3.49Å; Q27-F31 PolarHBondContact O-N 3.46Å; I28-F31 PolarHBondContact O-N 3.4Å; S29-F31 PolarHBondContact O-N 2.85Å; F31-N33 VanDerWaalsContact C-N 3.34Å; F31-L34 PolarHBondContact O-N 3.4Å; F31-K35 PolarHBondContact O-N 3.15Å; F31-T44 VanDerWaalsContact O-CG2 3.24Å; F31-T44 WeakPolarHBondContact O-CG2 3.38Å; F31-L47 HydrophobicContact CD1-CD1 4.07Å; F31-L47 HydrophobicContact CD2-CB 3.78Å; F31-L47 HydrophobicContact CE1-CD1 4.11Å; F31-L47 HydrophobicContact CE2-CB 3.92Å; F31-L47 HydrophobicContact CG-CB 4.11Å; F31-L47 HydrophobicContact CG-CD1 4.37Å; F31-L47 HydrophobicContact CZ-CB 4.37Å; F31-L47 HydrophobicContact CZ-CD1 4.42Å; F31-T51 WeakPolarHBondContact CE2-OG1 3.3Å
32	M	89.6	Confident	88.4	Confident	17 Å²	17	73.3 Å²	73.3	8%	0.084	39%	0.39	C	S	.	.	H	α-helix	trans	-63.9	-40.2	175	-66.2	-170	-64.6	0	0	112	I28 S29 L30 L34 K35 P81 Q83 L84	I28-M32 HydrophobicContact CG2-CE 4.3Å; I28-M32 WeakPolarHBondContact O-CG 3.32Å; I28-M32 PolarHBondContact O-N 3.49Å; S29-M32 PolarHBondContact O-N 3.09Å; L30-M32 VanDerWaalsContact C-N 3.32Å; L30-M32 PolarHBondContact O-N 3.14Å; M32-L34 VanDerWaalsContact C-N 3.28Å; M32-L34 PolarHBondContact O-N 2.71Å; M32-K35 WeakPolarHBondContact O-CB 3.42Å; M32-K35 PolarHBondContact O-N 3.47Å; M32-P81 HydrophobicContact CE-CB 4.36Å; M32-P81 HydrophobicContact SD-CB 3.45Å; M32-P81 WeakPolarHBondContact SD-CB 3.24Å; M32-P81 HydrophobicContact SD-CG 3.86Å; M32-Q83 HydrophobicContact CE-CB 4.38Å; M32-Q83 HydrophobicContact SD-CB 3.9Å; M32-Q83 HydrophobicContact SD-CG 4.29Å; M32-L84 HydrophobicContact CB-CD1 4.38Å; M32-L84 HydrophobicContact CG-CD1 4.16Å; M32-L84 HydrophobicContact SD-CB 4.3Å
33	N	89.5	Confident	88.3	Confident	101 Å²	101	74.5 Å²	74.5	54%	0.54	39%	0.392	S	S	.	.	H	α-helix	trans	-69.7	-25.7	177.8	-67.4	-19.4	0	0	0	113	S29 L30 F31 K35 P36	S29-N33 VanDerWaalsContact O-CG 3.28Å; S29-N33 PolarHBondContact O-N 3.46Å; S29-N33 PolarHBondContact O-ND2 3.36Å; L30-N33 PolarHBondContact O-N 3.1Å; F31-N33 VanDerWaalsContact C-N 3.34Å; N33-K35 VanDerWaalsContact C-N 3.34Å; N33-P36 WeakPolarHBondContact O-CD 3.48Å
34	L	87.1	Confident	88.1	Confident	81 Å²	81	70.7 Å²	70.7	42%	0.424	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.5	174	-66.7	172.2	0	0	0	113.5	L30 F31 M32 T37 L38	L30-L34 WeakPolarHBondContact O-CG 3.38Å; L30-L34 PolarHBondContact O-N 3.28Å; F31-L34 PolarHBondContact O-N 3.4Å; M32-L34 VanDerWaalsContact C-N 3.28Å; M32-L34 PolarHBondContact O-N 2.71Å; L34-T37 WeakPolarHBondContact CA-OG1 3.45Å; L34-T37 PolarHBondContact O-N 2.76Å; L34-T37 VanDerWaalsContact O-N 3.14Å; L34-T37 PolarHBondContact O-OG1 2.84Å; L34-L38 HydrophobicContact CB-CD1 4.11Å; L34-L38 HydrophobicContact CB-CG 4.42Å; L34-L38 WeakPolarHBondContact O-CG 3.22Å; L34-L38 PolarHBondContact O-N 2.9Å
35	K	81.8	Confident	87.8	Confident	60 Å²	60	70.3 Å²	70.3	26%	0.261	37%	0.371	S	S	.	.	H	α-helix	trans	-48.4	-50.3	173.7	-179.9	-179.6	172	173.9	0	113.5	F31 M32 N33 T37 Q39 E41 T44 L84	F31-K35 PolarHBondContact O-N 3.15Å; M32-K35 WeakPolarHBondContact O-CB 3.42Å; M32-K35 PolarHBondContact O-N 3.47Å; N33-K35 VanDerWaalsContact C-N 3.34Å; K35-T37 VanDerWaalsContact C-N 3.29Å; K35-T37 PolarHBondContact O-N 3.19Å; K35-Q39 PolarHBondContact O-N 3.35Å; K35-E41 WeakPolarHBondContact CE-OE1 2.95Å; K35-E41 IonicContact NZ-OE1 2.7Å; K35-E41 PolarHBondContact NZ-OE1 2.95Å; K35-T44 HydrophobicContact CB-CG2 4.35Å; K35-L84 HydrophobicContact CB-CD1 4.44Å; K35-L84 HydrophobicContact CD-CD1 3.59Å; K35-L84 HydrophobicContact CG-CD1 4.46Å
36	P	77.3	Confident	87.7	Confident	100 Å²	100	72 Å²	72	65%	0.649	38%	0.384	S	S	*	.	H	α-helix	trans	-65.5	-29.4	-178.9	24.6	-35.2	0	0	0	113.4	N33	N33-P36 WeakPolarHBondContact O-CD 3.48Å
37	T	80.8	Confident	87.6	Confident	99 Å²	99	69.7 Å²	69.7	61%	0.607	37%	0.374	S	S	*	.	H	α-helix	trans	-82.3	-37.4	-178.4	50.3	0	0	0	0	112.5	L34 K35 Q39	L34-T37 WeakPolarHBondContact CA-OG1 3.45Å; L34-T37 PolarHBondContact O-N 2.76Å; L34-T37 VanDerWaalsContact O-N 3.14Å; L34-T37 PolarHBondContact O-OG1 2.84Å; K35-T37 VanDerWaalsContact C-N 3.29Å; K35-T37 PolarHBondContact O-N 3.19Å; T37-Q39 VanDerWaalsContact C-N 3.28Å; T37-Q39 PolarHBondContact O-N 2.8Å
38	L	75.6	Confident	87.6	Confident	68 Å²	68	65.8 Å²	65.8	36%	0.356	36%	0.356	S	S	.	.	H	α-helix	trans	-71.6	-22.3	-179	-71.6	168.2	0	0	0	113.2	L34 N40 F43	L34-L38 HydrophobicContact CB-CD1 4.11Å; L34-L38 HydrophobicContact CB-CG 4.42Å; L34-L38 WeakPolarHBondContact O-CG 3.22Å; L34-L38 PolarHBondContact O-N 2.9Å; L38-N40 PolarHBondContact O-N 2.94Å; L38-F43 HydrophobicContact CD1-CD1 4.35Å
39	Q	78.1	Confident	87.5	Confident	178 Å²	178	71.4 Å²	71.4	83%	0.832	38%	0.377	S	S	*	.			trans	49.6	14.2	-175.4	-61.4	-176	-5.2	0	0	114.8	K35 T37	K35-Q39 PolarHBondContact O-N 3.35Å; T37-Q39 VanDerWaalsContact C-N 3.28Å; T37-Q39 PolarHBondContact O-N 2.8Å
40	N	84.7	Confident	87.7	Confident	81 Å²	81	72 Å²	72	43%	0.433	38%	0.38	S	S	.	.			trans	-129.9	87.9	-176.5	-172.1	-24.9	0	0	0	109	L38 A42 F43 T44	L38-N40 PolarHBondContact O-N 2.94Å; N40-A42 PolarHBondContact O-N 3.27Å; N40-A42 PolarHBondContact OD1-N 3.42Å; N40-F43 HydrophobicContact CB-CB 3.98Å; N40-F43 VanDerWaalsContact CG-CB 3.49Å; N40-F43 PolarHBondContact O-N 2.9Å; N40-F43 PolarHBondContact OD1-N 3.06Å; N40-T44 PolarHBondContact O-N 3.45Å; N40-T44 PolarHBondContact O-OG1 3.39Å
41	E	84.7	Confident	87.8	Confident	89 Å²	89	67.4 Å²	67.4	42%	0.416	36%	0.356	S	S	.	.	H	α-helix	trans	-63	-32.3	-175.8	-50.5	-166.7	131.7	0	0	112.5	K35 A45 W85	K35-E41 WeakPolarHBondContact CE-OE1 2.95Å; K35-E41 IonicContact NZ-OE1 2.7Å; K35-E41 PolarHBondContact NZ-OE1 2.95Å; E41-A45 VanDerWaalsContact O-CB 3.28Å; E41-A45 WeakPolarHBondContact O-CB 3.35Å; E41-A45 PolarHBondContact O-N 3.05Å; E41-W85 HydrophobicContact CB-CH2 4.3Å; E41-W85 HydrophobicContact CB-CZ2 3.82Å; E41-W85 WeakPolarHBondContact OE2-CH2 3.22Å
42	A	86.8	Confident	88	Confident	74 Å²	74	66 Å²	66	61%	0.612	35%	0.349	S	S	*	.	H	α-helix	trans	-66.3	-42.7	178	0	0	0	0	0	111.2	N40 A45 L46	N40-A42 PolarHBondContact O-N 3.27Å; N40-A42 PolarHBondContact OD1-N 3.42Å; A42-A45 PolarHBondContact O-N 3.28Å; A42-L46 WeakPolarHBondContact O-CB 3.45Å; A42-L46 PolarHBondContact O-N 3.04Å
43	F	90.4	Very high	88.3	Confident	94 Å²	94	68.5 Å²	68.5	41%	0.412	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-46.2	175.7	-176	-110.3	0	0	0	111.7	L38 N40 A45 L46 L47	L38-F43 HydrophobicContact CD1-CD1 4.35Å; N40-F43 HydrophobicContact CB-CB 3.98Å; N40-F43 VanDerWaalsContact CG-CB 3.49Å; N40-F43 PolarHBondContact O-N 2.9Å; N40-F43 PolarHBondContact OD1-N 3.06Å; F43-A45 VanDerWaalsContact C-N 3.32Å; F43-A45 PolarHBondContact O-N 2.98Å; F43-L46 WeakPolarHBondContact O-CB 3.43Å; F43-L46 PolarHBondContact O-N 3.24Å; F43-L47 HydrophobicContact CD1-CD1 4.02Å; F43-L47 HydrophobicContact CD1-CG 4.46Å; F43-L47 HydrophobicContact CE1-CD1 3.53Å; F43-L47 HydrophobicContact CE1-CG 4.11Å; F43-L47 HydrophobicContact CE2-CD2 4.5Å; F43-L47 HydrophobicContact CE2-CG 4.49Å; F43-L47 HydrophobicContact CZ-CD1 3.93Å; F43-L47 HydrophobicContact CZ-CD2 4.14Å; F43-L47 HydrophobicContact CZ-CG 4.12Å; F43-L47 PolarHBondContact O-N 2.91Å
44	T	89.9	Confident	88.6	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-59.3	-43.3	174.8	-54	0	0	0	0	111.7	F31 K35 N40 L46 L47 C48 L84	F31-T44 VanDerWaalsContact O-CG2 3.24Å; F31-T44 WeakPolarHBondContact O-CG2 3.38Å; K35-T44 HydrophobicContact CB-CG2 4.35Å; N40-T44 PolarHBondContact O-N 3.45Å; N40-T44 PolarHBondContact O-OG1 3.39Å; T44-L46 VanDerWaalsContact C-N 3.31Å; T44-L46 PolarHBondContact O-N 3.48Å; T44-L47 PolarHBondContact O-N 2.89Å; T44-C48 WeakPolarHBondContact O-CB 3.41Å; T44-C48 PolarHBondContact O-N 3.23Å; T44-C48 PolarHBondContact O-SG 3.39Å; T44-C48 VanDerWaalsContact O-SG 3.36Å; T44-L84 HydrophobicContact CG2-CD2 4.24Å
45	A	89.1	Confident	89	Confident	9 Å²	9	63.6 Å²	63.6	7%	0.074	34%	0.335	C	S	.	.	H	α-helix	trans	-62.7	-38.2	177.2	0	0	0	0	0	112.2	E41 A42 F43 R49	E41-A45 VanDerWaalsContact O-CB 3.28Å; E41-A45 WeakPolarHBondContact O-CB 3.35Å; E41-A45 PolarHBondContact O-N 3.05Å; A42-A45 PolarHBondContact O-N 3.28Å; F43-A45 VanDerWaalsContact C-N 3.32Å; F43-A45 PolarHBondContact O-N 2.98Å; A45-R49 VanDerWaalsContact O-CB 3.24Å; A45-R49 WeakPolarHBondContact O-CB 3.49Å; A45-R49 PolarHBondContact O-N 3.17Å
46	L	92.1	Very high	89.6	Confident	101 Å²	101	64.1 Å²	64.1	53%	0.529	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-49.3	175.1	-178	64.4	0	0	0	111.5	A42 F43 T44 C48 R49 T50	A42-L46 WeakPolarHBondContact O-CB 3.45Å; A42-L46 PolarHBondContact O-N 3.04Å; F43-L46 WeakPolarHBondContact O-CB 3.43Å; F43-L46 PolarHBondContact O-N 3.24Å; T44-L46 VanDerWaalsContact C-N 3.31Å; T44-L46 PolarHBondContact O-N 3.48Å; L46-C48 PolarHBondContact O-N 3.48Å; L46-R49 PolarHBondContact O-N 3.01Å; L46-T50 PolarHBondContact O-N 3.24Å; L46-T50 PolarHBondContact O-OG1 2.77Å; L46-T50 VanDerWaalsContact O-OG1 3.07Å
47	L	93.9	Very high	90.5	Very high	47 Å²	47	63.1 Å²	63.1	25%	0.246	33%	0.327	C	S	.	.	H	α-helix	trans	-58.2	-47.5	177.6	-70.1	179.9	0	0	0	112	F31 F43 T44 R49 T50 T51	F31-L47 HydrophobicContact CD1-CD1 4.07Å; F31-L47 HydrophobicContact CD2-CB 3.78Å; F31-L47 HydrophobicContact CE1-CD1 4.11Å; F31-L47 HydrophobicContact CE2-CB 3.92Å; F31-L47 HydrophobicContact CG-CB 4.11Å; F31-L47 HydrophobicContact CG-CD1 4.37Å; F31-L47 HydrophobicContact CZ-CB 4.37Å; F31-L47 HydrophobicContact CZ-CD1 4.42Å; F43-L47 HydrophobicContact CD1-CD1 4.02Å; F43-L47 HydrophobicContact CD1-CG 4.46Å; F43-L47 HydrophobicContact CE1-CD1 3.53Å; F43-L47 HydrophobicContact CE1-CG 4.11Å; F43-L47 HydrophobicContact CE2-CD2 4.5Å; F43-L47 HydrophobicContact CE2-CG 4.49Å; F43-L47 HydrophobicContact CZ-CD1 3.93Å; F43-L47 HydrophobicContact CZ-CD2 4.14Å; F43-L47 HydrophobicContact CZ-CG 4.12Å; F43-L47 PolarHBondContact O-N 2.91Å; T44-L47 PolarHBondContact O-N 2.89Å; L47-R49 VanDerWaalsContact C-N 3.34Å; L47-R49 PolarHBondContact O-N 3.36Å; L47-T50 PolarHBondContact O-N 3.49Å; L47-T51 WeakPolarHBondContact O-CB 3.45Å; L47-T51 PolarHBondContact O-N 2.83Å; L47-T51 PolarHBondContact O-OG1 2.84Å
48	C	94.1	Very high	91.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-45.2	175.8	-73.2	0	0	0	0	111.4	T44 L46 T51 S52 P81	T44-C48 WeakPolarHBondContact O-CB 3.41Å; T44-C48 PolarHBondContact O-N 3.23Å; T44-C48 PolarHBondContact O-SG 3.39Å; T44-C48 VanDerWaalsContact O-SG 3.36Å; L46-C48 PolarHBondContact O-N 3.48Å; C48-T51 PolarHBondContact O-N 3.28Å; C48-S52 WeakPolarHBondContact O-CB 3.32Å; C48-S52 PolarHBondContact O-N 2.84Å; C48-S52 PolarHBondContact O-OG 2.78Å; C48-P81 HydrophobicContact CB-CG 4.2Å
49	R	94	Very high	92	Very high	118 Å²	118	57.3 Å²	57.3	45%	0.445	30%	0.295	S	S	.	.	H	α-helix	trans	-61.9	-48.7	179.6	-178.6	176.1	178.7	-174.2	-0.5	111.9	A45 L46 L47 T51 S52 Q53 V80	A45-R49 VanDerWaalsContact O-CB 3.24Å; A45-R49 WeakPolarHBondContact O-CB 3.49Å; A45-R49 PolarHBondContact O-N 3.17Å; L46-R49 PolarHBondContact O-N 3.01Å; L47-R49 VanDerWaalsContact C-N 3.34Å; L47-R49 PolarHBondContact O-N 3.36Å; R49-T51 VanDerWaalsContact C-N 3.29Å; R49-T51 PolarHBondContact O-N 2.99Å; R49-S52 PolarHBondContact O-N 2.76Å; R49-Q53 WeakPolarHBondContact O-CB 3.49Å; R49-Q53 WeakPolarHBondContact O-CG 3.44Å; R49-Q53 PolarHBondContact O-N 3.34Å; R49-V80 HydrophobicContact CB-CG2 4Å
50	T	95.7	Very high	92.8	Very high	58 Å²	58	56 Å²	56	36%	0.356	29%	0.286	S	S	.	.	H	α-helix	trans	-59.9	-42.8	179.1	-59.1	0	0	0	0	110.9	L46 L47 Q53 N54	L46-T50 PolarHBondContact O-N 3.24Å; L46-T50 PolarHBondContact O-OG1 2.77Å; L46-T50 VanDerWaalsContact O-OG1 3.07Å; L47-T50 PolarHBondContact O-N 3.49Å; T50-Q53 WeakPolarHBondContact O-CB 3.37Å; T50-Q53 PolarHBondContact O-N 3Å; T50-N54 PolarHBondContact O-N 3.34Å
51	T	96.2	Very high	93.3	Very high	9 Å²	9	60.3 Å²	60.3	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-69	-41.3	-179.8	-49.6	0	0	0	0	111.8	L24 Q27 I28 F31 L47 C48 R49 Q53 N54 L55	L24-T51 HydrophobicContact CB-CG2 4.3Å; L24-T51 HydrophobicContact CD2-CG2 3.97Å; L24-T51 WeakPolarHBondContact O-CG2 3.44Å; Q27-T51 HydrophobicContact CB-CG2 4.3Å; Q27-T51 HydrophobicContact CG-CG2 4.43Å; I28-T51 HydrophobicContact CD1-CG2 4.14Å; I28-T51 HydrophobicContact CG1-CG2 3.6Å; F31-T51 WeakPolarHBondContact CE2-OG1 3.3Å; L47-T51 WeakPolarHBondContact O-CB 3.45Å; L47-T51 PolarHBondContact O-N 2.83Å; L47-T51 PolarHBondContact O-OG1 2.84Å; C48-T51 PolarHBondContact O-N 3.28Å; R49-T51 VanDerWaalsContact C-N 3.29Å; R49-T51 PolarHBondContact O-N 2.99Å; T51-Q53 VanDerWaalsContact C-N 3.32Å; T51-Q53 PolarHBondContact O-N 2.87Å; T51-N54 PolarHBondContact O-N 2.92Å; T51-L55 WeakPolarHBondContact O-CB 3.38Å; T51-L55 PolarHBondContact O-N 2.86Å
52	S	95.8	Very high	93.7	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-36.4	172.6	-65.2	0	0	0	0	112.9	I28 C48 R49 L55 Q56 L74 L79	I28-S52 WeakPolarHBondContact CD1-OG 3.44Å; C48-S52 WeakPolarHBondContact O-CB 3.32Å; C48-S52 PolarHBondContact O-N 2.84Å; C48-S52 PolarHBondContact O-OG 2.78Å; R49-S52 PolarHBondContact O-N 2.76Å; S52-L55 PolarHBondContact O-N 3.39Å; S52-Q56 PolarHBondContact O-N 2.84Å; S52-L74 WeakPolarHBondContact OG-CD2 3.43Å; S52-L79 WeakPolarHBondContact CB-O 3.03Å; S52-L79 PolarHBondContact OG-O 2.65Å
53	Q	96.2	Very high	94	Very high	70 Å²	70	62.7 Å²	62.7	33%	0.327	30%	0.303	S	S	.	.	H	α-helix	trans	-64.1	-45.9	173.5	-77.2	173.9	-26.4	0	0	111.1	R49 T50 T51 L55 Q56 I57 L79	R49-Q53 WeakPolarHBondContact O-CB 3.49Å; R49-Q53 WeakPolarHBondContact O-CG 3.44Å; R49-Q53 PolarHBondContact O-N 3.34Å; T50-Q53 WeakPolarHBondContact O-CB 3.37Å; T50-Q53 PolarHBondContact O-N 3Å; T51-Q53 VanDerWaalsContact C-N 3.32Å; T51-Q53 PolarHBondContact O-N 2.87Å; Q53-L55 VanDerWaalsContact C-N 3.29Å; Q53-L55 PolarHBondContact O-N 3.42Å; Q53-Q56 PolarHBondContact O-N 2.87Å; Q53-I57 WeakPolarHBondContact O-CB 3.39Å; Q53-I57 VanDerWaalsContact O-CG1 3.27Å; Q53-I57 WeakPolarHBondContact O-CG1 3.46Å; Q53-I57 PolarHBondContact O-N 2.75Å; Q53-L79 HydrophobicContact CG-CD1 3.65Å
54	N	96.2	Very high	94	Very high	79 Å²	79	59.4 Å²	59.4	42%	0.422	29%	0.291	S	S	.	.	H	α-helix	trans	-58.9	-42	175.2	-71.3	-17.4	0	0	0	111.6	L24 T50 T51 Q56 I57 L58	L24-N54 HydrophobicContact CD1-CB 4.46Å; L24-N54 HydrophobicContact CD2-CB 4.49Å; T50-N54 PolarHBondContact O-N 3.34Å; T51-N54 PolarHBondContact O-N 2.92Å; N54-Q56 PolarHBondContact O-N 2.82Å; N54-I57 PolarHBondContact O-N 3.33Å; N54-L58 VanDerWaalsContact O-CB 3.28Å; N54-L58 WeakPolarHBondContact O-CB 3.09Å; N54-L58 PolarHBondContact O-N 3.47Å
55	L	95.8	Very high	93.9	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-43.7	175.8	-177.7	60.7	0	0	0	112.1	M21 L24 I28 T51 S52 Q53 G59 L66 I70	M21-L55 HydrophobicContact CB-CD1 3.7Å; M21-L55 HydrophobicContact CG-CD1 3.79Å; M21-L55 WeakPolarHBondContact O-CD1 3.42Å; L24-L55 HydrophobicContact CB-CB 4.38Å; L24-L55 HydrophobicContact CB-CD1 4.14Å; L24-L55 HydrophobicContact CD1-CB 4.22Å; L24-L55 HydrophobicContact CD1-CD1 4.22Å; I28-L55 HydrophobicContact CD1-CD2 4.49Å; T51-L55 WeakPolarHBondContact O-CB 3.38Å; T51-L55 PolarHBondContact O-N 2.86Å; S52-L55 PolarHBondContact O-N 3.39Å; Q53-L55 VanDerWaalsContact C-N 3.29Å; Q53-L55 PolarHBondContact O-N 3.42Å; L55-G59 PolarHBondContact O-N 3.28Å; L55-G59 VanDerWaalsContact O-N 3.12Å; L55-L66 HydrophobicContact CD1-CD2 3.77Å; L55-L66 HydrophobicContact CD2-CD2 4.4Å; L55-L66 HydrophobicContact CG-CD1 4.33Å; L55-L66 HydrophobicContact CG-CD2 3.71Å; L55-I70 HydrophobicContact CD2-CG2 3.58Å
56	Q	94.5	Very high	93.8	Very high	72 Å²	72	70.9 Å²	70.9	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-67.5	-42.1	176.6	-166.9	-173.6	30.2	0	0	112.2	S52 Q53 N54 G59 K60	S52-Q56 PolarHBondContact O-N 2.84Å; Q53-Q56 PolarHBondContact O-N 2.87Å; N54-Q56 PolarHBondContact O-N 2.82Å; Q56-G59 PolarHBondContact O-N 2.84Å; Q56-K60 WeakPolarHBondContact O-CG 3.43Å; Q56-K60 PolarHBondContact O-N 3.18Å
57	I	95.6	Very high	93.5	Very high	78 Å²	78	68.9 Å²	68.9	40%	0.4	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-46	177.6	-70.5	165.6	0	0	0	110	Q53 N54 G59 K60 K61	Q53-I57 WeakPolarHBondContact O-CB 3.39Å; Q53-I57 VanDerWaalsContact O-CG1 3.27Å; Q53-I57 WeakPolarHBondContact O-CG1 3.46Å; Q53-I57 PolarHBondContact O-N 2.75Å; N54-I57 PolarHBondContact O-N 3.33Å; I57-G59 PolarHBondContact O-N 3.01Å; I57-K60 PolarHBondContact O-N 3.37Å; I57-K61 HydrophobicContact CG2-CD 3.94Å; I57-K61 HydrophobicContact CG2-CG 4.22Å; I57-K61 WeakPolarHBondContact O-CB 3.49Å; I57-K61 WeakPolarHBondContact O-CG 3.36Å; I57-K61 PolarHBondContact O-N 2.94Å
58	L	95.2	Very high	93	Very high	38 Å²	38	69.8 Å²	69.8	20%	0.199	33%	0.33	C	S	.	.	H	α-helix	trans	-55.2	-52.9	176.8	-179.7	61.5	0	0	0	109.9	H20 M21 L24 N54 K60 K61 S62	H20-L58 HydrophobicContact CB-CD2 4.01Å; M21-L58 HydrophobicContact CE-CG 4.32Å; M21-L58 HydrophobicContact CG-CD2 3.8Å; M21-L58 HydrophobicContact CG-CG 4.4Å; L24-L58 HydrophobicContact CD1-CD2 3.99Å; N54-L58 VanDerWaalsContact O-CB 3.28Å; N54-L58 WeakPolarHBondContact O-CB 3.09Å; N54-L58 PolarHBondContact O-N 3.47Å; L58-K60 VanDerWaalsContact C-N 3.3Å; L58-K60 PolarHBondContact O-N 3.43Å; L58-K61 PolarHBondContact O-N 2.88Å; L58-K61 VanDerWaalsContact O-N 3.1Å; L58-S62 PolarHBondContact O-N 3.42Å; L58-S62 PolarHBondContact O-OG 3.4Å
59	G	93.9	Very high	92.5	Very high	8 Å²	8	72.8 Å²	72.8	8%	0.082	36%	0.355	C	S	.	.	H	α-helix	trans	-61.5	-33.8	179.5	0	0	0	0	0	114.9	L55 Q56 I57 Q63 T64	L55-G59 PolarHBondContact O-N 3.28Å; L55-G59 VanDerWaalsContact O-N 3.12Å; Q56-G59 PolarHBondContact O-N 2.84Å; I57-G59 PolarHBondContact O-N 3.01Å; G59-Q63 CarbonylContact O-C 3.54Å; G59-Q63 WeakPolarHBondContact O-CA 3.45Å; G59-Q63 PolarHBondContact O-N 2.89Å; G59-Q63 VanDerWaalsContact O-N 3.15Å; G59-T64 CarbonylContact C-O 3.44Å; G59-T64 WeakPolarHBondContact CA-O 3.31Å; G59-T64 PolarHBondContact O-N 3.16Å; G59-T64 VanDerWaalsContact O-O 3.05Å
60	K	94.2	Very high	92.3	Very high	150 Å²	150	68 Å²	68	65%	0.652	34%	0.338	S	S	*	.	H	α-helix	trans	-67.6	-47.2	172	-73.7	177.9	177.6	-179.1	0	111.7	Q56 I57 L58 Q63	Q56-K60 WeakPolarHBondContact O-CG 3.43Å; Q56-K60 PolarHBondContact O-N 3.18Å; I57-K60 PolarHBondContact O-N 3.37Å; L58-K60 VanDerWaalsContact C-N 3.3Å; L58-K60 PolarHBondContact O-N 3.43Å; K60-Q63 PolarHBondContact O-N 3.13Å
61	K	95.6	Very high	92	Very high	171 Å²	171	70.3 Å²	70.3	74%	0.743	34%	0.341	S	S	*	.	H	α-helix	trans	-65.4	-41.1	-177.7	-76.1	-173.8	174.4	-173.8	0	112.6	I57 L58 Q63	I57-K61 HydrophobicContact CG2-CD 3.94Å; I57-K61 HydrophobicContact CG2-CG 4.22Å; I57-K61 WeakPolarHBondContact O-CB 3.49Å; I57-K61 WeakPolarHBondContact O-CG 3.36Å; I57-K61 PolarHBondContact O-N 2.94Å; L58-K61 PolarHBondContact O-N 2.88Å; L58-K61 VanDerWaalsContact O-N 3.1Å; K61-Q63 VanDerWaalsContact C-N 3.3Å
62	S	93.4	Very high	91.5	Very high	33 Å²	33	74.8 Å²	74.8	23%	0.231	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	0.8	178.3	54.9	0	0	0	0	113.9	I17 L58 T64	I17-S62 WeakPolarHBondContact CG2-OG 3.34Å; L58-S62 PolarHBondContact O-N 3.42Å; L58-S62 PolarHBondContact O-OG 3.4Å; S62-T64 PolarHBondContact O-N 3.5Å; S62-T64 VanDerWaalsContact O-N 3.09Å; S62-T64 PolarHBondContact OG-OG1 3.36Å
63	Q	92.5	Very high	91.3	Very high	180 Å²	180	76.1 Å²	76.1	84%	0.841	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	23.9	-174.3	-55.1	-179.4	-1.7	0	0	113.9	G59 K60 K61	G59-Q63 CarbonylContact O-C 3.54Å; G59-Q63 WeakPolarHBondContact O-CA 3.45Å; G59-Q63 PolarHBondContact O-N 2.89Å; G59-Q63 VanDerWaalsContact O-N 3.15Å; K60-Q63 PolarHBondContact O-N 3.13Å; K61-Q63 VanDerWaalsContact C-N 3.3Å
64	T	89.6	Confident	91.2	Very high	26 Å²	26	73.4 Å²	73.4	16%	0.16	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-100.5	128.8	178.9	51.5	0	0	0	0	110.3	I17 M21 G59 S62	I17-T64 HydrophobicContact CG2-CG2 4.01Å; M21-T64 WeakPolarHBondContact CE-OG1 3.28Å; G59-T64 CarbonylContact C-O 3.44Å; G59-T64 WeakPolarHBondContact CA-O 3.31Å; G59-T64 PolarHBondContact O-N 3.16Å; G59-T64 VanDerWaalsContact O-O 3.05Å; S62-T64 PolarHBondContact O-N 3.5Å; S62-T64 VanDerWaalsContact O-N 3.09Å; S62-T64 PolarHBondContact OG-OG1 3.36Å
65	R	88.4	Confident	91	Very high	225 Å²	225	69.8 Å²	69.8	85%	0.849	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-74.2	138.3	178.6	-64.5	-180	177.4	-175	-1	110.6
66	L	88.1	Confident	90.8	Very high	25 Å²	25	74.2 Å²	74.2	13%	0.131	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-65.1	143.1	168.3	-62	-179.8	0	0	0	110.4	M21 L55 I70 R71	M21-L66 HydrophobicContact CE-CD2 3.93Å; M21-L66 HydrophobicContact SD-CD2 3.84Å; L55-L66 HydrophobicContact CD1-CD2 3.77Å; L55-L66 HydrophobicContact CD2-CD2 4.4Å; L55-L66 HydrophobicContact CG-CD1 4.33Å; L55-L66 HydrophobicContact CG-CD2 3.71Å; L66-I70 HydrophobicContact CB-CG2 4.42Å; L66-I70 HydrophobicContact CD1-CG2 4.24Å; L66-R71 HydrophobicContact CB-CG 3.66Å; L66-R71 HydrophobicContact CD1-CG 4.36Å; L66-R71 PolarHBondContact O-NE 3.01Å
67	S	84.6	Confident	90.8	Very high	59 Å²	59	77.8 Å²	77.8	41%	0.413	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-56.8	151.1	174.3	74	0	0	0	0	110.7	A69 I70 R71	S67-A69 PolarHBondContact O-N 2.86Å; S67-I70 PolarHBondContact O-N 2.95Å; S67-I70 WeakPolarHBondContact OG-CD1 3.33Å; S67-I70 VanDerWaalsContact OG-CG1 3.26Å; S67-I70 WeakPolarHBondContact OG-CG1 3.42Å; S67-I70 PolarHBondContact OG-N 3.27Å; S67-R71 WeakPolarHBondContact O-CG 3.44Å; S67-R71 PolarHBondContact O-N 3Å
68	F	83.1	Confident	90.7	Very high	65 Å²	65	74.8 Å²	74.8	29%	0.285	36%	0.362	S	S	.	.	H	α-helix	trans	-62.2	-34.4	178.9	-79.4	-96.1	0	0	0	112	R71 R72 S120	F68-R71 PolarHBondContact O-N 3.32Å; F68-R72 WeakPolarHBondContact O-CB 3.13Å; F68-R72 VanDerWaalsContact O-CG 3.31Å; F68-R72 WeakPolarHBondContact O-CG 3.47Å; F68-R72 PolarHBondContact O-N 3.31Å; F68-S120 WeakPolarHBondContact CD2-OG 3.27Å; F68-S120 WeakPolarHBondContact CE2-OG 3.48Å
69	A	84	Confident	90.6	Very high	64 Å²	64	74.1 Å²	74.1	53%	0.529	36%	0.358	S	S	.	.	H	α-helix	trans	-57.8	-51.3	174.9	0	0	0	0	0	111.7	S67 R71 R72 S73	S67-A69 PolarHBondContact O-N 2.86Å; A69-R71 PolarHBondContact O-N 3.38Å; A69-R72 PolarHBondContact O-N 3.03Å; A69-S73 WeakPolarHBondContact O-CB 3.26Å; A69-S73 PolarHBondContact O-N 3.3Å; A69-S73 PolarHBondContact O-OG 3.35Å
70	I	89.7	Confident	90.5	Very high	17 Å²	17	73.8 Å²	73.8	9%	0.087	35%	0.354	C	S	.	.	H	α-helix	trans	-61.4	-45.1	177	-67.4	172.6	0	0	0	110.6	Y25 L55 L66 S67 R72 S73 L74	Y25-I70 HydrophobicContact CD1-CG1 4.34Å; Y25-I70 HydrophobicContact CD2-CB 4.42Å; Y25-I70 HydrophobicContact CD2-CD1 4.29Å; Y25-I70 HydrophobicContact CD2-CG1 3.75Å; Y25-I70 HydrophobicContact CD2-CG2 4.14Å; Y25-I70 HydrophobicContact CE2-CB 4.46Å; Y25-I70 HydrophobicContact CE2-CG1 3.97Å; Y25-I70 HydrophobicContact CE2-CG2 4.42Å; Y25-I70 HydrophobicContact CG-CD1 4.13Å; Y25-I70 HydrophobicContact CG-CG1 3.94Å; L55-I70 HydrophobicContact CD2-CG2 3.58Å; L66-I70 HydrophobicContact CB-CG2 4.42Å; L66-I70 HydrophobicContact CD1-CG2 4.24Å; S67-I70 PolarHBondContact O-N 2.95Å; S67-I70 WeakPolarHBondContact OG-CD1 3.33Å; S67-I70 VanDerWaalsContact OG-CG1 3.26Å; S67-I70 WeakPolarHBondContact OG-CG1 3.42Å; S67-I70 PolarHBondContact OG-N 3.27Å; I70-R72 VanDerWaalsContact C-N 3.31Å; I70-R72 PolarHBondContact O-N 3.46Å; I70-S73 PolarHBondContact O-N 3.32Å; I70-S73 PolarHBondContact O-OG 2.87Å; I70-L74 HydrophobicContact CG2-CD1 4.21Å; I70-L74 WeakPolarHBondContact O-CG 3.46Å; I70-L74 PolarHBondContact O-N 2.85Å
71	R	89	Confident	90.4	Very high	107 Å²	107	66.9 Å²	66.9	40%	0.404	33%	0.325	S	S	.	.	H	α-helix	trans	-64.4	-35.4	-179.4	-72.3	-173.1	-73.2	152.9	1.9	113	L66 S67 F68 A69	L66-R71 HydrophobicContact CB-CG 3.66Å; L66-R71 HydrophobicContact CD1-CG 4.36Å; L66-R71 PolarHBondContact O-NE 3.01Å; S67-R71 WeakPolarHBondContact O-CG 3.44Å; S67-R71 PolarHBondContact O-N 3Å; F68-R71 PolarHBondContact O-N 3.32Å; A69-R71 PolarHBondContact O-N 3.38Å
72	R	86.7	Confident	90.3	Very high	103 Å²	103	59.8 Å²	59.8	39%	0.389	30%	0.295	S	S	.	.	H	α-helix	trans	-76.3	-27.6	177.6	-74.9	177.2	177	155	-0.1	112.6	F68 A69 I70 E121	F68-R72 WeakPolarHBondContact O-CB 3.13Å; F68-R72 VanDerWaalsContact O-CG 3.31Å; F68-R72 WeakPolarHBondContact O-CG 3.47Å; F68-R72 PolarHBondContact O-N 3.31Å; A69-R72 PolarHBondContact O-N 3.03Å; I70-R72 VanDerWaalsContact C-N 3.31Å; I70-R72 PolarHBondContact O-N 3.46Å; R72-E121 IonicContact CZ-OE1 3.92Å; R72-E121 IonicContact NH1-OE1 2.82Å; R72-E121 PolarHBondContact NH1-OE1 3.45Å; R72-E121 IonicContact NH1-OE2 3.56Å
73	S	91.2	Very high	90.1	Very high	29 Å²	29	65.1 Å²	65.1	20%	0.203	32%	0.316	C	S	.	.	H	α-helix	trans	-79.8	-17.8	-179.8	66.4	0	0	0	0	113.5	Y25 A69 I70 P81 L82	Y25-S73 WeakPolarHBondContact CE2-OG 3.24Å; Y25-S73 PolarHBondContact OH-OG 3.36Å; A69-S73 WeakPolarHBondContact O-CB 3.26Å; A69-S73 PolarHBondContact O-N 3.3Å; A69-S73 PolarHBondContact O-OG 3.35Å; I70-S73 PolarHBondContact O-N 3.32Å; I70-S73 PolarHBondContact O-OG 2.87Å; S73-P81 CarbonylContact O-C 3.58Å; S73-P81 WeakPolarHBondContact O-CA 3.48Å; S73-L82 PolarHBondContact O-N 3.31Å
74	L	93.2	Very high	89.7	Confident	12 Å²	12	57.8 Å²	57.8	6%	0.063	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-99.7	146.9	178.4	-58.8	-179.7	0	0	0	112.1	S52 I70 T76 P81	S52-L74 WeakPolarHBondContact OG-CD2 3.43Å; I70-L74 HydrophobicContact CG2-CD1 4.21Å; I70-L74 WeakPolarHBondContact O-CG 3.46Å; I70-L74 PolarHBondContact O-N 2.85Å; L74-T76 PolarHBondContact O-N 2.84Å; L74-P81 HydrophobicContact CD2-CB 4.24Å; L74-P81 HydrophobicContact CD2-CG 3.87Å
75	C	93.6	Very high	89.5	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.027	29%	0.286	C	S	.	.			trans	-65.8	127	168	-179.4	0	0	0	0	110.1	K77 C78 L79 V80 L82 C99 C102	C75-K77 PolarHBondContact O-N 2.72Å; C75-K77 VanDerWaalsContact O-N 3.16Å; C75-K77 PolarHBondContact SG-N 2.82Å; C75-C78 VanDerWaalsContact CB-SG 3.57Å; C75-C78 VanDerWaalsContact SG-SG 3.61Å; C75-L79 WeakPolarHBondContact O-CA 3.31Å; C75-L79 PolarHBondContact O-N 3.12Å; C75-V80 WeakPolarHBondContact CB-O 3.34Å; C75-V80 PolarHBondContact N-O 3.16Å; C75-L82 HydrophobicContact CB-CD2 4.02Å; C75-C99 HydrophobicContact CB-CB 4.11Å; C75-C99 VanDerWaalsContact SG-CB 3.59Å; C75-C102 VanDerWaalsContact SG-SG 3.61Å
76	T	91.7	Very high	89.5	Confident	92 Å²	92	50 Å²	50	56%	0.564	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.2	178.5	48	0	0	0	0	114.2	L74 H104	L74-T76 PolarHBondContact O-N 2.84Å; T76-H104 PolarHBondContact OG1-CD2 3.39Å; T76-H104 PolarHBondContact OG1-NE2 2.96Å
77	K	93.6	Very high	89.7	Confident	148 Å²	148	54.8 Å²	54.8	64%	0.643	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-57.5	-179.1	-170.4	176.3	-177.4	-178.9	0	113	C75 H104	C75-K77 PolarHBondContact O-N 2.72Å; C75-K77 VanDerWaalsContact O-N 3.16Å; C75-K77 PolarHBondContact SG-N 2.82Å; K77-H104 HydrophobicContact CB-CB 3.85Å; K77-H104 HydrophobicContact CD-CB 4.05Å
78	C	92.6	Very high	89.9	Confident	15 Å²	15	56.3 Å²	56.3	10%	0.101	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-5.1	-175.2	67	0	0	0	0	114.3	C75 V80 C102	C75-C78 VanDerWaalsContact CB-SG 3.57Å; C75-C78 VanDerWaalsContact SG-SG 3.61Å; C78-V80 PolarHBondContact O-N 2.79Å; C78-C102 HydrophobicContact CB-CB 3.94Å
79	L	93.2	Very high	90.3	Very high	24 Å²	24	60.1 Å²	60.1	13%	0.126	30%	0.298	C	S	.	.			trans	62.4	7.2	-179.9	-53.4	172.8	0	0	0	115.3	S52 Q53 C75	S52-L79 WeakPolarHBondContact CB-O 3.03Å; S52-L79 PolarHBondContact OG-O 2.65Å; Q53-L79 HydrophobicContact CG-CD1 3.65Å; C75-L79 WeakPolarHBondContact O-CA 3.31Å; C75-L79 PolarHBondContact O-N 3.12Å
80	V	92.3	Very high	90.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.3	C	S	.	.			trans	-73.8	139.7	173.2	175.3	0	0	0	0	109.6	R49 C75 C78 L82 L84 L101	R49-V80 HydrophobicContact CB-CG2 4Å; C75-V80 WeakPolarHBondContact CB-O 3.34Å; C75-V80 PolarHBondContact N-O 3.16Å; C78-V80 PolarHBondContact O-N 2.79Å; V80-L82 PolarHBondContact O-N 2.84Å; V80-L84 HydrophobicContact CG1-CD2 4.46Å; V80-L101 HydrophobicContact CB-CD2 4.28Å; V80-L101 HydrophobicContact CG1-CD2 4.43Å; V80-L101 HydrophobicContact CG2-CD2 3.66Å
81	P	93.2	Very high	90.3	Very high	5 Å²	5	67.7 Å²	67.7	3%	0.032	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-56.6	130.1	175.5	-25.6	34.5	0	0	0	112.4	I28 M32 C48 S73 L74 Q83 L84 W85	I28-P81 HydrophobicContact CG2-CB 4.37Å; I28-P81 HydrophobicContact CG2-CG 3.26Å; M32-P81 HydrophobicContact CE-CB 4.36Å; M32-P81 HydrophobicContact SD-CB 3.45Å; M32-P81 WeakPolarHBondContact SD-CB 3.24Å; M32-P81 HydrophobicContact SD-CG 3.86Å; C48-P81 HydrophobicContact CB-CG 4.2Å; S73-P81 CarbonylContact O-C 3.58Å; S73-P81 WeakPolarHBondContact O-CA 3.48Å; L74-P81 HydrophobicContact CD2-CB 4.24Å; L74-P81 HydrophobicContact CD2-CG 3.87Å; P81-Q83 PolarHBondContact O-N 3.4Å; P81-L84 PolarHBondContact O-N 3.46Å; P81-L84 VanDerWaalsContact O-N 3.1Å; P81-W85 PolarHBondContact O-N 3.27Å
82	L	91.9	Very high	90	Very high	23 Å²	23	72.1 Å²	72.1	12%	0.12	34%	0.344	C	S	.	.	H	α-helix	trans	-68.3	-15.1	174.7	-65.5	176.3	0	0	0	112.1	S73 C75 V80 L84 G86 L97 C99	S73-L82 PolarHBondContact O-N 3.31Å; C75-L82 HydrophobicContact CB-CD2 4.02Å; V80-L82 PolarHBondContact O-N 2.84Å; L82-L84 VanDerWaalsContact C-N 3.27Å; L82-L84 PolarHBondContact O-N 3.29Å; L82-G86 WeakPolarHBondContact O-CA 3.4Å; L82-G86 PolarHBondContact O-N 3.23Å; L82-L97 HydrophobicContact CD1-CB 4.22Å; L82-L97 HydrophobicContact CD1-CD1 4Å; L82-L97 HydrophobicContact CD1-CG 4.49Å; L82-C99 HydrophobicContact CD2-CB 4.02Å
83	Q	89.4	Confident	89.8	Confident	145 Å²	145	74.3 Å²	74.3	68%	0.678	35%	0.352	S	S	*	.	H	α-helix	trans	-66.7	-31	170.1	-175.7	174	-11.7	0	0	112.2	M32 P81	M32-Q83 HydrophobicContact CE-CB 4.38Å; M32-Q83 HydrophobicContact SD-CB 3.9Å; M32-Q83 HydrophobicContact SD-CG 4.29Å; P81-Q83 PolarHBondContact O-N 3.4Å
84	L	84.1	Confident	89.6	Confident	25 Å²	25	76.2 Å²	76.2	13%	0.131	36%	0.358	C	S	.	.	H	α-helix	trans	-84.8	-41.7	-176.3	-163.6	71	0	0	0	112.5	M32 K35 T44 V80 P81 L82	M32-L84 HydrophobicContact CB-CD1 4.38Å; M32-L84 HydrophobicContact CG-CD1 4.16Å; M32-L84 HydrophobicContact SD-CB 4.3Å; K35-L84 HydrophobicContact CB-CD1 4.44Å; K35-L84 HydrophobicContact CD-CD1 3.59Å; K35-L84 HydrophobicContact CG-CD1 4.46Å; T44-L84 HydrophobicContact CG2-CD2 4.24Å; V80-L84 HydrophobicContact CG1-CD2 4.46Å; P81-L84 PolarHBondContact O-N 3.46Å; P81-L84 VanDerWaalsContact O-N 3.1Å; L82-L84 VanDerWaalsContact C-N 3.27Å; L82-L84 PolarHBondContact O-N 3.29Å
85	W	85.2	Confident	89.3	Confident	60 Å²	60	78.1 Å²	78.1	23%	0.227	37%	0.368	C	S	.	.	H	α-helix	trans	-135.8	16	-172.5	-64	93	0	0	0	112.9	E41 P81 C99 A100 L101	E41-W85 HydrophobicContact CB-CH2 4.3Å; E41-W85 HydrophobicContact CB-CZ2 3.82Å; E41-W85 WeakPolarHBondContact OE2-CH2 3.22Å; P81-W85 PolarHBondContact O-N 3.27Å; W85-C99 CarbonylContact O-C 3.59Å; W85-A100 HydrophobicContact CB-CB 4.41Å; W85-A100 HydrophobicContact CE3-CB 4.34Å; W85-A100 VanDerWaalsContact O-CB 3.22Å; W85-A100 WeakPolarHBondContact O-CB 3.43Å; W85-A100 PolarHBondContact O-N 3.43Å; W85-L101 HydrophobicContact CB-CB 4.31Å; W85-L101 HydrophobicContact CG-CB 4.32Å
86	G	88.9	Confident	89.2	Confident	27 Å²	27	80.6 Å²	80.6	28%	0.278	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	147.6	-179	0	0	0	0	0	112.1	L82 S98	L82-G86 WeakPolarHBondContact O-CA 3.4Å; L82-G86 PolarHBondContact O-N 3.23Å; G86-S98 CarbonylContact C-O 3.56Å; G86-S98 WeakPolarHBondContact CA-O 3.34Å
87	K	92.1	Very high	89.2	Confident	127 Å²	127	77.1 Å²	77.1	55%	0.552	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	126	162.2	-55.9	179.1	-179.1	179.6	0	108	S98	K87-S98 WeakPolarHBondContact CB-OG 3.27Å; K87-S98 PolarHBondContact N-O 2.99Å; K87-S98 PolarHBondContact O-N 3.04Å; K87-S98 PolarHBondContact O-OG 3.44Å
88	V	90	Very high	89.2	Confident	91 Å²	91	71.5 Å²	71.5	55%	0.552	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.6	175.4	-173.8	0	0	0	0	108	I95 H96 L97	V88-I95 HydrophobicContact CG1-CG2 3.75Å; V88-H96 CarbonylContact C-O 3.55Å; V88-H96 WeakPolarHBondContact CA-O 3.32Å; V88-L97 HydrophobicContact CB-CD2 4.15Å; V88-L97 HydrophobicContact CG1-CD2 3.88Å; V88-L97 HydrophobicContact CG2-CD2 3.58Å
89	R	91	Very high	89.3	Confident	145 Å²	145	70.9 Å²	70.9	55%	0.547	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.2	172.2	-69.3	-177.4	176.8	173.8	-3.1	109.3	H96	R89-H96 HydrophobicContact CB-CB 4.31Å; R89-H96 PolarHBondContact N-O 3.42Å; R89-H96 WeakPolarHBondContact O-CB 3.06Å; R89-H96 PolarHBondContact O-N 2.87Å
90	V	87.4	Confident	89.2	Confident	95 Å²	95	71.9 Å²	71.9	58%	0.576	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	127	172.7	-173.9	0	0	0	0	108.2	I95 Y110	V90-I95 HydrophobicContact CG2-CG1 4.47Å; V90-Y110 HydrophobicContact CG1-CE1 3.82Å
91	R	85.6	Confident	89.1	Confident	145 Å²	145	75.7 Å²	75.7	55%	0.547	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	120.1	177.2	-68.9	-174.5	170.2	-174.2	-5.1	110.2	R93 H94	R91-R93 VanDerWaalsContact C-N 3.32Å; R91-R93 PolarHBondContact O-N 2.9Å; R91-H94 PolarHBondContact N-O 2.78Å; R91-H94 PolarHBondContact O-N 3.1Å
92	K	83.9	Confident	89.1	Confident	199 Å²	199	77.1 Å²	77.1	87%	0.865	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	-79.6	177.4	-64.6	-175	176.9	-175.9	0	115.3	Y110	K92-Y110 VanDerWaalsContact C-OH 3.23Å; K92-Y110 VanDerWaalsContact O-CZ 3.28Å; K92-Y110 PolarHBondContact O-OH 2.96Å
93	R	82.4	Confident	89.2	Confident	149 Å²	149	82.2 Å²	82.2	56%	0.562	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.3	15.6	-175.6	-61.7	-171	178.9	-174.5	-5.9	111.8	R91 Y110 V112	R91-R93 VanDerWaalsContact C-N 3.32Å; R91-R93 PolarHBondContact O-N 2.9Å; R93-Y110 VanDerWaalsContact CA-CE1 3.44Å; R93-Y110 VanDerWaalsContact CA-CZ 3.45Å; R93-Y110 VanDerWaalsContact O-CD1 3.27Å; R93-Y110 WeakPolarHBondContact O-CD1 3.46Å; R93-Y110 PolarHBondContact O-N 2.75Å; R93-V112 HydrophobicContact CG-CG2 3.59Å
94	H	85.5	Confident	89.5	Confident	70 Å²	70	78.2 Å²	78.2	32%	0.324	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	139.9	-174.8	-56.2	-72.4	0	0	0	111.9	R91 I107 I108 S109	R91-H94 PolarHBondContact N-O 2.78Å; R91-H94 PolarHBondContact O-N 3.1Å; H94-I107 HydrophobicContact CB-CG2 3.71Å; H94-I108 CarbonylContact C-O 3.58Å; H94-I108 WeakPolarHBondContact CA-O 3.22Å; H94-S109 PolarHBondContact CE1-OG 3.49Å; H94-S109 VanDerWaalsContact CE1-OG 3.31Å; H94-S109 PolarHBondContact ND1-OG 3.29Å; H94-S109 VanDerWaalsContact ND1-OG 3.12Å
95	I	87.8	Confident	90	Very high	52 Å²	52	86.7 Å²	86.7	27%	0.267	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	112.9	166.2	-55.8	171.9	0	0	0	106.7	V88 V90 L97 I107 I108 Y110	V88-I95 HydrophobicContact CG1-CG2 3.75Å; V90-I95 HydrophobicContact CG2-CG1 4.47Å; I95-L97 HydrophobicContact CG2-CD2 3.99Å; I95-L97 HydrophobicContact CG2-CG 4.26Å; I95-I107 WeakPolarHBondContact O-CA 2.98Å; I95-I108 HydrophobicContact CB-CB 4.27Å; I95-I108 PolarHBondContact N-O 2.82Å; I95-I108 PolarHBondContact O-N 2.89Å; I95-Y110 HydrophobicContact CG1-CD1 4.06Å; I95-Y110 HydrophobicContact CG1-CE1 4.48Å
96	H	91.1	Very high	90.2	Very high	55 Å²	55	85.5 Å²	85.5	26%	0.255	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	115.9	173.4	-61.9	-97.6	0	0	0	108.7	V88 R89	V88-H96 CarbonylContact C-O 3.55Å; V88-H96 WeakPolarHBondContact CA-O 3.32Å; R89-H96 HydrophobicContact CB-CB 4.31Å; R89-H96 PolarHBondContact N-O 3.42Å; R89-H96 WeakPolarHBondContact O-CB 3.06Å; R89-H96 PolarHBondContact O-N 2.87Å
97	L	91.5	Very high	90.3	Very high	19 Å²	19	89.2 Å²	89.2	10%	0.099	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.3	171.5	-58.5	174.8	0	0	0	108.2	L82 V88 I95 R105 S106 I108	L82-L97 HydrophobicContact CD1-CB 4.22Å; L82-L97 HydrophobicContact CD1-CD1 4Å; L82-L97 HydrophobicContact CD1-CG 4.49Å; V88-L97 HydrophobicContact CB-CD2 4.15Å; V88-L97 HydrophobicContact CG1-CD2 3.88Å; V88-L97 HydrophobicContact CG2-CD2 3.58Å; I95-L97 HydrophobicContact CG2-CD2 3.99Å; I95-L97 HydrophobicContact CG2-CG 4.26Å; L97-R105 CarbonylContact O-C 3.46Å; L97-R105 VanDerWaalsContact O-CA 3.31Å; L97-R105 WeakPolarHBondContact O-CA 3.42Å; L97-S106 WeakPolarHBondContact CB-OG 3.39Å; L97-S106 PolarHBondContact N-O 3.22Å; L97-S106 PolarHBondContact O-N 3.46Å; L97-I108 HydrophobicContact CD1-CD1 3.56Å; L97-I108 HydrophobicContact CD1-CG1 4.38Å; L97-I108 HydrophobicContact CG-CD1 4.41Å
98	S	94.4	Very high	89.9	Confident	31 Å²	31	85.8 Å²	85.8	22%	0.217	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.4	175.3	55.7	0	0	0	0	110.2	G86 K87 H104	G86-S98 CarbonylContact C-O 3.56Å; G86-S98 WeakPolarHBondContact CA-O 3.34Å; K87-S98 WeakPolarHBondContact CB-OG 3.27Å; K87-S98 PolarHBondContact N-O 2.99Å; K87-S98 PolarHBondContact O-N 3.04Å; K87-S98 PolarHBondContact O-OG 3.44Å; S98-H104 CarbonylContact C-O 3.58Å; S98-H104 WeakPolarHBondContact CA-O 3.41Å
99	C	94.5	Very high	89.5	Confident	2 Å²	2	85.3 Å²	85.3	1%	0.014	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	118.1	174.6	-179.1	0	0	0	0	109.1	C75 L82 W85 L101 N103 H104	C75-C99 HydrophobicContact CB-CB 4.11Å; C75-C99 VanDerWaalsContact SG-CB 3.59Å; L82-C99 HydrophobicContact CD2-CB 4.02Å; W85-C99 CarbonylContact O-C 3.59Å; C99-L101 PolarHBondContact O-N 2.96Å; C99-N103 WeakPolarHBondContact O-CA 3.49Å; C99-N103 PolarHBondContact O-N 3.12Å; C99-H104 PolarHBondContact N-O 2.84Å
100	A	91.9	Very high	88.6	Confident	44 Å²	44	82.2 Å²	82.2	36%	0.364	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.6	177.2	0	0	0	0	0	113	W85	W85-A100 HydrophobicContact CB-CB 4.41Å; W85-A100 HydrophobicContact CE3-CB 4.34Å; W85-A100 VanDerWaalsContact O-CB 3.22Å; W85-A100 WeakPolarHBondContact O-CB 3.43Å; W85-A100 PolarHBondContact O-N 3.43Å
101	L	90.5	Very high	87.6	Confident	81 Å²	81	81.2 Å²	81.2	42%	0.424	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-44.6	179.7	-170.4	72.6	0	0	0	112.6	V80 W85 C99	V80-L101 HydrophobicContact CB-CD2 4.28Å; V80-L101 HydrophobicContact CG1-CD2 4.43Å; V80-L101 HydrophobicContact CG2-CD2 3.66Å; W85-L101 HydrophobicContact CB-CB 4.31Å; W85-L101 HydrophobicContact CG-CB 4.32Å; C99-L101 PolarHBondContact O-N 2.96Å
102	C	92.8	Very high	86.3	Confident	35 Å²	35	77.4 Å²	77.4	24%	0.236	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	4.1	-175.8	73.7	0	0	0	0	114.3	C75 C78 H104	C75-C102 VanDerWaalsContact SG-SG 3.61Å; C78-C102 HydrophobicContact CB-CB 3.94Å; C102-H104 PolarHBondContact O-N 2.65Å; C102-H104 WeakPolarHBondContact SG-CB 3.47Å
103	N	93.8	Very high	85.1	Confident	130 Å²	130	75.5 Å²	75.5	70%	0.695	39%	0.389	S	S	*	.			trans	56.6	10.7	-176	-65.3	-44.1	0	0	0	115.6	C99	C99-N103 WeakPolarHBondContact O-CA 3.49Å; C99-N103 PolarHBondContact O-N 3.12Å
104	H	95.3	Very high	84.1	Confident	61 Å²	61	75 Å²	75	28%	0.282	39%	0.391	S	S	.	.			trans	-67.1	138.8	176.4	-174.1	66.4	0	0	0	110.8	T76 K77 S98 C99 C102	T76-H104 PolarHBondContact OG1-CD2 3.39Å; T76-H104 PolarHBondContact OG1-NE2 2.96Å; K77-H104 HydrophobicContact CB-CB 3.85Å; K77-H104 HydrophobicContact CD-CB 4.05Å; S98-H104 CarbonylContact C-O 3.58Å; S98-H104 WeakPolarHBondContact CA-O 3.41Å; C99-H104 PolarHBondContact N-O 2.84Å; C102-H104 PolarHBondContact O-N 2.65Å; C102-H104 WeakPolarHBondContact SG-CB 3.47Å
105	R	94	Very high	82.9	Confident	203 Å²	203	79.6 Å²	79.6	77%	0.766	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.7	179.2	-59.1	-179.5	-176.6	174.4	1.4	109.4	L97	L97-R105 CarbonylContact O-C 3.46Å; L97-R105 VanDerWaalsContact O-CA 3.31Å; L97-R105 WeakPolarHBondContact O-CA 3.42Å
106	S	90.6	Very high	81.8	Confident	34 Å²	34	83 Å²	83	24%	0.238	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	146.5	171.3	60.1	0	0	0	0	109.8	L97	L97-S106 WeakPolarHBondContact CB-OG 3.39Å; L97-S106 PolarHBondContact N-O 3.22Å; L97-S106 PolarHBondContact O-N 3.46Å
107	I	89.5	Confident	80.4	Confident	105 Å²	105	81.7 Å²	81.7	54%	0.538	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.1	-178.8	-55.6	179.1	0	0	0	107.1	H94 I95	H94-I107 HydrophobicContact CB-CG2 3.71Å; I95-I107 WeakPolarHBondContact O-CA 2.98Å
108	I	84.7	Confident	79.2	Confident	55 Å²	55	81.6 Å²	81.6	28%	0.282	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	115.7	174.5	-57.5	171.8	0	0	0	106.9	H94 I95 L97	H94-I108 CarbonylContact C-O 3.58Å; H94-I108 WeakPolarHBondContact CA-O 3.22Å; I95-I108 HydrophobicContact CB-CB 4.27Å; I95-I108 PolarHBondContact N-O 2.82Å; I95-I108 PolarHBondContact O-N 2.89Å; L97-I108 HydrophobicContact CD1-CD1 3.56Å; L97-I108 HydrophobicContact CD1-CG1 4.38Å; L97-I108 HydrophobicContact CG-CD1 4.41Å
109	S	81.9	Confident	78	Confident	82 Å²	82	89.5 Å²	89.5	57%	0.573	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	132.8	173.5	-57.4	0	0	0	0	110.1	H94	H94-S109 PolarHBondContact CE1-OG 3.49Å; H94-S109 VanDerWaalsContact CE1-OG 3.31Å; H94-S109 PolarHBondContact ND1-OG 3.29Å; H94-S109 VanDerWaalsContact ND1-OG 3.12Å
110	Y	72.6	Confident	76.6	Confident	79 Å²	79	91.6 Å²	91.6	31%	0.31	46%	0.461	S	S	.	.			trans	-115.3	126.2	168.5	69.3	-94.4	0	0	0	109.3	V90 K92 R93 I95	V90-Y110 HydrophobicContact CG1-CE1 3.82Å; K92-Y110 VanDerWaalsContact C-OH 3.23Å; K92-Y110 VanDerWaalsContact O-CZ 3.28Å; K92-Y110 PolarHBondContact O-OH 2.96Å; R93-Y110 VanDerWaalsContact CA-CE1 3.44Å; R93-Y110 VanDerWaalsContact CA-CZ 3.45Å; R93-Y110 VanDerWaalsContact O-CD1 3.27Å; R93-Y110 WeakPolarHBondContact O-CD1 3.46Å; R93-Y110 PolarHBondContact O-N 2.75Å; I95-Y110 HydrophobicContact CG1-CD1 4.06Å; I95-Y110 HydrophobicContact CG1-CE1 4.48Å
111	P	65.7	Low	75.4	Confident	75 Å²	75	91.1 Å²	91.1	49%	0.487	45%	0.451	S	S	.	.			trans	-67.6	143.3	172.5	26.7	-30.6	0	0	0	110.3
112	V	58.3	Low	74.3	Confident	64 Å²	64	90.1 Å²	90.1	39%	0.388	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	138.4	176.7	174.9	0	0	0	0	109.5	R93 K114	R93-V112 HydrophobicContact CG-CG2 3.59Å; V112-K114 VanDerWaalsContact C-N 3.33Å; V112-K114 PolarHBondContact O-N 3.31Å
113	N	58.4	Low	73.2	Confident	159 Å²	159	93.4 Å²	93.4	85%	0.85	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	5.8	172.4	-62.7	-5.1	0	0	0	118.6
114	K	61.4	Low	71.8	Confident	139 Å²	139	91.9 Å²	91.9	60%	0.604	46%	0.461	S	S	*	.			trans	-146.3	106.3	169.9	-69.4	-174.9	-179.2	-178.9	0	109.8	V112 H116	V112-K114 VanDerWaalsContact C-N 3.33Å; V112-K114 PolarHBondContact O-N 3.31Å; K114-H116 WeakPolarHBondContact CB-CE1 3.13Å; K114-H116 WeakPolarHBondContact CB-ND1 3.5Å; K114-H116 PolarHBondContact O-N 3.29Å; K114-H116 VanDerWaalsContact O-N 3.14Å; K114-H116 PolarHBondContact O-ND1 2.64Å
115	W	61	Low	70.2	Confident	166 Å²	166	93.7 Å²	93.7	63%	0.629	48%	0.479	S	S	*	.			trans	-60.2	119.5	162.6	178.9	87.2	0	0	0	107.5	A117 E121	W115-A117 HydrophobicContact CE3-CB 4.16Å; W115-A117 VanDerWaalsContact CH2-CA 3.41Å; W115-A117 HydrophobicContact CH2-CB 3.31Å; W115-A117 HydrophobicContact CZ2-CB 4.14Å; W115-A117 HydrophobicContact CZ3-CB 3.33Å; W115-E121 HydrophobicContact CH2-CB 4.26Å
116	H	63.2	Low	68.6	Low	124 Å²	124	90.3 Å²	90.3	57%	0.574	48%	0.476	S	S	*	.			trans	-102.6	109.7	173.8	-74	54.2	0	0	0	107	K114 S118	K114-H116 WeakPolarHBondContact CB-CE1 3.13Å; K114-H116 WeakPolarHBondContact CB-ND1 3.5Å; K114-H116 PolarHBondContact O-N 3.29Å; K114-H116 VanDerWaalsContact O-N 3.14Å; K114-H116 PolarHBondContact O-ND1 2.64Å; H116-S118 PolarHBondContact O-N 2.99Å
117	A	63.1	Low	66.9	Low	27 Å²	27	89.8 Å²	89.8	22%	0.223	47%	0.472	C	S	.	.			trans	-50	132.6	165.6	0	0	0	0	0	108.4	W115 E121	W115-A117 HydrophobicContact CE3-CB 4.16Å; W115-A117 VanDerWaalsContact CH2-CA 3.41Å; W115-A117 HydrophobicContact CH2-CB 3.31Å; W115-A117 HydrophobicContact CZ2-CB 4.14Å; W115-A117 HydrophobicContact CZ3-CB 3.33Å; A117-E121 HydrophobicContact CB-CB 3.77Å
118	S	65.3	Low	65.2	Low	18 Å²	18	89.4 Å²	89.4	13%	0.126	47%	0.471	C	S	.	.			trans	-57.1	155.3	163	58.8	0	0	0	0	109.4	H116 S120 E121 S122	H116-S118 PolarHBondContact O-N 2.99Å; S118-S120 CarbonylContact O-C 3.59Å; S118-S120 PolarHBondContact O-N 3.13Å; S118-E121 WeakPolarHBondContact CB-OE2 3.27Å; S118-E121 PolarHBondContact N-OE2 3.32Å; S118-E121 CarbonylContact O-C 3.57Å; S118-E121 WeakPolarHBondContact O-CA 3.19Å; S118-E121 WeakPolarHBondContact O-CB 3.42Å; S118-E121 PolarHBondContact O-N 3.29Å; S118-E121 VanDerWaalsContact OG-CG 3.24Å; S118-E121 WeakPolarHBondContact OG-CG 3.36Å; S118-E121 PolarHBondContact OG-OE2 3.14Å; S118-S122 PolarHBondContact O-N 2.86Å; S118-S122 PolarHBondContact O-OG 3.09Å
119	Y	68.7	Low	63.4	Low	196 Å²	196	91.3 Å²	91.3	77%	0.769	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-37	-177.1	172.7	-97.5	0	0	0	113.8	S122 V123	Y119-S122 WeakPolarHBondContact CA-OG 2.84Å; Y119-S122 PolarHBondContact O-OG 3.29Å; Y119-V123 WeakPolarHBondContact O-CG2 3.46Å
120	S	65	Low	61.8	Low	46 Å²	46	91 Å²	91	32%	0.322	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-32.3	175.7	61.2	0	0	0	0	113.7	F68 S118 S122 V123	F68-S120 WeakPolarHBondContact CD2-OG 3.27Å; F68-S120 WeakPolarHBondContact CE2-OG 3.48Å; S118-S120 CarbonylContact O-C 3.59Å; S118-S120 PolarHBondContact O-N 3.13Å; S120-S122 VanDerWaalsContact C-N 3.35Å; S120-V123 PolarHBondContact O-N 3.14Å
121	E	67.6	Low	60.7	Low	34 Å²	34	92.5 Å²	92.5	16%	0.159	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-68.7	-36.9	175.6	-72.5	163.1	165.5	0	0	109.8	R72 W115 A117 S118 V123 L124 S127	R72-E121 IonicContact CZ-OE1 3.92Å; R72-E121 IonicContact NH1-OE1 2.82Å; R72-E121 PolarHBondContact NH1-OE1 3.45Å; R72-E121 IonicContact NH1-OE2 3.56Å; W115-E121 HydrophobicContact CH2-CB 4.26Å; A117-E121 HydrophobicContact CB-CB 3.77Å; S118-E121 WeakPolarHBondContact CB-OE2 3.27Å; S118-E121 PolarHBondContact N-OE2 3.32Å; S118-E121 CarbonylContact O-C 3.57Å; S118-E121 WeakPolarHBondContact O-CA 3.19Å; S118-E121 WeakPolarHBondContact O-CB 3.42Å; S118-E121 PolarHBondContact O-N 3.29Å; S118-E121 VanDerWaalsContact OG-CG 3.24Å; S118-E121 WeakPolarHBondContact OG-CG 3.36Å; S118-E121 PolarHBondContact OG-OE2 3.14Å; E121-V123 PolarHBondContact O-N 3.09Å; E121-V123 VanDerWaalsContact O-N 3.13Å; E121-L124 WeakPolarHBondContact O-CB 3.45Å; E121-L124 PolarHBondContact O-N 2.99Å; E121-L124 VanDerWaalsContact O-N 3.09Å; E121-S127 WeakPolarHBondContact O-CB 3.41Å; E121-S127 PolarHBondContact O-OG 2.92Å
122	S	66.8	Low	59.9	Low	61 Å²	61	95.7 Å²	95.7	43%	0.427	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-66.9	-10.1	177.7	51.7	0	0	0	0	115.2	S118 Y119 S120 S127	S118-S122 PolarHBondContact O-N 2.86Å; S118-S122 PolarHBondContact O-OG 3.09Å; Y119-S122 WeakPolarHBondContact CA-OG 2.84Å; Y119-S122 PolarHBondContact O-OG 3.29Å; S120-S122 VanDerWaalsContact C-N 3.35Å; S122-S127 VanDerWaalsContact C-OG 3.27Å; S122-S127 PolarHBondContact O-OG 3.33Å; S122-S127 VanDerWaalsContact O-OG 3.14Å
123	V	69.9	Low	59.2	Low	104 Å²	104	98.4 Å²	98.4	63%	0.63	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-99.5	-9.8	177.8	-177.8	0	0	0	0	111	Y119 S120 E121	Y119-V123 WeakPolarHBondContact O-CG2 3.46Å; S120-V123 PolarHBondContact O-N 3.14Å; E121-V123 PolarHBondContact O-N 3.09Å; E121-V123 VanDerWaalsContact O-N 3.13Å
124	L	64.9	Low	58.7	Low	97 Å²	97	95.2 Å²	95.2	51%	0.508	50%	0.501	S	S	.	.	S	Bend	trans	-72	142	175.5	-62.8	174.8	0	0	0	109.9	E121 D126 S127	E121-L124 WeakPolarHBondContact O-CB 3.45Å; E121-L124 PolarHBondContact O-N 2.99Å; E121-L124 VanDerWaalsContact O-N 3.09Å; L124-D126 PolarHBondContact O-N 3.45Å; L124-D126 VanDerWaalsContact O-N 3.16Å; L124-S127 WeakPolarHBondContact O-CB 3.41Å; L124-S127 PolarHBondContact O-N 3.15Å; L124-S127 PolarHBondContact O-OG 3.4Å
125	P	61.5	Low	57.8	Low	100 Å²	100	95.8 Å²	95.8	65%	0.649	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-55.8	-35.1	-179.2	19.6	-30.3	0	0	0	112.6	S127	P125-S127 PolarHBondContact O-N 2.9Å
126	D	60.6	Low	57.2	Low	131 Å²	131	95.6 Å²	95.6	70%	0.701	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-74	-12.9	-178.9	-54.3	-24.3	0	0	0	113.7	L124 L128 C129	L124-D126 PolarHBondContact O-N 3.45Å; L124-D126 VanDerWaalsContact O-N 3.16Å; D126-L128 PolarHBondContact O-N 2.76Å; D126-C129 PolarHBondContact O-N 3Å
127	S	55	Low	56.6	Low	23 Å²	23	93.4 Å²	93.4	16%	0.161	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-72.5	-15.2	-178.7	69.4	0	0	0	0	113.9	E121 S122 L124 P125 C129	E121-S127 WeakPolarHBondContact O-CB 3.41Å; E121-S127 PolarHBondContact O-OG 2.92Å; S122-S127 VanDerWaalsContact C-OG 3.27Å; S122-S127 PolarHBondContact O-OG 3.33Å; S122-S127 VanDerWaalsContact O-OG 3.14Å; L124-S127 WeakPolarHBondContact O-CB 3.41Å; L124-S127 PolarHBondContact O-N 3.15Å; L124-S127 PolarHBondContact O-OG 3.4Å; P125-S127 PolarHBondContact O-N 2.9Å; S127-C129 VanDerWaalsContact C-N 3.28Å; S127-C129 PolarHBondContact O-N 3.11Å
128	L	52.5	Low	56	Low	98 Å²	98	97.9 Å²	97.9	51%	0.513	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-72.9	-18.7	177.7	-73.2	156.7	0	0	0	112.9	D126 C130 N131	D126-L128 PolarHBondContact O-N 2.76Å; L128-C130 PolarHBondContact O-N 3.06Å; L128-N131 PolarHBondContact O-N 3.14Å
129	C	47.8	Very low	55.2	Low	95 Å²	95	104.2 Å²	104.2	64%	0.642	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-63	-11.4	-176.2	-77.2	0	0	0	0	115.1	D126 S127	D126-C129 PolarHBondContact O-N 3Å; S127-C129 VanDerWaalsContact C-N 3.28Å; S127-C129 PolarHBondContact O-N 3.11Å
130	C	49.4	Very low	53.8	Low	74 Å²	74	106.5 Å²	106.5	50%	0.5	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-105.2	-9	179.9	-60.8	0	0	0	0	115.1	L128 I134	L128-C130 PolarHBondContact O-N 3.06Å; C130-I134 WeakPolarHBondContact O-CD1 3.39Å
131	N	48.9	Very low	53.3	Low	112 Å²	112	109.6 Å²	109.6	60%	0.599	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-30.3	-178.9	-80.6	-11.7	0	0	0	113.2	L128 N133	L128-N131 PolarHBondContact O-N 3.14Å; N131-N133 VanDerWaalsContact C-N 3.35Å; N131-N133 PolarHBondContact O-N 3.13Å
132	E	47.9	Very low	52.5	Low	142 Å²	142	113.5 Å²	113.5	66%	0.664	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-19.1	-175.1	-66.3	-173.8	167.3	0	0	114.2
133	N	44	Very low	51.7	Low	120 Å²	120	116.4 Å²	116.4	64%	0.642	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-11.8	179.8	-70.2	-24.1	0	0	0	114	N131	N131-N133 VanDerWaalsContact C-N 3.35Å; N131-N133 PolarHBondContact O-N 3.13Å
134	I	47.6	Very low	50.6	Low	93 Å²	93	117.2 Å²	117.2	48%	0.477	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.4	-26	179.1	-61	174.1	0	0	0	111.3	C130 S137	C130-I134 WeakPolarHBondContact O-CD1 3.39Å; I134-S137 PolarHBondContact O-OG 3.32Å
135	E	43.7	Very low	49.8	Very low	151 Å²	151	118.4 Å²	118.4	71%	0.706	63%	0.631	S	S	*	*	S	Bend	trans	-79.6	-18.8	177.5	-70.4	-176.3	168.5	0	0	113.2
136	K	47.8	Very low	49	Very low	162 Å²	162	119.7 Å²	119.7	70%	0.704	63%	0.63	S	S	*	*	S	Bend	trans	-86	-20.6	176.8	-71.8	-178	179.4	175.6	0	114.2
137	S	49.6	Very low	48.1	Very low	78 Å²	78	118.9 Å²	118.9	55%	0.545	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.4	-1.7	-178.9	63	0	0	0	0	114.7	I134	I134-S137 PolarHBondContact O-OG 3.32Å
138	N	50.9	Low	47.6	Very low	121 Å²	121	126.2 Å²	126.2	65%	0.647	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	8.5	-178.8	-67.9	-18.7	0	0	0	113.1
139	N	49.5	Very low	47.2	Very low	150 Å²	150	128.6 Å²	128.6	80%	0.802	67%	0.673	S	S	*	*			trans	-124.9	18	-177.5	-78	-22.7	0	0	0	113.4
140	E	39.3	Very low	47.1	Very low	245 Å²	245	131.6 Å²	131.6	100%	1.145	68%	0.676	S	S	*	*			trans	-112.5	0	163.8	-73	-178.4	170.8	0	0	109.1

Retrieved 140 of 140 residues in 38.9 ms (Link to these results)

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