G4V9Y2_SCHMA Loading...

Smp_200800

AlphaFold DB , UniProt , Accession G4V9Y2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 102 aa.

						>G4V9Y2_SCHMA|G4V9Y2
MNKFPTWNILSITTLIVYCLLISLTNAWKIGKIEIPNDNEEVRMESEEEIEPTLRQRRKWISQLYHGDLPWIHGLNRAAVNQRLYNTIRRERRFFCNPMGCV
					

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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	47.3	Very low	72.8	Confident	222 Å²	222	127.2 Å²	127.2	100%	1.094	64%	0.636	S	S	*	*				0	88	0	-76	157	84.3	0	0	108.7
2	N	55.4	Low	74.2	Confident	145 Å²	145	124.8 Å²	124.8	78%	0.775	63%	0.625	S	S	*	*			trans	-110.8	81.5	175.5	-75.8	-2	0	0	0	108.3	P5	N2-P5 WeakPolarHBondContact O-CD 3.23Å
3	K	61.9	Low	75.5	Confident	159 Å²	159	120.5 Å²	120.5	69%	0.691	61%	0.609	S	S	*	*			trans	-88	-4.3	175.3	-70.3	-173.6	178.5	-178.9	0	113.1	T6	K3-T6 PolarHBondContact O-OG1 3.14Å
4	F	61.6	Low	76.6	Confident	168 Å²	168	117.7 Å²	117.7	74%	0.737	60%	0.601	S	S	*	*	H	α-helix	trans	-68.1	-31.1	177.7	-73.2	-78.6	0	0	0	116.6	T6 N8	F4-T6 PolarHBondContact O-N 3.18Å; F4-N8 PolarHBondContact O-N 2.99Å
5	P	74.9	Confident	77.5	Confident	67 Å²	67	117.2 Å²	117.2	44%	0.435	60%	0.6	S	S	.	*	H	α-helix	trans	-71	-32.9	-175.2	27.2	-31.5	0	0	0	112.3	N2 N8 I9	N2-P5 WeakPolarHBondContact O-CD 3.23Å; P5-N8 PolarHBondContact O-N 3.2Å; P5-I9 WeakPolarHBondContact O-CD1 3.44Å; P5-I9 WeakPolarHBondContact O-CG1 3.47Å; P5-I9 PolarHBondContact O-N 3.01Å; P5-I9 VanDerWaalsContact O-N 3.08Å
6	T	77.9	Confident	78.4	Confident	89 Å²	89	115.4 Å²	115.4	55%	0.546	59%	0.59	S	S	.	*	H	α-helix	trans	-69.4	-36.6	-178.2	54.5	0	0	0	0	112.5	K3 F4 I9 L10	K3-T6 PolarHBondContact O-OG1 3.14Å; F4-T6 PolarHBondContact O-N 3.18Å; T6-I9 PolarHBondContact O-N 2.84Å; T6-L10 WeakPolarHBondContact O-CB 3.47Å; T6-L10 PolarHBondContact O-N 2.89Å
7	W	79.2	Confident	79.1	Confident	181 Å²	181	113.3 Å²	113.3	69%	0.686	58%	0.584	S	S	*	*	H	α-helix	trans	-66.4	-42.6	176.9	-81.5	89.5	0	0	0	112	I9 L10 S11	W7-I9 VanDerWaalsContact C-N 3.34Å; W7-I9 PolarHBondContact O-N 3.2Å; W7-L10 PolarHBondContact O-N 3.17Å; W7-S11 PolarHBondContact O-N 3.35Å; W7-S11 PolarHBondContact O-OG 3.02Å
8	N	81.5	Confident	79.8	Confident	99 Å²	99	115.4 Å²	115.4	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-64.8	-40.1	176.8	-72.8	-9.4	0	0	0	111.7	F4 P5 L10 S11 I12	F4-N8 PolarHBondContact O-N 2.99Å; P5-N8 PolarHBondContact O-N 3.2Å; N8-L10 VanDerWaalsContact C-N 3.35Å; N8-S11 WeakPolarHBondContact CA-OG 3.41Å; N8-S11 PolarHBondContact O-N 3.37Å; N8-S11 PolarHBondContact O-OG 3.48Å; N8-I12 WeakPolarHBondContact O-CD1 3.34Å; N8-I12 WeakPolarHBondContact O-CG1 3.28Å; N8-I12 PolarHBondContact O-N 2.96Å
9	I	85.2	Confident	80.3	Confident	105 Å²	105	112.5 Å²	112.5	54%	0.538	58%	0.576	S	S	.	*	H	α-helix	trans	-63	-44.9	175.8	-66.5	162.8	0	0	0	110.1	P5 T6 W7 S11 I12 T13	P5-I9 WeakPolarHBondContact O-CD1 3.44Å; P5-I9 WeakPolarHBondContact O-CG1 3.47Å; P5-I9 PolarHBondContact O-N 3.01Å; P5-I9 VanDerWaalsContact O-N 3.08Å; T6-I9 PolarHBondContact O-N 2.84Å; W7-I9 VanDerWaalsContact C-N 3.34Å; W7-I9 PolarHBondContact O-N 3.2Å; I9-S11 PolarHBondContact O-N 3.42Å; I9-I12 PolarHBondContact O-N 3.41Å; I9-T13 HydrophobicContact CG2-CG2 4.45Å; I9-T13 WeakPolarHBondContact O-CG2 3.43Å; I9-T13 PolarHBondContact O-N 3.04Å; I9-T13 PolarHBondContact O-OG1 2.96Å
10	L	87.6	Confident	80.6	Confident	107 Å²	107	112.6 Å²	112.6	56%	0.56	58%	0.577	S	S	*	*	H	α-helix	trans	-63.4	-39.5	178.4	-160.3	99.9	0	0	0	112.4	T6 W7 N8 T13 T14	T6-L10 WeakPolarHBondContact O-CB 3.47Å; T6-L10 PolarHBondContact O-N 2.89Å; W7-L10 PolarHBondContact O-N 3.17Å; N8-L10 VanDerWaalsContact C-N 3.35Å; L10-T13 PolarHBondContact O-OG1 3.07Å; L10-T13 VanDerWaalsContact O-OG1 3.08Å; L10-T14 WeakPolarHBondContact O-CB 3.44Å; L10-T14 VanDerWaalsContact O-CG2 3.26Å; L10-T14 WeakPolarHBondContact O-CG2 3.36Å; L10-T14 PolarHBondContact O-N 3.14Å; L10-T14 VanDerWaalsContact O-N 3.11Å; L10-T14 PolarHBondContact O-OG1 3.24Å
11	S	88.7	Confident	81	Confident	57 Å²	57	111.6 Å²	111.6	40%	0.399	57%	0.572	S	S	.	*	H	α-helix	trans	-67.7	-36.5	177.2	61.3	0	0	0	0	112.3	W7 N8 I9 T14 L15	W7-S11 PolarHBondContact O-N 3.35Å; W7-S11 PolarHBondContact O-OG 3.02Å; N8-S11 WeakPolarHBondContact CA-OG 3.41Å; N8-S11 PolarHBondContact O-N 3.37Å; N8-S11 PolarHBondContact O-OG 3.48Å; I9-S11 PolarHBondContact O-N 3.42Å; S11-T14 WeakPolarHBondContact CA-OG1 3.41Å; S11-T14 PolarHBondContact O-OG1 3.4Å; S11-L15 WeakPolarHBondContact O-CB 3.35Å; S11-L15 PolarHBondContact O-N 2.99Å; S11-L15 VanDerWaalsContact O-N 3.15Å
12	I	89.5	Confident	82.7	Confident	99 Å²	99	104 Å²	104	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-70.5	-45	179.4	-67.9	166.9	0	0	0	110.3	N8 I9 T14 L15 I16	N8-I12 WeakPolarHBondContact O-CD1 3.34Å; N8-I12 WeakPolarHBondContact O-CG1 3.28Å; N8-I12 PolarHBondContact O-N 2.96Å; I9-I12 PolarHBondContact O-N 3.41Å; I12-T14 PolarHBondContact O-N 3.44Å; I12-L15 PolarHBondContact O-N 3.36Å; I12-I16 HydrophobicContact CG2-CD1 3.78Å; I12-I16 HydrophobicContact CG2-CG1 4.48Å; I12-I16 VanDerWaalsContact O-CG1 3.29Å; I12-I16 WeakPolarHBondContact O-CG1 3.22Å; I12-I16 PolarHBondContact O-N 2.95Å
13	T	91.1	Very high	83.7	Confident	68 Å²	68	100.8 Å²	100.8	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-40.4	-179.9	54.7	0	0	0	0	112.1	I9 L10 I16 V17	I9-T13 HydrophobicContact CG2-CG2 4.45Å; I9-T13 WeakPolarHBondContact O-CG2 3.43Å; I9-T13 PolarHBondContact O-N 3.04Å; I9-T13 PolarHBondContact O-OG1 2.96Å; L10-T13 PolarHBondContact O-OG1 3.07Å; L10-T13 VanDerWaalsContact O-OG1 3.08Å; T13-I16 PolarHBondContact O-N 2.99Å; T13-V17 WeakPolarHBondContact O-CG2 3.47Å; T13-V17 PolarHBondContact O-N 2.73Å
14	T	90.2	Very high	84.5	Confident	82 Å²	82	98.1 Å²	98.1	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-40	175.9	49.1	0	0	0	0	112.4	L10 S11 I12 V17 Y18	L10-T14 WeakPolarHBondContact O-CB 3.44Å; L10-T14 VanDerWaalsContact O-CG2 3.26Å; L10-T14 WeakPolarHBondContact O-CG2 3.36Å; L10-T14 PolarHBondContact O-N 3.14Å; L10-T14 VanDerWaalsContact O-N 3.11Å; L10-T14 PolarHBondContact O-OG1 3.24Å; S11-T14 WeakPolarHBondContact CA-OG1 3.41Å; S11-T14 PolarHBondContact O-OG1 3.4Å; I12-T14 PolarHBondContact O-N 3.44Å; T14-V17 PolarHBondContact O-N 2.93Å; T14-Y18 WeakPolarHBondContact O-CB 3.37Å; T14-Y18 PolarHBondContact O-N 3.35Å
15	L	91	Very high	85.3	Confident	110 Å²	110	93.6 Å²	93.6	58%	0.576	50%	0.503	S	S	*	.	H	α-helix	trans	-65.5	-42.7	176.5	-163.8	151.8	0	0	0	111.8	S11 I12 Y18 C19	S11-L15 WeakPolarHBondContact O-CB 3.35Å; S11-L15 PolarHBondContact O-N 2.99Å; S11-L15 VanDerWaalsContact O-N 3.15Å; I12-L15 PolarHBondContact O-N 3.36Å; L15-Y18 PolarHBondContact O-N 2.83Å; L15-C19 PolarHBondContact O-N 3.03Å; L15-C19 PolarHBondContact O-SG 3.1Å; L15-C19 VanDerWaalsContact O-SG 3.36Å
16	I	91.3	Very high	85.2	Confident	88 Å²	88	94.3 Å²	94.3	45%	0.451	50%	0.503	S	S	.	.	H	α-helix	trans	-61.2	-47.1	176.4	-68	165.9	0	0	0	110.8	I12 T13 Y18 C19 L20	I12-I16 HydrophobicContact CG2-CD1 3.78Å; I12-I16 HydrophobicContact CG2-CG1 4.48Å; I12-I16 VanDerWaalsContact O-CG1 3.29Å; I12-I16 WeakPolarHBondContact O-CG1 3.22Å; I12-I16 PolarHBondContact O-N 2.95Å; T13-I16 PolarHBondContact O-N 2.99Å; I16-Y18 VanDerWaalsContact C-N 3.31Å; I16-Y18 PolarHBondContact O-N 2.91Å; I16-C19 PolarHBondContact O-N 3.38Å; I16-L20 HydrophobicContact CG2-CD1 4.13Å; I16-L20 WeakPolarHBondContact O-CG 3.31Å; I16-L20 PolarHBondContact O-N 2.98Å
17	V	90.9	Very high	84.8	Confident	80 Å²	80	92.9 Å²	92.9	49%	0.485	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-42.8	177.8	172.2	0	0	0	0	110.9	T13 T14 C19 L20 L21	T13-V17 WeakPolarHBondContact O-CG2 3.47Å; T13-V17 PolarHBondContact O-N 2.73Å; T14-V17 PolarHBondContact O-N 2.93Å; V17-C19 PolarHBondContact O-N 3.45Å; V17-L20 PolarHBondContact O-N 2.88Å; V17-L21 HydrophobicContact CG1-CD1 3.96Å; V17-L21 HydrophobicContact CG1-CG 4.36Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 3.11Å
18	Y	90.7	Very high	84.1	Confident	151 Å²	151	92.1 Å²	92.1	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-60.9	-44.7	176.8	-179	-106.4	0	0	0	112.5	T14 L15 I16 L20 L21 I22	T14-Y18 WeakPolarHBondContact O-CB 3.37Å; T14-Y18 PolarHBondContact O-N 3.35Å; L15-Y18 PolarHBondContact O-N 2.83Å; I16-Y18 VanDerWaalsContact C-N 3.31Å; I16-Y18 PolarHBondContact O-N 2.91Å; Y18-L20 VanDerWaalsContact C-N 3.33Å; Y18-L20 PolarHBondContact O-N 2.97Å; Y18-L21 PolarHBondContact O-N 3.09Å; Y18-I22 HydrophobicContact CD1-CD1 3.69Å; Y18-I22 HydrophobicContact CE1-CD1 3.22Å; Y18-I22 HydrophobicContact CE1-CG1 4.29Å; Y18-I22 HydrophobicContact CE2-CD1 4.19Å; Y18-I22 HydrophobicContact CE2-CG1 4.47Å; Y18-I22 HydrophobicContact CG-CD1 4.35Å; Y18-I22 VanDerWaalsContact CZ-CD1 3.5Å; Y18-I22 WeakPolarHBondContact O-CG1 3.5Å; Y18-I22 PolarHBondContact O-N 3.4Å
19	C	89.2	Confident	83.3	Confident	61 Å²	61	94.6 Å²	94.6	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-37.5	176.3	-70.5	0	0	0	0	113	L15 I16 V17 S23	L15-C19 PolarHBondContact O-N 3.03Å; L15-C19 PolarHBondContact O-SG 3.1Å; L15-C19 VanDerWaalsContact O-SG 3.36Å; I16-C19 PolarHBondContact O-N 3.38Å; V17-C19 PolarHBondContact O-N 3.45Å; C19-S23 PolarHBondContact O-N 3Å; C19-S23 PolarHBondContact O-OG 3.11Å; C19-S23 VanDerWaalsContact O-OG 3.11Å
20	L	87.8	Confident	82	Confident	114 Å²	114	95 Å²	95	60%	0.597	51%	0.506	S	S	*	.	H	α-helix	trans	-69	-40.4	176	-68.6	174.7	0	0	0	111.7	I16 V17 Y18 S23 L24	I16-L20 HydrophobicContact CG2-CD1 4.13Å; I16-L20 WeakPolarHBondContact O-CG 3.31Å; I16-L20 PolarHBondContact O-N 2.98Å; V17-L20 PolarHBondContact O-N 2.88Å; Y18-L20 VanDerWaalsContact C-N 3.33Å; Y18-L20 PolarHBondContact O-N 2.97Å; L20-S23 PolarHBondContact O-N 3.36Å; L20-L24 PolarHBondContact O-N 2.9Å
21	L	87.2	Confident	80.6	Confident	92 Å²	92	93.2 Å²	93.2	48%	0.482	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-37	177.4	-71.3	173	0	0	0	112.6	V17 Y18 S23 L24 T25	V17-L21 HydrophobicContact CG1-CD1 3.96Å; V17-L21 HydrophobicContact CG1-CG 4.36Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 3.11Å; Y18-L21 PolarHBondContact O-N 3.09Å; L21-S23 VanDerWaalsContact C-N 3.35Å; L21-L24 PolarHBondContact O-N 3.43Å; L21-T25 WeakPolarHBondContact O-CB 3.36Å; L21-T25 VanDerWaalsContact O-CG2 3.31Å; L21-T25 WeakPolarHBondContact O-CG2 3.35Å; L21-T25 PolarHBondContact O-N 3.43Å; L21-T25 PolarHBondContact O-OG1 3.35Å
22	I	83.1	Confident	78.9	Confident	62 Å²	62	97.8 Å²	97.8	32%	0.318	53%	0.525	S	S	.	.	H	α-helix	trans	-62.3	-44.9	174	-69.5	165.4	0	0	0	110.6	Y18 L24 T25 N26	Y18-I22 HydrophobicContact CD1-CD1 3.69Å; Y18-I22 HydrophobicContact CE1-CD1 3.22Å; Y18-I22 HydrophobicContact CE1-CG1 4.29Å; Y18-I22 HydrophobicContact CE2-CD1 4.19Å; Y18-I22 HydrophobicContact CE2-CG1 4.47Å; Y18-I22 HydrophobicContact CG-CD1 4.35Å; Y18-I22 VanDerWaalsContact CZ-CD1 3.5Å; Y18-I22 WeakPolarHBondContact O-CG1 3.5Å; Y18-I22 PolarHBondContact O-N 3.4Å; I22-L24 VanDerWaalsContact C-N 3.32Å; I22-L24 PolarHBondContact O-N 3.16Å; I22-T25 WeakPolarHBondContact CA-OG1 3.5Å; I22-T25 PolarHBondContact O-N 3.14Å; I22-T25 PolarHBondContact O-OG1 3.49Å; I22-N26 WeakPolarHBondContact O-CB 3.45Å; I22-N26 VanDerWaalsContact O-CG 3.24Å; I22-N26 PolarHBondContact O-N 2.81Å; I22-N26 PolarHBondContact O-ND2 3Å
23	S	78	Confident	77.3	Confident	77 Å²	77	98.4 Å²	98.4	54%	0.538	53%	0.528	S	S	.	.	H	α-helix	trans	-61.7	-42.2	177.4	-57.5	0	0	0	0	111.4	C19 L20 L21 A27	C19-S23 PolarHBondContact O-N 3Å; C19-S23 PolarHBondContact O-OG 3.11Å; C19-S23 VanDerWaalsContact O-OG 3.11Å; L20-S23 PolarHBondContact O-N 3.36Å; L21-S23 VanDerWaalsContact C-N 3.35Å; S23-A27 VanDerWaalsContact O-CB 3.3Å; S23-A27 WeakPolarHBondContact O-CB 3.45Å; S23-A27 PolarHBondContact O-N 3.36Å
24	L	78.9	Confident	75.5	Confident	104 Å²	104	103.7 Å²	103.7	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-66	-42.3	177.9	-170.2	72.2	0	0	0	112.4	L20 L21 I22 A27 W28	L20-L24 PolarHBondContact O-N 2.9Å; L21-L24 PolarHBondContact O-N 3.43Å; I22-L24 VanDerWaalsContact C-N 3.32Å; I22-L24 PolarHBondContact O-N 3.16Å; L24-A27 PolarHBondContact O-N 2.94Å; L24-W28 WeakPolarHBondContact O-CB 3.42Å; L24-W28 PolarHBondContact O-N 3.16Å
25	T	78.4	Confident	73.6	Confident	73 Å²	73	107 Å²	107	45%	0.448	56%	0.561	S	S	.	*	H	α-helix	trans	-70	-36.8	179.2	51.1	0	0	0	0	112.2	L21 I22 W28 K29	L21-T25 WeakPolarHBondContact O-CB 3.36Å; L21-T25 VanDerWaalsContact O-CG2 3.31Å; L21-T25 WeakPolarHBondContact O-CG2 3.35Å; L21-T25 PolarHBondContact O-N 3.43Å; L21-T25 PolarHBondContact O-OG1 3.35Å; I22-T25 WeakPolarHBondContact CA-OG1 3.5Å; I22-T25 PolarHBondContact O-N 3.14Å; I22-T25 PolarHBondContact O-OG1 3.49Å; T25-W28 PolarHBondContact O-N 3.24Å; T25-K29 WeakPolarHBondContact O-CG 3.32Å; T25-K29 PolarHBondContact O-N 3.27Å
26	N	72.3	Confident	71.6	Confident	82 Å²	82	106.2 Å²	106.2	44%	0.439	56%	0.563	S	S	.	*	H	α-helix	trans	-66.4	-43.1	172.4	-71.2	-19.4	0	0	0	111.3	I22 W28 K29 I30	I22-N26 WeakPolarHBondContact O-CB 3.45Å; I22-N26 VanDerWaalsContact O-CG 3.24Å; I22-N26 PolarHBondContact O-N 2.81Å; I22-N26 PolarHBondContact O-ND2 3Å; N26-W28 VanDerWaalsContact C-N 3.35Å; N26-W28 PolarHBondContact O-N 3.26Å; N26-K29 PolarHBondContact O-N 2.88Å; N26-I30 WeakPolarHBondContact O-CD1 3.39Å; N26-I30 WeakPolarHBondContact O-CG1 3.3Å; N26-I30 PolarHBondContact O-N 2.83Å; N26-I30 VanDerWaalsContact O-N 3.14Å
27	A	69	Low	69.5	Low	58 Å²	58	106.3 Å²	106.3	48%	0.479	56%	0.564	S	S	.	*	H	α-helix	trans	-63	-40.3	174.1	0	0	0	0	0	112	S23 L24 I30 G31	S23-A27 VanDerWaalsContact O-CB 3.3Å; S23-A27 WeakPolarHBondContact O-CB 3.45Å; S23-A27 PolarHBondContact O-N 3.36Å; L24-A27 PolarHBondContact O-N 2.94Å; A27-I30 PolarHBondContact O-N 3.27Å; A27-G31 PolarHBondContact O-N 3.35Å
28	W	64.3	Low	67.8	Low	165 Å²	165	109.2 Å²	109.2	63%	0.625	58%	0.577	S	S	*	*	H	α-helix	trans	-63.5	-45.1	176.2	-161.9	-45.1	0	0	0	111	L24 T25 N26 I30 G31 K32	L24-W28 WeakPolarHBondContact O-CB 3.42Å; L24-W28 PolarHBondContact O-N 3.16Å; T25-W28 PolarHBondContact O-N 3.24Å; N26-W28 VanDerWaalsContact C-N 3.35Å; N26-W28 PolarHBondContact O-N 3.26Å; W28-I30 PolarHBondContact O-N 3.23Å; W28-G31 PolarHBondContact O-N 2.94Å; W28-G31 VanDerWaalsContact O-N 3.11Å; W28-K32 PolarHBondContact O-N 2.97Å
29	K	65.4	Low	66.1	Low	151 Å²	151	108.8 Å²	108.8	66%	0.657	59%	0.585	S	S	*	*	H	α-helix	trans	-57.5	-37.3	176.3	-79.1	-178.5	178.2	-179	0	112	T25 N26	T25-K29 WeakPolarHBondContact O-CG 3.32Å; T25-K29 PolarHBondContact O-N 3.27Å; N26-K29 PolarHBondContact O-N 2.88Å
30	I	58.3	Low	64.4	Low	115 Å²	115	113.1 Å²	113.1	59%	0.59	60%	0.599	S	S	*	*	H	α-helix	trans	-73.6	-37	176.9	-63.5	158.1	0	0	0	111.3	N26 A27 W28 K32 I33	N26-I30 WeakPolarHBondContact O-CD1 3.39Å; N26-I30 WeakPolarHBondContact O-CG1 3.3Å; N26-I30 PolarHBondContact O-N 2.83Å; N26-I30 VanDerWaalsContact O-N 3.14Å; A27-I30 PolarHBondContact O-N 3.27Å; W28-I30 PolarHBondContact O-N 3.23Å; I30-K32 VanDerWaalsContact C-N 3.26Å; I30-K32 PolarHBondContact O-N 2.93Å; I30-I33 WeakPolarHBondContact O-CB 3.43Å; I30-I33 PolarHBondContact O-N 2.86Å; I30-I33 VanDerWaalsContact O-N 3.11Å
31	G	56.5	Low	62.3	Low	68 Å²	68	116.4 Å²	116.4	70%	0.701	61%	0.611	S	S	*	*	H	α-helix	trans	-71	-16.2	175.4	0	0	0	0	0	115	A27 W28	A27-G31 PolarHBondContact O-N 3.35Å; W28-G31 PolarHBondContact O-N 2.94Å; W28-G31 VanDerWaalsContact O-N 3.11Å
32	K	55	Low	60.5	Low	154 Å²	154	118 Å²	118	67%	0.67	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-5.2	169.6	-83.9	-171.7	176.3	-172.8	0	113.6	W28 I30 E34	W28-K32 PolarHBondContact O-N 2.97Å; I30-K32 VanDerWaalsContact C-N 3.26Å; I30-K32 PolarHBondContact O-N 2.93Å; K32-E34 PolarHBondContact O-N 3.37Å
33	I	54.1	Low	58.7	Low	112 Å²	112	124.6 Å²	124.6	57%	0.574	65%	0.646	S	S	*	*	S	Bend	trans	-71.9	97.5	164.9	-58	171.1	0	0	0	103.9	I30 I35	I30-I33 WeakPolarHBondContact O-CB 3.43Å; I30-I33 PolarHBondContact O-N 2.86Å; I30-I33 VanDerWaalsContact O-N 3.11Å; I33-I35 PolarHBondContact O-N 3.4Å
34	E	53.2	Low	57.1	Low	178 Å²	178	129.3 Å²	129.3	83%	0.832	66%	0.662	S	S	*	*			trans	-45	108.1	165.4	-73	171	165.5	0	0	106.4	K32 P36	K32-E34 PolarHBondContact O-N 3.37Å; E34-P36 VanDerWaalsContact O-CD 3.22Å; E34-P36 WeakPolarHBondContact O-CD 3.1Å
35	I	51.4	Low	55.5	Low	152 Å²	152	130.4 Å²	130.4	78%	0.779	66%	0.664	S	S	*	*			trans	-58.2	113.7	164.8	-63.7	168.9	0	0	0	102.7	I33 N37	I33-I35 PolarHBondContact O-N 3.4Å; I35-N37 PolarHBondContact O-N 3.44Å
36	P	48.8	Very low	53.9	Low	93 Å²	93	131.5 Å²	131.5	60%	0.604	68%	0.675	S	S	*	*			trans	-54	121.6	179.6	21.6	-30.7	0	0	0	106.5	E34 D38	E34-P36 VanDerWaalsContact O-CD 3.22Å; E34-P36 WeakPolarHBondContact O-CD 3.1Å; P36-D38 VanDerWaalsContact C-N 3.3Å; P36-D38 PolarHBondContact O-N 3.34Å
37	N	46.7	Very low	52.5	Low	90 Å²	90	135.4 Å²	135.4	48%	0.481	69%	0.69	S	S	.	*			trans	-62.6	102.5	170	-175.2	14.9	0	0	0	104.8	I35 N39 E40	I35-N37 PolarHBondContact O-N 3.44Å; N37-N39 PolarHBondContact O-N 2.97Å; N37-E40 PolarHBondContact ND2-OE2 3.28Å; N37-E40 PolarHBondContact O-N 3.31Å
38	D	55.1	Low	51.6	Low	141 Å²	141	141.7 Å²	141.7	75%	0.754	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-0	-178.7	-70.4	-30.4	0	0	0	113.4	P36	P36-D38 VanDerWaalsContact C-N 3.3Å; P36-D38 PolarHBondContact O-N 3.34Å
39	N	55.7	Low	51	Low	143 Å²	143	143.2 Å²	143.2	77%	0.765	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-2.4	-174.1	-59.2	-29.5	0	0	0	114.8	N37	N37-N39 PolarHBondContact O-N 2.97Å
40	E	52.8	Low	50.5	Low	151 Å²	151	138.6 Å²	138.6	71%	0.706	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	-11.7	-165.8	-133.7	160.9	-175	0	0	118.3	N37	N37-E40 PolarHBondContact ND2-OE2 3.28Å; N37-E40 PolarHBondContact O-N 3.31Å
41	E	45.1	Very low	50.5	Low	183 Å²	183	138.9 Å²	138.9	86%	0.855	71%	0.705	S	S	*	*			trans	-145.4	51.5	179.6	-65.2	-171.3	171.3	0	0	114.5	R43	E41-R43 PolarHBondContact O-N 2.91Å
42	V	47.9	Very low	50.6	Low	127 Å²	127	140.8 Å²	140.8	77%	0.77	70%	0.704	S	S	*	*			trans	-84.9	58.3	153	-169.6	0	0	0	0	108.4	M44	V42-M44 HydrophobicContact CG1-CB 4.42Å; V42-M44 HydrophobicContact CG1-CG 3.9Å; V42-M44 PolarHBondContact O-N 3.06Å; V42-M44 VanDerWaalsContact O-N 3.14Å
43	R	46	Very low	51.1	Low	199 Å²	199	137.3 Å²	137.3	75%	0.751	70%	0.696	S	S	*	*			trans	-83.2	70.6	157.9	-150.1	178.6	86.3	-169.3	1.7	106.6	E41 E45	E41-R43 PolarHBondContact O-N 2.91Å; R43-E45 VanDerWaalsContact CD-OE2 3.23Å; R43-E45 WeakPolarHBondContact CD-OE2 3.33Å; R43-E45 HydrophobicContact CG-CB 4.16Å; R43-E45 HydrophobicContact CG-CG 3.86Å; R43-E45 WeakPolarHBondContact CG-OE2 3.31Å; R43-E45 IonicContact CZ-OE2 3.73Å; R43-E45 IonicContact NE-OE2 3.01Å; R43-E45 PolarHBondContact NE-OE2 3.2Å; R43-E45 PolarHBondContact O-N 3.46Å
44	M	45.5	Very low	51.4	Low	177 Å²	177	135.9 Å²	135.9	87%	0.872	69%	0.689	S	S	*	*			trans	-70.7	66	162.5	-76.4	-138.7	-61.8	0	0	108.2	V42	V42-M44 HydrophobicContact CG1-CB 4.42Å; V42-M44 HydrophobicContact CG1-CG 3.9Å; V42-M44 PolarHBondContact O-N 3.06Å; V42-M44 VanDerWaalsContact O-N 3.14Å
45	E	44.9	Very low	51.7	Low	126 Å²	126	136.4 Å²	136.4	59%	0.589	68%	0.684	S	S	*	*			trans	-99.8	112.1	167.7	-80.6	-179.9	164.2	0	0	107.7	R43	R43-E45 VanDerWaalsContact CD-OE2 3.23Å; R43-E45 WeakPolarHBondContact CD-OE2 3.33Å; R43-E45 HydrophobicContact CG-CB 4.16Å; R43-E45 HydrophobicContact CG-CG 3.86Å; R43-E45 WeakPolarHBondContact CG-OE2 3.31Å; R43-E45 IonicContact CZ-OE2 3.73Å; R43-E45 IonicContact NE-OE2 3.01Å; R43-E45 PolarHBondContact NE-OE2 3.2Å; R43-E45 PolarHBondContact O-N 3.46Å
46	S	43.3	Very low	52.2	Low	97 Å²	97	134.8 Å²	134.8	68%	0.678	67%	0.673	S	S	*	*			trans	56.6	76.8	134.9	70.5	0	0	0	0	117.4
47	E	44.8	Very low	53	Low	163 Å²	163	139 Å²	139	76%	0.762	68%	0.677	S	S	*	*			trans	-131.7	78.6	135.9	-73.1	-169.4	161.6	0	0	107.3	I50	E47-I50 HydrophobicContact CB-CD1 4.46Å
48	E	49.7	Very low	53.8	Low	190 Å²	190	142.8 Å²	142.8	89%	0.888	68%	0.684	S	S	*	*			trans	-47.3	143.8	148.9	-69.5	175	142.2	0	0	107.9
49	E	51.9	Low	54.2	Low	197 Å²	197	142.6 Å²	142.6	92%	0.921	68%	0.677	S	S	*	*			trans	90.2	26.2	177.3	-132.3	170.9	-146.2	0	0	118.1	E51	E49-E51 PolarHBondContact O-N 2.98Å
50	I	53.3	Low	54.5	Low	55 Å²	55	142.8 Å²	142.8	28%	0.282	67%	0.667	S	S	.	*			trans	-76.1	108.1	171.9	-64.6	172.3	0	0	0	111.2	E47 L54	E47-I50 HydrophobicContact CB-CD1 4.46Å; I50-L54 HydrophobicContact CG2-CB 3.36Å; I50-L54 HydrophobicContact CG2-CD1 3.71Å; I50-L54 HydrophobicContact CG2-CG 4.16Å
51	E	59.1	Low	55	Low	121 Å²	121	140.1 Å²	140.1	57%	0.565	66%	0.657	S	S	*	*			trans	-32.2	144.3	172.3	-85.9	-176.6	155.1	0	0	115.1	E49 T53 L54	E49-E51 PolarHBondContact O-N 2.98Å; E51-T53 PolarHBondContact O-N 3.49Å; E51-T53 PolarHBondContact OE2-OG1 3.42Å; E51-L54 PolarHBondContact O-N 3.02Å
52	P	59.1	Low	55.8	Low	107 Å²	107	134 Å²	134	70%	0.695	63%	0.633	S	S	*	*	H	α-helix	trans	-55.7	-27.8	178.2	23.2	-33.1	0	0	0	113.2	Q56	P52-Q56 PolarHBondContact O-N 3.27Å
53	T	64.1	Low	56.3	Low	82 Å²	82	132.1 Å²	132.1	50%	0.503	62%	0.616	S	S	.	*	H	α-helix	trans	-62.1	-39.3	175.9	4.7	0	0	0	0	113.3	E51 Q56 R57	E51-T53 PolarHBondContact O-N 3.49Å; E51-T53 PolarHBondContact OE2-OG1 3.42Å; T53-Q56 PolarHBondContact O-N 3.28Å; T53-R57 PolarHBondContact O-N 3.42Å
54	L	60.5	Low	56.9	Low	81 Å²	81	127.7 Å²	127.7	42%	0.424	61%	0.607	S	S	.	*	H	α-helix	trans	-77.9	-33	-178.2	-73.9	173.7	0	0	0	112.1	I50 E51 Q56 R57 R58	I50-L54 HydrophobicContact CG2-CB 3.36Å; I50-L54 HydrophobicContact CG2-CD1 3.71Å; I50-L54 HydrophobicContact CG2-CG 4.16Å; E51-L54 PolarHBondContact O-N 3.02Å; L54-Q56 VanDerWaalsContact C-N 3.3Å; L54-Q56 PolarHBondContact O-N 3.49Å; L54-R57 PolarHBondContact O-N 3.28Å; L54-R58 PolarHBondContact O-N 3.15Å
55	R	60.3	Low	57.5	Low	190 Å²	190	128.4 Å²	128.4	72%	0.717	60%	0.601	S	S	*	*	H	α-helix	trans	-60.3	-42.2	168.6	-74.4	-172.8	179.5	-168.7	-0.7	111.4	R58 K59	R55-R58 PolarHBondContact O-N 3.32Å; R55-K59 PolarHBondContact O-N 2.99Å
56	Q	62.7	Low	58	Low	118 Å²	118	129.5 Å²	129.5	55%	0.551	61%	0.606	S	S	*	*	H	α-helix	trans	-65.3	-45.5	178.3	-156	172.9	0.8	0	0	110.8	P52 T53 L54 R58 K59 W60	P52-Q56 PolarHBondContact O-N 3.27Å; T53-Q56 PolarHBondContact O-N 3.28Å; L54-Q56 VanDerWaalsContact C-N 3.3Å; L54-Q56 PolarHBondContact O-N 3.49Å; Q56-R58 PolarHBondContact O-N 3.09Å; Q56-K59 WeakPolarHBondContact O-CB 3.41Å; Q56-K59 PolarHBondContact O-N 3.25Å; Q56-K59 VanDerWaalsContact O-N 3.14Å; Q56-W60 PolarHBondContact O-N 2.96Å
57	R	64.8	Low	58.4	Low	180 Å²	180	126.4 Å²	126.4	68%	0.679	59%	0.589	S	S	*	*	H	α-helix	trans	-57.6	-45	173.9	-91.5	-170	178.7	-164.6	1.7	113	T53 L54 K59 W60 I61	T53-R57 PolarHBondContact O-N 3.42Å; L54-R57 PolarHBondContact O-N 3.28Å; R57-K59 VanDerWaalsContact C-N 3.3Å; R57-K59 PolarHBondContact O-N 3.11Å; R57-W60 PolarHBondContact O-N 3.04Å; R57-I61 VanDerWaalsContact O-CG1 3.28Å; R57-I61 WeakPolarHBondContact O-CG1 3.38Å; R57-I61 PolarHBondContact O-N 2.82Å
58	R	63.9	Low	58.9	Low	170 Å²	170	124.4 Å²	124.4	64%	0.642	58%	0.584	S	S	*	*	H	α-helix	trans	-60.7	-39.2	175.7	-76.5	-170.4	-162.7	-177.8	6	111.9	L54 R55 Q56 I61 S62	L54-R58 PolarHBondContact O-N 3.15Å; R55-R58 PolarHBondContact O-N 3.32Å; Q56-R58 PolarHBondContact O-N 3.09Å; R58-I61 PolarHBondContact O-N 3.45Å; R58-S62 WeakPolarHBondContact O-CB 3.26Å; R58-S62 PolarHBondContact O-N 3Å; R58-S62 PolarHBondContact O-OG 3.39Å
59	K	63.5	Low	59.1	Low	137 Å²	137	115.9 Å²	115.9	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-39.4	176.3	-166	176.8	-178.3	179.2	0	112.6	R55 Q56 R57 S62 Q63	R55-K59 PolarHBondContact O-N 2.99Å; Q56-K59 WeakPolarHBondContact O-CB 3.41Å; Q56-K59 PolarHBondContact O-N 3.25Å; Q56-K59 VanDerWaalsContact O-N 3.14Å; R57-K59 VanDerWaalsContact C-N 3.3Å; R57-K59 PolarHBondContact O-N 3.11Å; K59-S62 PolarHBondContact O-OG 3.3Å; K59-Q63 WeakPolarHBondContact O-CB 3.47Å; K59-Q63 WeakPolarHBondContact O-CG 3.37Å; K59-Q63 PolarHBondContact O-N 2.96Å; K59-Q63 VanDerWaalsContact O-N 3.1Å
60	W	62.5	Low	59.3	Low	148 Å²	148	111.5 Å²	111.5	56%	0.561	53%	0.533	S	S	*	.	H	α-helix	trans	-65.7	-43.3	173.7	-76.6	106.2	0	0	0	111.8	Q56 R57 Q63 L64	Q56-W60 PolarHBondContact O-N 2.96Å; R57-W60 PolarHBondContact O-N 3.04Å; W60-Q63 PolarHBondContact O-N 3.36Å; W60-L64 PolarHBondContact O-N 3.4Å
61	I	62.3	Low	59.7	Low	95 Å²	95	116.4 Å²	116.4	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-66.9	-42.1	178.8	-66.1	166.7	0	0	0	110.6	R57 R58 Q63 L64 Y65	R57-I61 VanDerWaalsContact O-CG1 3.28Å; R57-I61 WeakPolarHBondContact O-CG1 3.38Å; R57-I61 PolarHBondContact O-N 2.82Å; R58-I61 PolarHBondContact O-N 3.45Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 2.99Å; I61-L64 WeakPolarHBondContact O-CB 3.43Å; I61-L64 PolarHBondContact O-N 3.11Å; I61-L64 VanDerWaalsContact O-N 3.09Å; I61-Y65 HydrophobicContact CG2-CD2 3.77Å; I61-Y65 HydrophobicContact CG2-CE2 3.98Å; I61-Y65 WeakPolarHBondContact O-CD2 3.32Å; I61-Y65 PolarHBondContact O-N 3.48Å
62	S	62.2	Low	59.4	Low	53 Å²	53	112.8 Å²	112.8	37%	0.371	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-36.3	177	71	0	0	0	0	112	R58 K59 L64 H66	R58-S62 WeakPolarHBondContact O-CB 3.26Å; R58-S62 PolarHBondContact O-N 3Å; R58-S62 PolarHBondContact O-OG 3.39Å; K59-S62 PolarHBondContact O-OG 3.3Å; S62-L64 VanDerWaalsContact C-N 3.34Å; S62-H66 WeakPolarHBondContact O-CB 3.44Å; S62-H66 PolarHBondContact O-CD2 3.03Å; S62-H66 PolarHBondContact O-N 3.48Å
63	Q	57.6	Low	59	Low	88 Å²	88	112.6 Å²	112.6	41%	0.411	52%	0.522	S	S	.	.	H	α-helix	trans	-69.3	-30	173.4	-76.2	179.1	-20.2	0	0	112.9	K59 W60 I61	K59-Q63 WeakPolarHBondContact O-CB 3.47Å; K59-Q63 WeakPolarHBondContact O-CG 3.37Å; K59-Q63 PolarHBondContact O-N 2.96Å; K59-Q63 VanDerWaalsContact O-N 3.1Å; W60-Q63 PolarHBondContact O-N 3.36Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 2.99Å
64	L	59.8	Low	58.4	Low	107 Å²	107	110.8 Å²	110.8	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-71.4	-40.5	174.4	-131.2	99.9	0	0	0	112.3	W60 I61 S62 L69	W60-L64 PolarHBondContact O-N 3.4Å; I61-L64 WeakPolarHBondContact O-CB 3.43Å; I61-L64 PolarHBondContact O-N 3.11Å; I61-L64 VanDerWaalsContact O-N 3.09Å; S62-L64 VanDerWaalsContact C-N 3.34Å; L64-L69 HydrophobicContact CB-CD1 4.42Å; L64-L69 HydrophobicContact CD1-CD1 3.83Å; L64-L69 HydrophobicContact CG-CD1 3.84Å
65	Y	57.4	Low	58	Low	191 Å²	191	112.5 Å²	112.5	75%	0.749	53%	0.529	S	S	*	.	H	α-helix	trans	-81.9	-29.1	-177.4	-88.8	-93.4	0	0	0	113.9	I61	I61-Y65 HydrophobicContact CG2-CD2 3.77Å; I61-Y65 HydrophobicContact CG2-CE2 3.98Å; I61-Y65 WeakPolarHBondContact O-CD2 3.32Å; I61-Y65 PolarHBondContact O-N 3.48Å
66	H	55.6	Low	57.5	Low	150 Å²	150	108 Å²	108	69%	0.694	52%	0.519	S	S	*	.	S	Bend	trans	-95.3	15.7	180	-73.5	-66.9	0	0	0	115.2	S62 D68	S62-H66 WeakPolarHBondContact O-CB 3.44Å; S62-H66 PolarHBondContact O-CD2 3.03Å; S62-H66 PolarHBondContact O-N 3.48Å; H66-D68 VanDerWaalsContact C-N 3.31Å; H66-D68 PolarHBondContact O-N 3.28Å; H66-D68 VanDerWaalsContact O-N 3.16Å
67	G	50.4	Low	56.8	Low	31 Å²	31	111.2 Å²	111.2	32%	0.32	53%	0.526	S	S	.	.	S	Bend	trans	77.4	3.1	157.4	0	0	0	0	0	117.4	L69	G67-L69 VanDerWaalsContact C-N 3.35Å; G67-L69 PolarHBondContact O-N 2.99Å
68	D	56	Low	56.1	Low	121 Å²	121	105.5 Å²	105.5	65%	0.647	52%	0.517	S	S	*	.			trans	-97.6	31	-177.9	-72.4	-17.6	0	0	0	113.4	H66	H66-D68 VanDerWaalsContact C-N 3.31Å; H66-D68 PolarHBondContact O-N 3.28Å; H66-D68 VanDerWaalsContact O-N 3.16Å
69	L	55.2	Low	55.4	Low	11 Å²	11	100.6 Å²	100.6	6%	0.058	51%	0.513	C	S	.	.			trans	-75.3	127.9	170.4	-77.2	160.6	0	0	0	109.3	L64 G67 W71 I72 H73	L64-L69 HydrophobicContact CB-CD1 4.42Å; L64-L69 HydrophobicContact CD1-CD1 3.83Å; L64-L69 HydrophobicContact CG-CD1 3.84Å; G67-L69 VanDerWaalsContact C-N 3.35Å; G67-L69 PolarHBondContact O-N 2.99Å; L69-W71 HydrophobicContact CB-CD2 4.16Å; L69-W71 HydrophobicContact CB-CG 4.46Å; L69-W71 HydrophobicContact CB-CZ2 4.14Å; L69-W71 HydrophobicContact CD1-CZ2 3.67Å; L69-W71 HydrophobicContact CD2-CH2 3.52Å; L69-W71 HydrophobicContact CD2-CZ2 3.39Å; L69-W71 HydrophobicContact CD2-CZ3 4.14Å; L69-W71 HydrophobicContact CG-CZ2 3.92Å; L69-W71 PolarHBondContact O-N 3.49Å; L69-I72 HydrophobicContact CB-CB 4.3Å; L69-I72 HydrophobicContact CB-CD1 3.75Å; L69-I72 HydrophobicContact CB-CG1 3.77Å; L69-I72 HydrophobicContact CD1-CD1 3.71Å; L69-I72 HydrophobicContact CD1-CG1 4.43Å; L69-I72 HydrophobicContact CG-CD1 4.3Å; L69-I72 WeakPolarHBondContact O-CA 3.29Å; L69-I72 WeakPolarHBondContact O-CB 3.39Å; L69-I72 PolarHBondContact O-N 3.04Å; L69-H73 PolarHBondContact O-N 3.47Å
70	P	55.9	Low	54.8	Low	106 Å²	106	99.1 Å²	99.1	69%	0.688	52%	0.515	S	S	*	.	H	α-helix	trans	-54.8	-29.5	-175.2	-25.7	31.7	0	0	0	114.1
71	W	60.3	Low	54.2	Low	158 Å²	158	98.4 Å²	98.4	60%	0.598	52%	0.523	S	S	*	.	H	α-helix	trans	-78.8	-25.3	176.8	57.9	74.5	0	0	0	113.7	L69 G74 L75	L69-W71 HydrophobicContact CB-CD2 4.16Å; L69-W71 HydrophobicContact CB-CG 4.46Å; L69-W71 HydrophobicContact CB-CZ2 4.14Å; L69-W71 HydrophobicContact CD1-CZ2 3.67Å; L69-W71 HydrophobicContact CD2-CH2 3.52Å; L69-W71 HydrophobicContact CD2-CZ2 3.39Å; L69-W71 HydrophobicContact CD2-CZ3 4.14Å; L69-W71 HydrophobicContact CG-CZ2 3.92Å; L69-W71 PolarHBondContact O-N 3.49Å; W71-G74 PolarHBondContact O-N 3.37Å; W71-L75 PolarHBondContact O-N 2.91Å
72	I	54.5	Low	53.4	Low	45 Å²	45	101.4 Å²	101.4	23%	0.231	54%	0.535	C	S	.	.	H	α-helix	trans	-72.8	-33.5	175.7	-60.5	-177.9	0	0	0	110.1	L69 G74 L75 N76	L69-I72 HydrophobicContact CB-CB 4.3Å; L69-I72 HydrophobicContact CB-CD1 3.75Å; L69-I72 HydrophobicContact CB-CG1 3.77Å; L69-I72 HydrophobicContact CD1-CD1 3.71Å; L69-I72 HydrophobicContact CD1-CG1 4.43Å; L69-I72 HydrophobicContact CG-CD1 4.3Å; L69-I72 WeakPolarHBondContact O-CA 3.29Å; L69-I72 WeakPolarHBondContact O-CB 3.39Å; L69-I72 PolarHBondContact O-N 3.04Å; I72-G74 PolarHBondContact O-N 3.3Å; I72-L75 PolarHBondContact O-N 2.86Å; I72-L75 VanDerWaalsContact O-N 3.16Å; I72-N76 WeakPolarHBondContact O-CB 2.98Å; I72-N76 PolarHBondContact O-N 3.4Å
73	H	49.9	Very low	52.6	Low	102 Å²	102	108.4 Å²	108.4	47%	0.472	55%	0.553	S	S	.	*	H	α-helix	trans	-59.3	-30.2	169.5	-88.8	-59.7	0	0	0	113.1	L69 R77	L69-H73 PolarHBondContact O-N 3.47Å; H73-R77 WeakPolarHBondContact O-CB 2.98Å; H73-R77 WeakPolarHBondContact O-CG 3.38Å; H73-R77 PolarHBondContact O-N 3.08Å
74	G	50.8	Low	51.8	Low	44 Å²	44	112 Å²	112	45%	0.454	57%	0.574	S	S	.	*	H	α-helix	trans	-71.6	-42.6	173.2	0	0	0	0	0	113.1	W71 I72 R77 A78	W71-G74 PolarHBondContact O-N 3.37Å; I72-G74 PolarHBondContact O-N 3.3Å; G74-R77 PolarHBondContact O-N 3.4Å; G74-A78 PolarHBondContact O-N 3.18Å
75	L	52.1	Low	51	Low	118 Å²	118	116.3 Å²	116.3	62%	0.618	58%	0.584	S	S	*	*	H	α-helix	trans	-69.8	-40.4	178.7	-80	157.1	0	0	0	112.6	W71 I72 A78 A79	W71-L75 PolarHBondContact O-N 2.91Å; I72-L75 PolarHBondContact O-N 2.86Å; I72-L75 VanDerWaalsContact O-N 3.16Å; L75-A78 PolarHBondContact O-N 3.01Å; L75-A79 PolarHBondContact O-N 3.01Å; L75-A79 VanDerWaalsContact O-N 3.09Å
76	N	50.8	Low	50.5	Low	95 Å²	95	113.7 Å²	113.7	51%	0.508	58%	0.583	S	S	.	*	H	α-helix	trans	-69.2	-32.8	175.5	-77	-17.2	0	0	0	111.9	I72 A79 V80	I72-N76 WeakPolarHBondContact O-CB 2.98Å; I72-N76 PolarHBondContact O-N 3.4Å; N76-A79 PolarHBondContact O-N 2.9Å; N76-V80 VanDerWaalsContact O-CB 3.31Å; N76-V80 WeakPolarHBondContact O-CB 3.22Å; N76-V80 WeakPolarHBondContact O-CG2 3.43Å; N76-V80 PolarHBondContact O-N 2.85Å
77	R	47.4	Very low	49.9	Very low	185 Å²	185	113.4 Å²	113.4	70%	0.698	59%	0.592	S	S	*	*	H	α-helix	trans	-69.1	-32.9	171	-81.1	-178.8	176.7	175.5	1.4	113.2	H73 G74 N81	H73-R77 WeakPolarHBondContact O-CB 2.98Å; H73-R77 WeakPolarHBondContact O-CG 3.38Å; H73-R77 PolarHBondContact O-N 3.08Å; G74-R77 PolarHBondContact O-N 3.4Å; R77-N81 PolarHBondContact O-N 3.44Å
78	A	49.6	Very low	49.7	Very low	61 Å²	61	118.7 Å²	118.7	50%	0.504	61%	0.611	S	S	.	*	H	α-helix	trans	-69.6	-35.3	176	0	0	0	0	0	112.3	G74 L75	G74-A78 PolarHBondContact O-N 3.18Å; L75-A78 PolarHBondContact O-N 3.01Å
79	A	50.1	Low	49.2	Very low	66 Å²	66	123.8 Å²	123.8	55%	0.545	62%	0.622	S	S	.	*	H	α-helix	trans	-80.4	-32.9	177.4	0	0	0	0	0	113.5	L75 N76 N81	L75-A79 PolarHBondContact O-N 3.01Å; L75-A79 VanDerWaalsContact O-N 3.09Å; N76-A79 PolarHBondContact O-N 2.9Å; A79-N81 VanDerWaalsContact C-N 3.29Å; A79-N81 PolarHBondContact O-N 2Å
80	V	51	Low	48.6	Very low	107 Å²	107	134.3 Å²	134.3	65%	0.648	66%	0.661	S	S	*	*	H	α-helix	trans	-72.1	-21.7	-179.9	169.8	0	0	0	0	112.9	N76	N76-V80 VanDerWaalsContact O-CB 3.31Å; N76-V80 WeakPolarHBondContact O-CB 3.22Å; N76-V80 WeakPolarHBondContact O-CG2 3.43Å; N76-V80 PolarHBondContact O-N 2.85Å
81	N	49.1	Very low	48.2	Very low	133 Å²	133	138.4 Å²	138.4	71%	0.711	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	8	179.9	-78.4	-21.6	0	0	0	115.2	R77 A79 R83	R77-N81 PolarHBondContact O-N 3.44Å; A79-N81 VanDerWaalsContact C-N 3.29Å; A79-N81 PolarHBondContact O-N 2Å; N81-R83 VanDerWaalsContact C-N 3.28Å; N81-R83 PolarHBondContact O-N 3.43Å
82	Q	46.2	Very low	47.9	Very low	158 Å²	158	141 Å²	141	74%	0.738	68%	0.68	S	S	*	*			trans	-88.3	17.5	176.5	-74	-172.5	-12.4	0	0	114.4	L84	Q82-L84 PolarHBondContact O-N 3.15Å
83	R	44.3	Very low	47.8	Very low	199 Å²	199	148.8 Å²	148.8	75%	0.751	71%	0.707	S	S	*	*	S	Bend	trans	-63.9	106.9	158.4	-80.4	-173.8	178.8	174.1	1.3	107.8	N81 Y85	N81-R83 VanDerWaalsContact C-N 3.28Å; N81-R83 PolarHBondContact O-N 3.43Å; R83-Y85 VanDerWaalsContact C-N 3.28Å; R83-Y85 HydrophobicContact CB-CD2 4.14Å; R83-Y85 HydrophobicContact CB-CE2 4.22Å; R83-Y85 PolarHBondContact O-N 3.46Å
84	L	42.3	Very low	47.9	Very low	165 Å²	165	150.9 Å²	150.9	86%	0.864	72%	0.715	S	S	*	*			trans	-50.9	92.3	167.8	-89.4	90.6	0	0	0	109.3	Q82 N86	Q82-L84 PolarHBondContact O-N 3.15Å; L84-N86 PolarHBondContact O-N 3.44Å
85	Y	42	Very low	47.9	Very low	197 Å²	197	156.4 Å²	156.4	77%	0.773	73%	0.727	S	S	*	*			trans	-87.4	106	165.3	-95.5	-86.4	0	0	0	107.8	R83 T87	R83-Y85 VanDerWaalsContact C-N 3.28Å; R83-Y85 HydrophobicContact CB-CD2 4.14Å; R83-Y85 HydrophobicContact CB-CE2 4.22Å; R83-Y85 PolarHBondContact O-N 3.46Å; Y85-T87 PolarHBondContact O-N 3.43Å
86	N	47.3	Very low	48	Very low	135 Å²	135	154.2 Å²	154.2	72%	0.722	72%	0.72	S	S	*	*			trans	-34.7	128.4	171.9	-75.2	-34.2	0	0	0	112.2	L84 I88	L84-N86 PolarHBondContact O-N 3.44Å; N86-I88 PolarHBondContact O-N 3.45Å
87	T	43.6	Very low	48.3	Very low	144 Å²	144	155.8 Å²	155.8	88%	0.883	73%	0.729	S	S	*	*			trans	-57.1	90.1	172.4	47.7	0	0	0	0	110.9	Y85	Y85-T87 PolarHBondContact O-N 3.43Å
88	I	45.8	Very low	48.8	Very low	142 Å²	142	153 Å²	153	73%	0.728	74%	0.735	S	S	*	*			trans	-130.2	94.2	167.6	-59.2	178.3	0	0	0	107.2	N86	N86-I88 PolarHBondContact O-N 3.45Å
89	R	45.2	Very low	49.5	Very low	228 Å²	228	159.4 Å²	159.4	86%	0.86	76%	0.756	S	S	*	*			trans	73.8	86.5	134.5	-130.1	174.8	-161.9	-177	2.6	117
90	R	43.4	Very low	49.4	Very low	233 Å²	233	158.5 Å²	158.5	88%	0.879	75%	0.754	S	S	*	*			trans	44.2	94.7	136.3	-66.5	-178.8	178.8	167.6	-0.5	117.3
91	E	47.4	Very low	50.1	Low	192 Å²	192	157.7 Å²	157.7	90%	0.897	75%	0.752	S	S	*	*			trans	-106.7	116.5	143.7	-77.2	-175.7	168.3	0	0	108.5	R93	E91-R93 PolarHBondContact O-N 3.08Å
92	R	52.4	Low	49.9	Very low	213 Å²	213	159.4 Å²	159.4	80%	0.804	77%	0.767	S	S	*	*			trans	-64.4	116.6	-175.5	-61.7	180	-160.6	-171.5	5	108.3	F94	R92-F94 PolarHBondContact O-N 3.42Å; R92-F94 VanDerWaalsContact O-N 3.1Å
93	R	52.6	Low	50.1	Low	207 Å²	207	159.5 Å²	159.5	78%	0.781	77%	0.768	S	S	*	*			trans	-65.5	106.4	166.2	-66.4	-178.7	179.7	-176.2	-1.7	108	E91 F95	E91-R93 PolarHBondContact O-N 3.08Å; R93-F95 HydrophobicContact CB-CD2 3.78Å; R93-F95 HydrophobicContact CB-CE2 3.79Å; R93-F95 VanDerWaalsContact CD-CE2 3.48Å; R93-F95 HydrophobicContact CG-CE2 4.28Å; R93-F95 PolarHBondContact O-N 2.76Å
94	F	51.8	Low	50.4	Low	146 Å²	146	157.4 Å²	157.4	64%	0.64	77%	0.769	S	S	*	*			trans	-75.9	102.4	155.6	-71.8	-71.7	0	0	0	106.7	R92 C96 V102	R92-F94 PolarHBondContact O-N 3.42Å; R92-F94 VanDerWaalsContact O-N 3.1Å; F94-C96 PolarHBondContact O-N 3.29Å; F94-V102 WeakPolarHBondContact CD1-O 3.2Å
95	F	51.9	Low	50.9	Low	161 Å²	161	157 Å²	157	71%	0.706	76%	0.764	S	S	*	*			trans	-81.5	104.8	169.6	-88.8	-86.3	0	0	0	107.6	R93	R93-F95 HydrophobicContact CB-CD2 3.78Å; R93-F95 HydrophobicContact CB-CE2 3.79Å; R93-F95 VanDerWaalsContact CD-CE2 3.48Å; R93-F95 HydrophobicContact CG-CE2 4.28Å; R93-F95 PolarHBondContact O-N 2.76Å
96	C	54.9	Low	51.4	Low	71 Å²	71	154.6 Å²	154.6	48%	0.48	76%	0.763	S	S	.	*			trans	-81.2	125.4	164.8	-53.2	0	0	0	0	108.8	F94 C101	F94-C96 PolarHBondContact O-N 3.29Å; C96-C101 HydrophobicContact CB-CB 3.94Å; C96-C101 WeakPolarHBondContact CB-SG 3.19Å; C96-C101 WeakPolarHBondContact SG-CB 2.96Å; C96-C101 CovalentContact SG-SG 2Å; C96-C101 PolarHBondContact SG-SG 3.1Å
97	N	56.7	Low	51.7	Low	129 Å²	129	155.9 Å²	155.9	69%	0.69	77%	0.766	S	S	*	*	B	Isolated β-bridge	trans	-101.7	166	166	-140.9	9.6	0	0	0	107.7	M99 G100	N97-M99 PolarHBondContact O-N 3.41Å; N97-G100 PolarHBondContact N-O 3.22Å; N97-G100 CarbonylContact O-C 3.59Å; N97-G100 PolarHBondContact O-N 2.86Å
98	P	57	Low	52.2	Low	126 Å²	126	156.7 Å²	156.7	82%	0.818	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	0.2	-169.1	25.4	-30.7	0	0	0	115.3
99	M	63.7	Low	52.7	Low	195 Å²	195	157.7 Å²	157.7	96%	0.961	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-4.8	171	-67.6	-87.4	-170.6	0	0	113.2	N97	N97-M99 PolarHBondContact O-N 3.41Å
100	G	48.4	Very low	53.2	Low	48 Å²	48	152.3 Å²	152.3	50%	0.495	75%	0.753	S	S	.	*	B	Isolated β-bridge	trans	132.3	162.7	-178.8	0	0	0	0	0	113.9	N97	N97-G100 PolarHBondContact N-O 3.22Å; N97-G100 CarbonylContact O-C 3.59Å; N97-G100 PolarHBondContact O-N 2.86Å
101	C	65.7	Low	54	Low	89 Å²	89	145.6 Å²	145.6	60%	0.601	74%	0.742	S	S	*	*			trans	-90.8	134.1	170	-52.3	0	0	0	0	109.4	C96	C96-C101 HydrophobicContact CB-CB 3.94Å; C96-C101 WeakPolarHBondContact CB-SG 3.19Å; C96-C101 WeakPolarHBondContact SG-CB 2.96Å; C96-C101 CovalentContact SG-SG 2Å; C96-C101 PolarHBondContact SG-SG 3.1Å
102	V	46.1	Very low	54.7	Low	170 Å²	170	141.4 Å²	141.4	100%	1.03	73%	0.728	S	S	*	*			trans	-84.7	0	160	-175.4	0	0	0	0	108.5	F94	F94-V102 WeakPolarHBondContact CD1-O 3.2Å

Retrieved 102 of 102 residues in 115.2 ms (Link to these results)

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