A0A5K4FFX0_SCHMA Loading...

MEG 2.2

AlphaFold DB , UniProt , Accession A0A5K4FFX0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 83 aa.

						>A0A5K4FFX0_SCHMA|A0A5K4FFX0
MKLSGANCLVVFSLLQLLVAFSHCDISAITCNKTVCCASEDGKTGPLCCEKDGCPSTPDLFLENYRRHRRMKNYLEEVCKYYI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	40.2	Very low	53.1	Low	240 Å²	240	121 Å²	121	100%	1.182	70%	0.696	S	S	*	*				0	141.1	0	-72.4	175	171.7	0	0	108.2
2	K	41.9	Very low	53.6	Low	204 Å²	204	122.4 Å²	122.4	89%	0.887	69%	0.688	S	S	*	*			trans	84.4	78.6	-171.9	-54.2	176.1	175.8	176.5	0	115.3
3	L	46.8	Very low	54.1	Low	154 Å²	154	118.4 Å²	118.4	81%	0.806	67%	0.673	S	S	*	*			trans	-146.7	9.1	153.8	-100	132.8	0	0	0	113.1	G5	L3-G5 VanDerWaalsContact C-N 3.3Å; L3-G5 PolarHBondContact O-N 3.3Å
4	S	53.7	Low	54.4	Low	112 Å²	112	116.4 Å²	116.4	78%	0.783	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	3.4	-173.7	-163.9	0	0	0	0	115.1
5	G	56.1	Low	54.6	Low	54 Å²	54	114.8 Å²	114.8	56%	0.557	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-27.7	-175.4	0	0	0	0	0	115.3	L3	L3-G5 VanDerWaalsContact C-N 3.3Å; L3-G5 PolarHBondContact O-N 3.3Å
6	A	54.6	Low	54.7	Low	59 Å²	59	115.4 Å²	115.4	49%	0.488	64%	0.643	S	S	.	*	H	α-helix	trans	-77.8	-30.4	-173.6	0	0	0	0	0	112.9	C8	A6-C8 PolarHBondContact O-N 3.3Å
7	N	57.8	Low	54.7	Low	121 Å²	121	112.4 Å²	112.4	65%	0.647	63%	0.625	S	S	*	*	H	α-helix	trans	-70.9	-30.8	-177.2	-72.1	-4.8	0	0	0	113	V11	N7-V11 VanDerWaalsContact O-CG2 3.22Å; N7-V11 WeakPolarHBondContact O-CG2 3.22Å; N7-V11 PolarHBondContact O-N 3.47Å
8	C	54.8	Low	54.6	Low	88 Å²	88	112.7 Å²	112.7	60%	0.595	63%	0.625	S	S	*	*	H	α-helix	trans	-71.4	-35.2	-179	-67.7	0	0	0	0	112.7	A6 F12	A6-C8 PolarHBondContact O-N 3.3Å; C8-F12 WeakPolarHBondContact O-CB 3.16Å; C8-F12 PolarHBondContact O-N 3.45Å
9	L	58.4	Low	54.5	Low	127 Å²	127	110.8 Å²	110.8	67%	0.665	62%	0.616	S	S	*	*	H	α-helix	trans	-68.2	-43.4	-179.9	-72.1	172.5	0	0	0	111.8	V11 F12 S13	L9-V11 VanDerWaalsContact C-N 3.33Å; L9-V11 PolarHBondContact O-N 3.21Å; L9-F12 PolarHBondContact O-N 3.41Å; L9-S13 PolarHBondContact O-N 3.02Å; L9-S13 PolarHBondContact O-OG 3.17Å
10	V	59.2	Low	54.3	Low	90 Å²	90	108.5 Å²	108.5	55%	0.545	61%	0.611	S	S	.	*	H	α-helix	trans	-63.7	-41.1	178.8	-180	0	0	0	0	111.1	F12 S13 L14	V10-F12 VanDerWaalsContact C-N 3.34Å; V10-S13 PolarHBondContact O-N 3.37Å; V10-L14 HydrophobicContact CG1-CD1 4.06Å; V10-L14 WeakPolarHBondContact O-CB 3.46Å; V10-L14 WeakPolarHBondContact O-CG 3.44Å; V10-L14 PolarHBondContact O-N 3.34Å
11	V	60.3	Low	53.9	Low	82 Å²	82	106.6 Å²	106.6	50%	0.497	60%	0.597	S	S	.	*	H	α-helix	trans	-64.6	-39.6	176	174	0	0	0	0	111.1	N7 L9 L14 L15	N7-V11 VanDerWaalsContact O-CG2 3.22Å; N7-V11 WeakPolarHBondContact O-CG2 3.22Å; N7-V11 PolarHBondContact O-N 3.47Å; L9-V11 VanDerWaalsContact C-N 3.33Å; L9-V11 PolarHBondContact O-N 3.21Å; V11-L14 PolarHBondContact O-N 2.93Å; V11-L15 HydrophobicContact CG1-CD1 3.89Å; V11-L15 WeakPolarHBondContact O-CB 3.44Å; V11-L15 PolarHBondContact O-N 2.93Å
12	F	59.7	Low	54.1	Low	138 Å²	138	99 Å²	99	61%	0.605	57%	0.567	S	S	*	*	H	α-helix	trans	-66.8	-40.4	176.7	-131.7	-90.6	0	0	0	112.3	C8 L9 V10 L15 Q16	C8-F12 WeakPolarHBondContact O-CB 3.16Å; C8-F12 PolarHBondContact O-N 3.45Å; L9-F12 PolarHBondContact O-N 3.41Å; V10-F12 VanDerWaalsContact C-N 3.34Å; F12-L15 PolarHBondContact O-N 2.96Å; F12-Q16 HydrophobicContact CD1-CG 4.48Å; F12-Q16 WeakPolarHBondContact O-CG 3.28Å; F12-Q16 PolarHBondContact O-N 2.92Å
13	S	60	Low	54.2	Low	70 Å²	70	96 Å²	96	49%	0.49	56%	0.556	S	S	.	*	H	α-helix	trans	-64.7	-40.7	175	-61.5	0	0	0	0	112.1	L9 V10 Q16 L17	L9-S13 PolarHBondContact O-N 3.02Å; L9-S13 PolarHBondContact O-OG 3.17Å; V10-S13 PolarHBondContact O-N 3.37Å; S13-Q16 PolarHBondContact O-N 3.38Å; S13-L17 WeakPolarHBondContact O-CB 3.5Å; S13-L17 PolarHBondContact O-N 2.88Å
14	L	57.9	Low	53.9	Low	91 Å²	91	91.7 Å²	91.7	48%	0.476	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-40.4	174.2	-78.2	162.1	0	0	0	112	V10 V11 L17 L18	V10-L14 HydrophobicContact CG1-CD1 4.06Å; V10-L14 WeakPolarHBondContact O-CB 3.46Å; V10-L14 WeakPolarHBondContact O-CG 3.44Å; V10-L14 PolarHBondContact O-N 3.34Å; V11-L14 PolarHBondContact O-N 2.93Å; L14-L17 WeakPolarHBondContact O-CB 3.42Å; L14-L17 PolarHBondContact O-N 3.49Å; L14-L18 WeakPolarHBondContact O-CB 3.49Å; L14-L18 PolarHBondContact O-N 2.7Å
15	L	58.5	Low	53.3	Low	92 Å²	92	90.6 Å²	90.6	48%	0.482	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-41	174.5	-91.7	150.2	0	0	0	112.1	V11 F12 L17 L18 V19	V11-L15 HydrophobicContact CG1-CD1 3.89Å; V11-L15 WeakPolarHBondContact O-CB 3.44Å; V11-L15 PolarHBondContact O-N 2.93Å; F12-L15 PolarHBondContact O-N 2.96Å; L15-L17 VanDerWaalsContact C-N 3.3Å; L15-L17 PolarHBondContact O-N 3.21Å; L15-L18 PolarHBondContact O-N 2.82Å; L15-V19 WeakPolarHBondContact O-CB 3.38Å; L15-V19 VanDerWaalsContact O-CG2 3.24Å; L15-V19 WeakPolarHBondContact O-CG2 3.21Å; L15-V19 PolarHBondContact O-N 3.45Å
16	Q	56	Low	52.8	Low	124 Å²	124	91.6 Å²	91.6	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-63.9	-38.6	173.7	-76	-175.7	-18.5	0	0	111.6	F12 S13 A20	F12-Q16 HydrophobicContact CD1-CG 4.48Å; F12-Q16 WeakPolarHBondContact O-CG 3.28Å; F12-Q16 PolarHBondContact O-N 2.92Å; S13-Q16 PolarHBondContact O-N 3.38Å; Q16-A20 WeakPolarHBondContact O-CB 3.4Å; Q16-A20 PolarHBondContact O-N 3.44Å
17	L	54.7	Low	52	Low	64 Å²	64	93.9 Å²	93.9	34%	0.335	53%	0.528	S	S	.	.	H	α-helix	trans	-61.7	-49.8	172.7	-141.6	90.6	0	0	0	110.5	S13 L14 L15 V19 A20 F21 Y82	S13-L17 WeakPolarHBondContact O-CB 3.5Å; S13-L17 PolarHBondContact O-N 2.88Å; L14-L17 WeakPolarHBondContact O-CB 3.42Å; L14-L17 PolarHBondContact O-N 3.49Å; L15-L17 VanDerWaalsContact C-N 3.3Å; L15-L17 PolarHBondContact O-N 3.21Å; L17-V19 PolarHBondContact O-N 3.02Å; L17-A20 PolarHBondContact O-N 2.87Å; L17-F21 HydrophobicContact CB-CD2 4.47Å; L17-F21 HydrophobicContact CD2-CD2 4.01Å; L17-F21 HydrophobicContact CD2-CE2 3.7Å; L17-F21 HydrophobicContact CG-CD2 3.79Å; L17-F21 HydrophobicContact CG-CE2 3.69Å; L17-F21 VanDerWaalsContact O-CB 3.27Å; L17-F21 WeakPolarHBondContact O-CB 3.47Å; L17-F21 WeakPolarHBondContact O-CD2 3.25Å; L17-F21 PolarHBondContact O-N 3Å; L17-Y82 HydrophobicContact CD2-CE1 3.9Å
18	L	52.3	Low	51.1	Low	119 Å²	119	90.3 Å²	90.3	62%	0.623	52%	0.515	S	S	*	.	H	α-helix	trans	-62.4	-38.6	178.7	-90	149	0	0	0	113.1	L14 L15 S22	L14-L18 WeakPolarHBondContact O-CB 3.49Å; L14-L18 PolarHBondContact O-N 2.7Å; L15-L18 PolarHBondContact O-N 2.82Å; L18-S22 WeakPolarHBondContact O-CB 3.5Å; L18-S22 PolarHBondContact O-N 3.49Å; L18-S22 PolarHBondContact O-OG 3.31Å
19	V	53	Low	50.6	Low	77 Å²	77	89.9 Å²	89.9	47%	0.467	51%	0.506	S	S	.	.	H	α-helix	trans	-70.8	-43.9	176.5	172.4	0	0	0	0	110.3	L15 L17 F21 S22 H23	L15-V19 WeakPolarHBondContact O-CB 3.38Å; L15-V19 VanDerWaalsContact O-CG2 3.24Å; L15-V19 WeakPolarHBondContact O-CG2 3.21Å; L15-V19 PolarHBondContact O-N 3.45Å; L17-V19 PolarHBondContact O-N 3.02Å; V19-F21 VanDerWaalsContact C-N 3.32Å; V19-F21 PolarHBondContact O-N 3.18Å; V19-S22 WeakPolarHBondContact CA-OG 3.38Å; V19-S22 PolarHBondContact O-N 3.23Å; V19-S22 PolarHBondContact O-OG 3.18Å; V19-H23 PolarHBondContact O-CD2 3.33Å; V19-H23 PolarHBondContact O-N 3.36Å
20	A	50.5	Low	49.6	Very low	63 Å²	63	88.6 Å²	88.6	52%	0.521	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-37.8	174.6	0	0	0	0	0	112	Q16 L17 C24	Q16-A20 WeakPolarHBondContact O-CB 3.4Å; Q16-A20 PolarHBondContact O-N 3.44Å; L17-A20 PolarHBondContact O-N 2.87Å; A20-C24 PolarHBondContact O-N 2.82Å
21	F	45.7	Very low	48.8	Very low	69 Å²	69	87.8 Å²	87.8	30%	0.303	50%	0.501	S	S	.	.	H	α-helix	trans	-73.7	-31.3	174.8	-86.5	-69.4	0	0	0	113	L17 V19 H23 C24 I26	L17-F21 HydrophobicContact CB-CD2 4.47Å; L17-F21 HydrophobicContact CD2-CD2 4.01Å; L17-F21 HydrophobicContact CD2-CE2 3.7Å; L17-F21 HydrophobicContact CG-CD2 3.79Å; L17-F21 HydrophobicContact CG-CE2 3.69Å; L17-F21 VanDerWaalsContact O-CB 3.27Å; L17-F21 WeakPolarHBondContact O-CB 3.47Å; L17-F21 WeakPolarHBondContact O-CD2 3.25Å; L17-F21 PolarHBondContact O-N 3Å; V19-F21 VanDerWaalsContact C-N 3.32Å; V19-F21 PolarHBondContact O-N 3.18Å; F21-H23 PolarHBondContact O-N 2.9Å; F21-C24 CarbonylContact O-C 3.09Å; F21-C24 PolarHBondContact O-N 3.3Å; F21-I26 HydrophobicContact CD1-CD1 3.77Å; F21-I26 HydrophobicContact CD1-CG1 4.22Å; F21-I26 HydrophobicContact CE1-CD1 3.6Å; F21-I26 HydrophobicContact CE1-CG1 4.33Å
22	S	45.3	Very low	47.6	Very low	80 Å²	80	89 Å²	89	56%	0.559	51%	0.505	S	S	*	.	H	α-helix	trans	-66.7	-21.8	176.4	66.3	0	0	0	0	113.5	L18 V19	L18-S22 WeakPolarHBondContact O-CB 3.5Å; L18-S22 PolarHBondContact O-N 3.49Å; L18-S22 PolarHBondContact O-OG 3.31Å; V19-S22 WeakPolarHBondContact CA-OG 3.38Å; V19-S22 PolarHBondContact O-N 3.23Å; V19-S22 PolarHBondContact O-OG 3.18Å
23	H	43.3	Very low	46.8	Very low	142 Å²	142	89.5 Å²	89.5	66%	0.657	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-11.3	173.5	-66.4	-58.4	0	0	0	113.3	V19 F21	V19-H23 PolarHBondContact O-CD2 3.33Å; V19-H23 PolarHBondContact O-N 3.36Å; F21-H23 PolarHBondContact O-N 2.9Å
24	C	41	Very low	45.8	Very low	63 Å²	63	91.9 Å²	91.9	43%	0.426	52%	0.519	S	S	.	.	S	Bend	trans	-117.9	71.1	173.2	-82.6	0	0	0	0	108.1	A20 F21 I26	A20-C24 PolarHBondContact O-N 2.82Å; F21-C24 CarbonylContact O-C 3.09Å; F21-C24 PolarHBondContact O-N 3.3Å; C24-I26 VanDerWaalsContact C-N 3.34Å; C24-I26 WeakPolarHBondContact O-CG1 3.42Å; C24-I26 PolarHBondContact O-N 2.84Å
25	D	41	Very low	44.9	Very low	90 Å²	90	92.1 Å²	92.1	48%	0.481	52%	0.524	S	S	.	.			trans	-56	101.6	168.7	-170.5	-14.7	0	0	0	107.5	S27 A28 I29	D25-S27 PolarHBondContact O-N 3.37Å; D25-S27 WeakPolarHBondContact OD1-CB 3.24Å; D25-S27 PolarHBondContact OD1-N 2.77Å; D25-S27 PolarHBondContact OD1-OG 2.69Å; D25-A28 HydrophobicContact CB-CB 3.7Å; D25-A28 CarbonylContact O-C 3.27Å; D25-A28 VanDerWaalsContact O-C 3.27Å; D25-A28 VanDerWaalsContact O-CA 3.24Å; D25-A28 WeakPolarHBondContact O-CA 3.41Å; D25-A28 WeakPolarHBondContact O-CB 3.21Å; D25-A28 PolarHBondContact O-N 2.98Å; D25-I29 PolarHBondContact O-N 3.4Å
26	I	43.9	Very low	44.4	Very low	74 Å²	74	91 Å²	91	38%	0.379	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-63.8	-25.7	-175.2	-56.2	177	0	0	0	109.6	F21 C24 A28 I29	F21-I26 HydrophobicContact CD1-CD1 3.77Å; F21-I26 HydrophobicContact CD1-CG1 4.22Å; F21-I26 HydrophobicContact CE1-CD1 3.6Å; F21-I26 HydrophobicContact CE1-CG1 4.33Å; C24-I26 VanDerWaalsContact C-N 3.34Å; C24-I26 WeakPolarHBondContact O-CG1 3.42Å; C24-I26 PolarHBondContact O-N 2.84Å; I26-A28 VanDerWaalsContact C-N 3.27Å; I26-I29 HydrophobicContact CG2-CD1 4.39Å
27	S	39.7	Very low	43.9	Very low	107 Å²	107	87.5 Å²	87.5	75%	0.748	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-71.9	-19	168.7	8.1	0	0	0	0	113.4	D25	D25-S27 PolarHBondContact O-N 3.37Å; D25-S27 WeakPolarHBondContact OD1-CB 3.24Å; D25-S27 PolarHBondContact OD1-N 2.77Å; D25-S27 PolarHBondContact OD1-OG 2.69Å
28	A	38.9	Very low	43.5	Very low	47 Å²	47	88.8 Å²	88.8	39%	0.388	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-108.2	28.3	178.1	0	0	0	0	0	113.5	D25 I26 T30	D25-A28 HydrophobicContact CB-CB 3.7Å; D25-A28 CarbonylContact O-C 3.27Å; D25-A28 VanDerWaalsContact O-C 3.27Å; D25-A28 VanDerWaalsContact O-CA 3.24Å; D25-A28 WeakPolarHBondContact O-CA 3.41Å; D25-A28 WeakPolarHBondContact O-CB 3.21Å; D25-A28 PolarHBondContact O-N 2.98Å; I26-A28 VanDerWaalsContact C-N 3.27Å; A28-T30 PolarHBondContact O-N 2.64Å; A28-T30 VanDerWaalsContact O-O 3.08Å
29	I	43.9	Very low	43.1	Very low	78 Å²	78	85 Å²	85	40%	0.4	52%	0.515	S	S	.	.			trans	-70.4	43.8	153.4	-45.8	173.1	0	0	0	109.1	D25 I26 L75	D25-I29 PolarHBondContact O-N 3.4Å; I26-I29 HydrophobicContact CG2-CD1 4.39Å; I29-L75 HydrophobicContact CD1-CD1 3.47Å; I29-L75 VanDerWaalsContact CD1-CD1 3.47Å
30	T	37.7	Very low	42.8	Very low	100 Å²	100	90.6 Å²	90.6	61%	0.613	54%	0.536	S	S	*	.	S	Bend	trans	-102.2	121	156.5	39.4	0	0	0	0	103.5	A28 N32	A28-T30 PolarHBondContact O-N 2.64Å; A28-T30 VanDerWaalsContact O-O 3.08Å; T30-N32 PolarHBondContact O-N 3.28Å
31	C	41.1	Very low	42.6	Very low	74 Å²	74	93.5 Å²	93.5	50%	0.5	54%	0.543	S	S	.	.			trans	-50	85.2	177.1	-96.2	0	0	0	0	112	C49	C31-C49 WeakPolarHBondContact CA-SG 3.4Å; C31-C49 HydrophobicContact CB-CB 3.34Å; C31-C49 WeakPolarHBondContact CB-SG 3.49Å; C31-C49 WeakPolarHBondContact SG-CA 3.43Å; C31-C49 WeakPolarHBondContact SG-CB 3.33Å; C31-C49 CovalentContact SG-SG 2.01Å; C31-C49 PolarHBondContact SG-SG 3.2Å
32	N	36.4	Very low	42.5	Very low	107 Å²	107	93.8 Å²	93.8	57%	0.572	57%	0.565	S	S	*	*			trans	-86	134.5	173.4	-160.6	0.5	0	0	0	106.2	T30 T34 V35	T30-N32 PolarHBondContact O-N 3.28Å; N32-T34 PolarHBondContact O-N 2.88Å; N32-V35 PolarHBondContact O-N 3.34Å
33	K	41.3	Very low	42.5	Very low	148 Å²	148	99.3 Å²	99.3	64%	0.643	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	4.7	-160.2	-60.5	-176.1	168.1	-176.7	0	116.7	D52	K33-D52 WeakPolarHBondContact CA-OD2 3.29Å; K33-D52 WeakPolarHBondContact CB-OD2 3.42Å; K33-D52 WeakPolarHBondContact CG-OD2 3.16Å
34	T	40.1	Very low	42.6	Very low	120 Å²	120	94.5 Å²	94.5	74%	0.736	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.9	-4.8	-165.8	46.7	0	0	0	0	115.1	N32	N32-T34 PolarHBondContact O-N 2.88Å
35	V	39.6	Very low	42.8	Very low	97 Å²	97	93.7 Å²	93.7	59%	0.588	56%	0.562	S	S	*	*			trans	-132.1	93.8	-174.6	-161.3	0	0	0	0	111.1	N32	N32-V35 PolarHBondContact O-N 3.34Å
36	C	46.9	Very low	43.1	Very low	69 Å²	69	94.5 Å²	94.5	47%	0.466	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-85.9	124.8	169.8	-64.8	0	0	0	0	108.8	A38 L47	C36-A38 PolarHBondContact O-N 3.33Å; C36-A38 VanDerWaalsContact O-N 3.14Å; C36-L47 WeakPolarHBondContact CB-O 3.14Å; C36-L47 PolarHBondContact SG-O 2.86Å
37	C	46.5	Very low	43.4	Very low	50 Å²	50	92.5 Å²	92.5	34%	0.338	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-62.5	117.1	169.3	-63.2	0	0	0	0	108.6	S39 M71	C37-S39 PolarHBondContact O-N 3.5Å; C37-M71 HydrophobicContact CB-CE 4.19Å; C37-M71 HydrophobicContact CB-SD 4.43Å
38	A	45.1	Very low	43.9	Very low	90 Å²	90	89.6 Å²	89.6	74%	0.744	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-64.9	130.5	175.5	0	0	0	0	0	109.4	C36 E40	C36-A38 PolarHBondContact O-N 3.33Å; C36-A38 VanDerWaalsContact O-N 3.14Å; A38-E40 PolarHBondContact O-N 3.27Å
39	S	44.8	Very low	44.4	Very low	41 Å²	41	88.3 Å²	88.3	29%	0.287	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-68.4	123.3	167.7	-163.8	0	0	0	0	108	C37 D41 G42 T44	C37-S39 PolarHBondContact O-N 3.5Å; S39-D41 PolarHBondContact O-N 2.82Å; S39-G42 PolarHBondContact O-N 3.33Å; S39-T44 WeakPolarHBondContact CB-OG1 3.39Å; S39-T44 PolarHBondContact OG-OG1 2.82Å
40	E	46.6	Very low	44.5	Very low	194 Å²	194	92.1 Å²	92.1	91%	0.907	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-18.8	-177.2	-68.7	-161.3	123.1	0	0	113.9	A38	A38-E40 PolarHBondContact O-N 3.27Å
41	D	45.3	Very low	44.9	Very low	123 Å²	123	95.7 Å²	95.7	66%	0.658	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-3.6	-171.9	-63.9	-46.7	0	0	0	115.8	S39 K43	S39-D41 PolarHBondContact O-N 2.82Å; D41-K43 WeakPolarHBondContact O-CG 3.42Å; D41-K43 PolarHBondContact O-N 3.49Å
42	G	43.9	Very low	45.1	Very low	75 Å²	75	96.3 Å²	96.3	77%	0.773	55%	0.551	S	S	*	*	S	Bend	trans	58.5	-5.7	179.7	0	0	0	0	0	116.4	S39	S39-G42 PolarHBondContact O-N 3.33Å
43	K	45.1	Very low	45.5	Very low	197 Å²	197	94.8 Å²	94.8	86%	0.857	56%	0.56	S	S	*	*	S	Bend	trans	-94.9	-19.9	-177	-73.4	175.2	-179	178.8	0	112.5	D41	D41-K43 WeakPolarHBondContact O-CG 3.42Å; D41-K43 PolarHBondContact O-N 3.49Å
44	T	46.7	Very low	45.9	Very low	41 Å²	41	88.8 Å²	88.8	25%	0.252	54%	0.536	S	S	.	.	S	Bend	trans	-109.5	105.4	-179.9	23	0	0	0	0	106.3	S39	S39-T44 WeakPolarHBondContact CB-OG1 3.39Å; S39-T44 PolarHBondContact OG-OG1 2.82Å
45	G	45.3	Very low	46.4	Very low	46 Å²	46	87.2 Å²	87.2	47%	0.474	53%	0.528	S	S	.	.			trans	-49.3	166.8	-178.4	0	0	0	0	0	113.8	L47	G45-L47 PolarHBondContact O-N 3.49Å
46	P	46.7	Very low	47	Very low	107 Å²	107	86.9 Å²	86.9	70%	0.695	53%	0.53	S	S	*	.			trans	-51.8	129.1	-170.7	21.6	-33.1	0	0	0	111.7	C48	P46-C48 PolarHBondContact O-N 2.97Å
47	L	49.7	Very low	47.4	Very low	32 Å²	32	86.6 Å²	86.6	17%	0.168	53%	0.526	C	S	.	.			trans	-69.8	96.7	172.6	-76.9	163.6	0	0	0	108.3	C36 G45 R67 M71	C36-L47 WeakPolarHBondContact CB-O 3.14Å; C36-L47 PolarHBondContact SG-O 2.86Å; G45-L47 PolarHBondContact O-N 3.49Å; L47-R67 HydrophobicContact CD2-CB 4.12Å; L47-M71 HydrophobicContact CD1-CE 4.47Å; L47-M71 HydrophobicContact CD1-SD 4.42Å
48	C	50.2	Low	47.8	Very low	45 Å²	45	89.4 Å²	89.4	30%	0.304	54%	0.544	S	S	.	.			trans	-75.2	148.2	174.5	-60	0	0	0	0	112	P46 C54	P46-C48 PolarHBondContact O-N 2.97Å; C48-C54 HydrophobicContact CB-CB 3.28Å; C48-C54 WeakPolarHBondContact CB-SG 3.44Å; C48-C54 WeakPolarHBondContact SG-CB 3.27Å; C48-C54 CovalentContact SG-SG 2.03Å; C48-C54 PolarHBondContact SG-SG 3.29Å
49	C	49.3	Very low	48.5	Very low	20 Å²	20	91.2 Å²	91.2	14%	0.135	54%	0.541	C	S	.	.			trans	-75.4	136.2	155.5	-71.8	0	0	0	0	111.5	C31 K51	C31-C49 WeakPolarHBondContact CA-SG 3.4Å; C31-C49 HydrophobicContact CB-CB 3.34Å; C31-C49 WeakPolarHBondContact CB-SG 3.49Å; C31-C49 WeakPolarHBondContact SG-CA 3.43Å; C31-C49 WeakPolarHBondContact SG-CB 3.33Å; C31-C49 CovalentContact SG-SG 2.01Å; C31-C49 PolarHBondContact SG-SG 3.2Å; C49-K51 PolarHBondContact O-N 3.49Å
50	E	46.8	Very low	49.1	Very low	159 Å²	159	92 Å²	92	74%	0.743	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-12.5	-176	-162.4	175	159.3	0	0	114.8	F61	E50-F61 HydrophobicContact CG-CE1 3.66Å; E50-F61 HydrophobicContact CG-CZ 4.18Å; E50-F61 WeakPolarHBondContact OE1-CE1 3.39Å
51	K	44.9	Very low	49.5	Very low	174 Å²	174	86.8 Å²	86.8	76%	0.757	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-16.2	-168.9	-103.7	-177.1	175.3	174.7	0	117.2	C49	C49-K51 PolarHBondContact O-N 3.49Å
52	D	45.3	Very low	50.3	Low	88 Å²	88	85 Å²	85	47%	0.471	51%	0.506	S	S	.	.	S	Bend	trans	-124.9	39.1	-167.3	-64.4	-54.5	0	0	0	114.7	K33	K33-D52 WeakPolarHBondContact CA-OD2 3.29Å; K33-D52 WeakPolarHBondContact CB-OD2 3.42Å; K33-D52 WeakPolarHBondContact CG-OD2 3.16Å
53	G	46.5	Very low	51.3	Low	74 Å²	74	85.5 Å²	85.5	76%	0.763	49%	0.489	S	S	*	.			trans	86.6	29.3	168.7	0	0	0	0	0	114.8
54	C	49.2	Very low	52	Low	22 Å²	22	78 Å²	78	15%	0.149	46%	0.458	C	S	.	.			trans	-66.4	141.7	169.5	-145.4	0	0	0	0	110.5	C48 S56	C48-C54 HydrophobicContact CB-CB 3.28Å; C48-C54 WeakPolarHBondContact CB-SG 3.44Å; C48-C54 WeakPolarHBondContact SG-CB 3.27Å; C48-C54 CovalentContact SG-SG 2.03Å; C48-C54 PolarHBondContact SG-SG 3.29Å; C54-S56 PolarHBondContact O-N 3.33Å; C54-S56 PolarHBondContact O-OG 2.95Å
55	P	50.3	Low	52.7	Low	88 Å²	88	83.6 Å²	83.6	57%	0.571	48%	0.475	S	S	*	.			trans	-57.8	103.8	178	18.3	-30.6	0	0	0	111.7	T57 L60	P55-T57 VanDerWaalsContact C-N 3.32Å; P55-T57 PolarHBondContact O-N 3.48Å; P55-L60 HydrophobicContact CG-CD2 4.19Å; P55-L60 WeakPolarHBondContact O-CD2 3.45Å
56	S	52.2	Low	53.8	Low	89 Å²	89	88.6 Å²	88.6	62%	0.622	48%	0.48	S	S	*	.			trans	-76	73.9	-177.5	-66.1	0	0	0	0	111.7	C54	C54-S56 PolarHBondContact O-N 3.33Å; C54-S56 PolarHBondContact O-OG 2.95Å
57	T	54.7	Low	54.7	Low	63 Å²	63	85.7 Å²	85.7	39%	0.387	46%	0.455	S	S	.	.			trans	-96.5	138.6	163	63.4	0	0	0	0	109.3	P55 D59 L60 F61	P55-T57 VanDerWaalsContact C-N 3.32Å; P55-T57 PolarHBondContact O-N 3.48Å; T57-D59 PolarHBondContact O-N 3.44Å; T57-D59 VanDerWaalsContact O-N 3.1Å; T57-L60 WeakPolarHBondContact O-CA 3.49Å; T57-L60 WeakPolarHBondContact O-CB 3.44Å; T57-L60 PolarHBondContact O-N 2.87Å; T57-L60 WeakPolarHBondContact OG1-CB 3.3Å; T57-L60 WeakPolarHBondContact OG1-CD1 3.42Å; T57-L60 PolarHBondContact OG1-N 2.85Å; T57-F61 WeakPolarHBondContact O-CD2 3.5Å; T57-F61 PolarHBondContact O-N 3.49Å
58	P	55.1	Low	55.6	Low	110 Å²	110	88.4 Å²	88.4	71%	0.714	47%	0.467	S	S	*	.	H	α-helix	trans	-52.2	-33.3	179	-26.5	33.5	0	0	0	113.4	F61 L62	P58-F61 WeakPolarHBondContact O-CB 3.1Å; P58-F61 PolarHBondContact O-N 3.32Å; P58-L62 PolarHBondContact O-N 3.43Å; P58-L62 VanDerWaalsContact O-N 3.11Å
59	D	59.3	Low	56.3	Low	128 Å²	128	93.6 Å²	93.6	68%	0.684	48%	0.48	S	S	*	.	H	α-helix	trans	-66.6	-42.3	174.2	-70.8	-43.7	0	0	0	112.4	T57 F61 L62 E63	T57-D59 PolarHBondContact O-N 3.44Å; T57-D59 VanDerWaalsContact O-N 3.1Å; D59-F61 VanDerWaalsContact C-N 3.29Å; D59-F61 PolarHBondContact O-N 2.88Å; D59-L62 PolarHBondContact O-N 3.35Å; D59-E63 WeakPolarHBondContact O-CB 3.26Å; D59-E63 PolarHBondContact O-N 3.27Å
60	L	57.6	Low	57.4	Low	58 Å²	58	100.3 Å²	100.3	30%	0.304	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-36.4	173.5	-112.3	91.8	0	0	0	111.9	P55 T57 N64	P55-L60 HydrophobicContact CG-CD2 4.19Å; P55-L60 WeakPolarHBondContact O-CD2 3.45Å; T57-L60 WeakPolarHBondContact O-CA 3.49Å; T57-L60 WeakPolarHBondContact O-CB 3.44Å; T57-L60 PolarHBondContact O-N 2.87Å; T57-L60 WeakPolarHBondContact OG1-CB 3.3Å; T57-L60 WeakPolarHBondContact OG1-CD1 3.42Å; T57-L60 PolarHBondContact OG1-N 2.85Å; L60-N64 WeakPolarHBondContact O-CB 3.33Å; L60-N64 PolarHBondContact O-N 2.77Å; L60-N64 PolarHBondContact O-ND2 3.04Å
61	F	56.3	Low	58.2	Low	84 Å²	84	95.3 Å²	95.3	37%	0.368	48%	0.48	S	S	.	.	H	α-helix	trans	-63.2	-48.3	176	-87.5	-84.3	0	0	0	111.9	E50 T57 P58 D59 E63 N64 Y65	E50-F61 HydrophobicContact CG-CE1 3.66Å; E50-F61 HydrophobicContact CG-CZ 4.18Å; E50-F61 WeakPolarHBondContact OE1-CE1 3.39Å; T57-F61 WeakPolarHBondContact O-CD2 3.5Å; T57-F61 PolarHBondContact O-N 3.49Å; P58-F61 WeakPolarHBondContact O-CB 3.1Å; P58-F61 PolarHBondContact O-N 3.32Å; D59-F61 VanDerWaalsContact C-N 3.29Å; D59-F61 PolarHBondContact O-N 2.88Å; F61-E63 VanDerWaalsContact C-N 3.32Å; F61-E63 PolarHBondContact O-N 3.44Å; F61-N64 PolarHBondContact O-N 3.44Å; F61-Y65 VanDerWaalsContact O-CB 3.26Å; F61-Y65 WeakPolarHBondContact O-CB 3.36Å; F61-Y65 PolarHBondContact O-N 3.14Å
62	L	60.4	Low	59.2	Low	85 Å²	85	92.5 Å²	92.5	45%	0.445	47%	0.468	S	S	.	.	H	α-helix	trans	-64.7	-40.6	179.5	-175.8	61.7	0	0	0	111.2	P58 D59 R66	P58-L62 PolarHBondContact O-N 3.43Å; P58-L62 VanDerWaalsContact O-N 3.11Å; D59-L62 PolarHBondContact O-N 3.35Å; L62-R66 WeakPolarHBondContact O-CB 3.43Å; L62-R66 VanDerWaalsContact O-CG 3.3Å; L62-R66 WeakPolarHBondContact O-CG 3.27Å; L62-R66 PolarHBondContact O-N 3.29Å
63	E	65	Low	60.4	Low	86 Å²	86	92.1 Å²	92.1	40%	0.402	47%	0.466	S	S	.	.	H	α-helix	trans	-68.2	-44.7	177.6	-169.9	172	-165.9	0	0	112.2	D59 F61 Y65 R66 R67	D59-E63 WeakPolarHBondContact O-CB 3.26Å; D59-E63 PolarHBondContact O-N 3.27Å; F61-E63 VanDerWaalsContact C-N 3.32Å; F61-E63 PolarHBondContact O-N 3.44Å; E63-Y65 VanDerWaalsContact C-N 3.34Å; E63-Y65 PolarHBondContact O-N 3.45Å; E63-R66 PolarHBondContact O-N 3.43Å; E63-R67 VanDerWaalsContact CD-NH2 3.25Å; E63-R67 HydrophobicContact CG-CG 4.42Å; E63-R67 WeakPolarHBondContact O-CB 3.42Å; E63-R67 WeakPolarHBondContact O-CG 3.47Å; E63-R67 PolarHBondContact O-N 2.9Å; E63-R67 IonicContact OE1-CZ 3.32Å; E63-R67 IonicContact OE1-NE 3.28Å; E63-R67 PolarHBondContact OE1-NE 2.93Å; E63-R67 IonicContact OE1-NH2 2.64Å; E63-R67 PolarHBondContact OE1-NH2 2.86Å; E63-R67 IonicContact OE2-NH2 3.69Å
64	N	60.7	Low	61.2	Low	40 Å²	40	95.7 Å²	95.7	21%	0.214	46%	0.457	C	S	.	.	H	α-helix	trans	-61.1	-42.9	175.1	-76.3	-20.1	0	0	0	111.1	L60 F61 R67 H68	L60-N64 WeakPolarHBondContact O-CB 3.33Å; L60-N64 PolarHBondContact O-N 2.77Å; L60-N64 PolarHBondContact O-ND2 3.04Å; F61-N64 PolarHBondContact O-N 3.44Å; N64-R67 PolarHBondContact O-N 3.45Å; N64-H68 VanDerWaalsContact O-CB 3.27Å; N64-H68 WeakPolarHBondContact O-CB 3.13Å; N64-H68 PolarHBondContact O-N 3.14Å
65	Y	62.2	Low	61.7	Low	157 Å²	157	96.5 Å²	96.5	62%	0.616	46%	0.46	S	S	*	.	H	α-helix	trans	-61.5	-46.5	175.2	-177.2	-94.5	0	0	0	111.8	F61 E63 R67 H68 R69	F61-Y65 VanDerWaalsContact O-CB 3.26Å; F61-Y65 WeakPolarHBondContact O-CB 3.36Å; F61-Y65 PolarHBondContact O-N 3.14Å; E63-Y65 VanDerWaalsContact C-N 3.34Å; E63-Y65 PolarHBondContact O-N 3.45Å; Y65-R67 PolarHBondContact O-N 2.81Å; Y65-H68 PolarHBondContact O-N 2.79Å; Y65-R69 WeakPolarHBondContact O-CB 3.45Å; Y65-R69 PolarHBondContact O-N 3.25Å
66	R	67.7	Low	62.3	Low	151 Å²	151	96.8 Å²	96.8	57%	0.57	45%	0.454	S	S	*	.	H	α-helix	trans	-62.1	-42.7	176.1	-76.1	179.3	-171.8	179.5	3.9	111.8	L62 E63 R69 R70	L62-R66 WeakPolarHBondContact O-CB 3.43Å; L62-R66 VanDerWaalsContact O-CG 3.3Å; L62-R66 WeakPolarHBondContact O-CG 3.27Å; L62-R66 PolarHBondContact O-N 3.29Å; E63-R66 PolarHBondContact O-N 3.43Å; R66-R69 PolarHBondContact O-N 2.83Å; R66-R70 WeakPolarHBondContact O-CG 3.48Å; R66-R70 PolarHBondContact O-N 3.36Å
67	R	66.5	Low	62.8	Low	46 Å²	46	98.4 Å²	98.4	17%	0.174	45%	0.451	C	S	.	.	H	α-helix	trans	-65.4	-44.7	177.5	-75.1	-179.3	-172.3	-177.7	8	111.4	L47 E63 N64 Y65 R69 R70 M71	L47-R67 HydrophobicContact CD2-CB 4.12Å; E63-R67 VanDerWaalsContact CD-NH2 3.25Å; E63-R67 HydrophobicContact CG-CG 4.42Å; E63-R67 WeakPolarHBondContact O-CB 3.42Å; E63-R67 WeakPolarHBondContact O-CG 3.47Å; E63-R67 PolarHBondContact O-N 2.9Å; E63-R67 IonicContact OE1-CZ 3.32Å; E63-R67 IonicContact OE1-NE 3.28Å; E63-R67 PolarHBondContact OE1-NE 2.93Å; E63-R67 IonicContact OE1-NH2 2.64Å; E63-R67 PolarHBondContact OE1-NH2 2.86Å; E63-R67 IonicContact OE2-NH2 3.69Å; N64-R67 PolarHBondContact O-N 3.45Å; Y65-R67 PolarHBondContact O-N 2.81Å; R67-R69 VanDerWaalsContact C-N 3.34Å; R67-R69 PolarHBondContact O-N 3.48Å; R67-R70 PolarHBondContact O-N 2.95Å; R67-M71 WeakPolarHBondContact O-CB 3.24Å; R67-M71 PolarHBondContact O-N 3.41Å
68	H	66.6	Low	62.9	Low	90 Å²	90	97 Å²	97	42%	0.417	44%	0.442	S	S	.	.	H	α-helix	trans	-60	-44.5	176.2	-169.5	93.9	0	0	0	111.4	N64 Y65 R70 M71 K72	N64-H68 VanDerWaalsContact O-CB 3.27Å; N64-H68 WeakPolarHBondContact O-CB 3.13Å; N64-H68 PolarHBondContact O-N 3.14Å; Y65-H68 PolarHBondContact O-N 2.79Å; H68-R70 PolarHBondContact O-N 2.94Å; H68-M71 PolarHBondContact O-N 3.47Å; H68-K72 WeakPolarHBondContact O-CB 3.05Å; H68-K72 PolarHBondContact O-N 3.11Å
69	R	66.5	Low	62.7	Low	154 Å²	154	93.4 Å²	93.4	58%	0.581	42%	0.419	S	S	*	.	H	α-helix	trans	-63.6	-40.7	176	-167.4	176.3	-176.8	-175.8	1.2	112.3	Y65 R66 R67 K72 N73	Y65-R69 WeakPolarHBondContact O-CB 3.45Å; Y65-R69 PolarHBondContact O-N 3.25Å; R66-R69 PolarHBondContact O-N 2.83Å; R67-R69 VanDerWaalsContact C-N 3.34Å; R67-R69 PolarHBondContact O-N 3.48Å; R69-K72 PolarHBondContact O-N 3.42Å; R69-N73 WeakPolarHBondContact O-CB 3.37Å; R69-N73 VanDerWaalsContact O-CG 3.23Å; R69-N73 PolarHBondContact O-N 3.35Å; R69-N73 PolarHBondContact O-OD1 3.27Å
70	R	71.3	Confident	62.3	Low	161 Å²	161	94.1 Å²	94.1	61%	0.608	42%	0.417	S	S	*	.	H	α-helix	trans	-62	-44.9	173.9	-77.4	-171.2	-70.7	-173.4	-0.5	111.7	R66 R67 H68 N73 Y74	R66-R70 WeakPolarHBondContact O-CG 3.48Å; R66-R70 PolarHBondContact O-N 3.36Å; R67-R70 PolarHBondContact O-N 2.95Å; H68-R70 PolarHBondContact O-N 2.94Å; R70-N73 PolarHBondContact O-N 2.03Å; R70-Y74 WeakPolarHBondContact O-CB 3.43Å; R70-Y74 PolarHBondContact O-N 3.41Å
71	M	64	Low	62	Low	54 Å²	54	100.9 Å²	100.9	27%	0.266	44%	0.439	S	S	.	.	H	α-helix	trans	-65.2	-42.7	178.9	-165.7	158.5	76.8	0	0	111.5	C37 L47 R67 H68 Y74 L75	C37-M71 HydrophobicContact CB-CE 4.19Å; C37-M71 HydrophobicContact CB-SD 4.43Å; L47-M71 HydrophobicContact CD1-CE 4.47Å; L47-M71 HydrophobicContact CD1-SD 4.42Å; R67-M71 WeakPolarHBondContact O-CB 3.24Å; R67-M71 PolarHBondContact O-N 3.41Å; H68-M71 PolarHBondContact O-N 3.47Å; M71-Y74 PolarHBondContact O-N 2.8Å; M71-L75 HydrophobicContact CG-CD1 4.27Å; M71-L75 WeakPolarHBondContact O-CB 3.35Å; M71-L75 VanDerWaalsContact O-CG 3.29Å; M71-L75 WeakPolarHBondContact O-CG 3.42Å; M71-L75 PolarHBondContact O-N 3.35Å
72	K	66.5	Low	61.5	Low	114 Å²	114	103.9 Å²	103.9	50%	0.496	45%	0.449	S	S	.	.	H	α-helix	trans	-59	-47.9	173.3	-176.1	179	174.8	179.4	0	111.7	H68 R69 Y74 L75 E76	H68-K72 WeakPolarHBondContact O-CB 3.05Å; H68-K72 PolarHBondContact O-N 3.11Å; R69-K72 PolarHBondContact O-N 3.42Å; K72-Y74 PolarHBondContact O-N 2.75Å; K72-L75 PolarHBondContact O-N 2.96Å; K72-E76 WeakPolarHBondContact CE-OE1 3.35Å; K72-E76 IonicContact NZ-OE1 3.98Å; K72-E76 WeakPolarHBondContact O-CB 3.46Å; K72-E76 WeakPolarHBondContact O-CG 2.72Å; K72-E76 PolarHBondContact O-N 3.42Å
73	N	69.1	Low	60.8	Low	80 Å²	80	109.7 Å²	109.7	43%	0.428	48%	0.479	S	S	.	.	H	α-helix	trans	-62.8	-42.2	178.1	-72.1	1.9	0	0	0	111.9	R69 R70 E76 E77	R69-N73 WeakPolarHBondContact O-CB 3.37Å; R69-N73 VanDerWaalsContact O-CG 3.23Å; R69-N73 PolarHBondContact O-N 3.35Å; R69-N73 PolarHBondContact O-OD1 3.27Å; R70-N73 PolarHBondContact O-N 2.03Å; N73-E76 PolarHBondContact O-N 3.03Å; N73-E77 PolarHBondContact O-N 3.22Å
74	Y	64.8	Low	60.6	Low	150 Å²	150	110.9 Å²	110.9	59%	0.588	48%	0.482	S	S	*	.	H	α-helix	trans	-62.2	-45.4	176.5	179.4	-103.1	0	0	0	111.3	R70 M71 K72 E76 E77 V78	R70-Y74 WeakPolarHBondContact O-CB 3.43Å; R70-Y74 PolarHBondContact O-N 3.41Å; M71-Y74 PolarHBondContact O-N 2.8Å; K72-Y74 PolarHBondContact O-N 2.75Å; Y74-E76 PolarHBondContact O-N 3.24Å; Y74-E77 PolarHBondContact O-N 2.55Å; Y74-V78 HydrophobicContact CD1-CG2 4.1Å; Y74-V78 HydrophobicContact CD2-CG2 4.24Å; Y74-V78 HydrophobicContact CE1-CG2 3.71Å; Y74-V78 HydrophobicContact CE2-CG2 3.86Å; Y74-V78 HydrophobicContact CG-CG2 4.36Å; Y74-V78 WeakPolarHBondContact O-CB 3.28Å; Y74-V78 VanDerWaalsContact O-CG2 3.28Å; Y74-V78 WeakPolarHBondContact O-CG2 2.87Å; Y74-V78 PolarHBondContact O-N 3.36Å
75	L	59.1	Low	60.5	Low	38 Å²	38	114.6 Å²	114.6	20%	0.199	50%	0.497	C	S	.	.	H	α-helix	trans	-62.7	-41.7	175.7	-72.7	170.2	0	0	0	111.8	I29 M71 K72 E77 V78 C79	I29-L75 HydrophobicContact CD1-CD1 3.47Å; I29-L75 VanDerWaalsContact CD1-CD1 3.47Å; M71-L75 HydrophobicContact CG-CD1 4.27Å; M71-L75 WeakPolarHBondContact O-CB 3.35Å; M71-L75 VanDerWaalsContact O-CG 3.29Å; M71-L75 WeakPolarHBondContact O-CG 3.42Å; M71-L75 PolarHBondContact O-N 3.35Å; K72-L75 PolarHBondContact O-N 2.96Å; L75-E77 VanDerWaalsContact C-N 3.35Å; L75-E77 PolarHBondContact O-N 3.26Å; L75-V78 PolarHBondContact O-N 3.27Å; L75-C79 WeakPolarHBondContact O-CB 3.39Å; L75-C79 PolarHBondContact O-N 2.77Å; L75-C79 PolarHBondContact O-SG 3.1Å
76	E	62.6	Low	60.5	Low	95 Å²	95	112.2 Å²	112.2	44%	0.444	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-40	173.5	-77.2	179.7	-173.9	0	0	112	K72 N73 Y74 K80	K72-E76 WeakPolarHBondContact CE-OE1 3.35Å; K72-E76 IonicContact NZ-OE1 3.98Å; K72-E76 WeakPolarHBondContact O-CB 3.46Å; K72-E76 WeakPolarHBondContact O-CG 2.72Å; K72-E76 PolarHBondContact O-N 3.42Å; N73-E76 PolarHBondContact O-N 3.03Å; Y74-E76 PolarHBondContact O-N 3.24Å; E76-K80 VanDerWaalsContact O-CG 3.25Å; E76-K80 WeakPolarHBondContact O-CG 3.43Å; E76-K80 PolarHBondContact O-N 2.66Å
77	E	62.3	Low	60	Low	122 Å²	122	109.9 Å²	109.9	57%	0.57	49%	0.485	S	S	*	.	H	α-helix	trans	-67.3	-45	175.6	-78.9	-167.5	162.5	0	0	112.6	N73 Y74 L75 K80 Y81	N73-E77 PolarHBondContact O-N 3.22Å; Y74-E77 PolarHBondContact O-N 2.55Å; L75-E77 VanDerWaalsContact C-N 3.35Å; L75-E77 PolarHBondContact O-N 3.26Å; E77-K80 WeakPolarHBondContact O-CB 2.84Å; E77-K80 PolarHBondContact O-N 3.06Å; E77-Y81 WeakPolarHBondContact O-CD2 3.35Å; E77-Y81 WeakPolarHBondContact O-CE2 3.37Å
78	V	56.6	Low	59.6	Low	33 Å²	33	113.9 Å²	113.9	20%	0.2	51%	0.505	C	S	.	.	H	α-helix	trans	-65.7	-47.8	178.5	174.3	0	0	0	0	109.8	Y74 L75 K80 Y81 Y82	Y74-V78 HydrophobicContact CD1-CG2 4.1Å; Y74-V78 HydrophobicContact CD2-CG2 4.24Å; Y74-V78 HydrophobicContact CE1-CG2 3.71Å; Y74-V78 HydrophobicContact CE2-CG2 3.86Å; Y74-V78 HydrophobicContact CG-CG2 4.36Å; Y74-V78 WeakPolarHBondContact O-CB 3.28Å; Y74-V78 VanDerWaalsContact O-CG2 3.28Å; Y74-V78 WeakPolarHBondContact O-CG2 2.87Å; Y74-V78 PolarHBondContact O-N 3.36Å; L75-V78 PolarHBondContact O-N 3.27Å; V78-K80 PolarHBondContact O-N 3.31Å; V78-Y81 PolarHBondContact O-N 2.86Å; V78-Y82 HydrophobicContact CG1-CD2 4.17Å; V78-Y82 HydrophobicContact CG1-CE2 3.76Å; V78-Y82 WeakPolarHBondContact O-CD2 3.42Å
79	C	51.3	Low	59.2	Low	35 Å²	35	115.5 Å²	115.5	24%	0.236	51%	0.511	C	S	.	.	H	α-helix	trans	-62	-27	179.6	-74.8	0	0	0	0	113.6	L75 Y81 Y82 I83	L75-C79 WeakPolarHBondContact O-CB 3.39Å; L75-C79 PolarHBondContact O-N 2.77Å; L75-C79 PolarHBondContact O-SG 3.1Å; C79-Y81 PolarHBondContact O-N 2.85Å; C79-Y82 PolarHBondContact O-N 2.01Å; C79-I83 PolarHBondContact O-N 2.64Å
80	K	52.4	Low	58.6	Low	144 Å²	144	112.8 Å²	112.8	63%	0.626	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.2	172.6	-79.9	168.4	-171.5	174.6	0	113.5	E76 E77 V78	E76-K80 VanDerWaalsContact O-CG 3.25Å; E76-K80 WeakPolarHBondContact O-CG 3.43Å; E76-K80 PolarHBondContact O-N 2.66Å; E77-K80 WeakPolarHBondContact O-CB 2.84Å; E77-K80 PolarHBondContact O-N 3.06Å; V78-K80 PolarHBondContact O-N 3.31Å
81	Y	50.7	Low	57.7	Low	199 Å²	199	109.1 Å²	109.1	78%	0.78	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-5.1	176.7	-65.5	-80.3	0	0	0	113.3	E77 V78 C79	E77-Y81 WeakPolarHBondContact O-CD2 3.35Å; E77-Y81 WeakPolarHBondContact O-CE2 3.37Å; V78-Y81 PolarHBondContact O-N 2.86Å; C79-Y81 PolarHBondContact O-N 2.85Å
82	Y	45.9	Very low	57.1	Low	147 Å²	147	113.7 Å²	113.7	58%	0.576	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	2.4	-175.9	-67.1	-82.9	0	0	0	114.3	L17 V78 C79	L17-Y82 HydrophobicContact CD2-CE1 3.9Å; V78-Y82 HydrophobicContact CG1-CD2 4.17Å; V78-Y82 HydrophobicContact CG1-CE2 3.76Å; V78-Y82 WeakPolarHBondContact O-CD2 3.42Å; C79-Y82 PolarHBondContact O-N 2.01Å
83	I	44.5	Very low	56.3	Low	207 Å²	207	113.6 Å²	113.6	100%	1.062	52%	0.519	S	S	*	.			trans	-113.1	0	170.7	-59.5	173.7	0	0	0	108.5	C79	C79-I83 PolarHBondContact O-N 2.64Å

Retrieved 83 of 83 residues in 63.5 ms (Link to these results)

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