A0A5K4FBI7_SCHMA Loading...

Lactamase_B domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBI7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 61 aa.

						>A0A5K4FBI7_SCHMA|A0A5K4FBI7
MVLQSKNFDLNTIYAQKSSDFIKANINYTSIAYCIAFTFRNSPPIKNYENHSGILGCLDFP
					

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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	46.4	Very low	58.4	Low	211 Å²	211	144.5 Å²	144.5	100%	1.039	75%	0.748	S	S	*	*				0	91.9	0	-172.4	171.6	-179.6	0	0	107.6	L3	M1-L3 HydrophobicContact CE-CD1 4.28Å; M1-L3 HydrophobicContact CE-CD2 4.01Å; M1-L3 HydrophobicContact CE-CG 4.19Å; M1-L3 HydrophobicContact CG-CG 4.3Å; M1-L3 PolarHBondContact O-N 3.18Å
2	V	43.7	Very low	59.6	Low	142 Å²	142	138.2 Å²	138.2	86%	0.861	72%	0.72	S	S	*	*			trans	-85	100.5	172.4	176.6	0	0	0	0	105.7	Q4	V2-Q4 PolarHBondContact O-N 3.39Å
3	L	56.1	Low	60.5	Low	141 Å²	141	131.4 Å²	131.4	74%	0.738	69%	0.685	S	S	*	*			trans	-74.1	106.1	173.9	-82.9	162.8	0	0	0	107.8	M1 S5	M1-L3 HydrophobicContact CE-CD1 4.28Å; M1-L3 HydrophobicContact CE-CD2 4.01Å; M1-L3 HydrophobicContact CE-CG 4.19Å; M1-L3 HydrophobicContact CG-CG 4.3Å; M1-L3 PolarHBondContact O-N 3.18Å; L3-S5 PolarHBondContact O-N 2.92Å
4	Q	54	Low	61	Low	172 Å²	172	133.3 Å²	133.3	80%	0.804	68%	0.68	S	S	*	*			trans	-52.6	120	166.6	-65	-175.8	-55.9	0	0	108.9	V2 K6	V2-Q4 PolarHBondContact O-N 3.39Å; Q4-K6 VanDerWaalsContact C-N 3.3Å; Q4-K6 PolarHBondContact O-N 3.24Å
5	S	48.3	Very low	61.7	Low	114 Å²	114	128.1 Å²	128.1	80%	0.797	67%	0.666	S	S	*	*			trans	-65.9	92	165.4	47.8	0	0	0	0	108.2	L3 N7	L3-S5 PolarHBondContact O-N 2.92Å; S5-N7 PolarHBondContact O-N 3.31Å
6	K	61.2	Low	62.3	Low	178 Å²	178	127 Å²	127	77%	0.774	66%	0.656	S	S	*	*			trans	-56.1	127.9	160.1	-68.3	-170.8	177.9	-176.6	0	106.3	Q4 F8	Q4-K6 VanDerWaalsContact C-N 3.3Å; Q4-K6 PolarHBondContact O-N 3.24Å; K6-F8 VanDerWaalsContact C-N 3.32Å; K6-F8 PolarHBondContact O-N 3.09Å
7	N	56.2	Low	62.7	Low	166 Å²	166	127.8 Å²	127.8	89%	0.888	65%	0.654	S	S	*	*			trans	-52	100	168.9	-83	-22.6	0	0	0	108	S5 D9	S5-N7 PolarHBondContact O-N 3.31Å; N7-D9 PolarHBondContact O-N 2.79Å; N7-D9 VanDerWaalsContact O-N 3.09Å
8	F	63.7	Low	63	Low	159 Å²	159	124.1 Å²	124.1	70%	0.697	64%	0.641	S	S	*	*			trans	-73.3	98.7	171.7	-110.8	-87.5	0	0	0	105.8	K6 L10 I13	K6-F8 VanDerWaalsContact C-N 3.32Å; K6-F8 PolarHBondContact O-N 3.09Å; F8-L10 PolarHBondContact O-N 3.07Å; F8-L10 VanDerWaalsContact O-N 3.07Å; F8-I13 HydrophobicContact CB-CD1 4.38Å; F8-I13 HydrophobicContact CD1-CD1 3.67Å; F8-I13 HydrophobicContact CD1-CG1 3.77Å; F8-I13 HydrophobicContact CE1-CD1 4.4Å; F8-I13 HydrophobicContact CE1-CG1 4.29Å; F8-I13 HydrophobicContact CG-CD1 4.4Å
9	D	72.8	Confident	63.4	Low	77 Å²	77	120.2 Å²	120.2	41%	0.412	63%	0.625	S	S	.	*			trans	-59.3	112.9	172.8	169.8	35.4	0	0	0	108.7	N7 N11 T12 I13	N7-D9 PolarHBondContact O-N 2.79Å; N7-D9 VanDerWaalsContact O-N 3.09Å; D9-N11 PolarHBondContact O-N 3.11Å; D9-N11 VanDerWaalsContact O-N 3.16Å; D9-N11 WeakPolarHBondContact OD1-CB 3.45Å; D9-N11 PolarHBondContact OD1-N 3.17Å; D9-N11 PolarHBondContact OD1-ND2 3.37Å; D9-N11 VanDerWaalsContact OD1-ND2 3.11Å; D9-T12 WeakPolarHBondContact O-CB 3.37Å; D9-T12 PolarHBondContact O-N 2.95Å; D9-T12 PolarHBondContact OD2-N 2.92Å; D9-T12 PolarHBondContact OD2-OG1 3.16Å; D9-I13 PolarHBondContact O-N 3.21Å
10	L	67.7	Low	63.8	Low	113 Å²	113	118.9 Å²	118.9	59%	0.592	62%	0.619	S	S	*	*	H	α-helix	trans	-52.1	-36.7	178.9	-83.7	146.3	0	0	0	111.1	F8 T12 I13 Y14	F8-L10 PolarHBondContact O-N 3.07Å; F8-L10 VanDerWaalsContact O-N 3.07Å; L10-T12 VanDerWaalsContact C-N 3.29Å; L10-T12 PolarHBondContact O-N 3.43Å; L10-I13 PolarHBondContact O-N 2.98Å; L10-I13 VanDerWaalsContact O-N 3.17Å; L10-Y14 HydrophobicContact CB-CD2 4.44Å; L10-Y14 HydrophobicContact CB-CE2 4.3Å; L10-Y14 HydrophobicContact CD2-CE2 4.15Å; L10-Y14 WeakPolarHBondContact O-CD2 3.29Å; L10-Y14 PolarHBondContact O-N 3.32Å
11	N	72.6	Confident	64.1	Low	117 Å²	117	119.9 Å²	119.9	63%	0.626	62%	0.619	S	S	*	*	H	α-helix	trans	-62.9	-37	179.4	-60.2	-49.9	0	0	0	112.1	D9 Y14 A15	D9-N11 PolarHBondContact O-N 3.11Å; D9-N11 VanDerWaalsContact O-N 3.16Å; D9-N11 WeakPolarHBondContact OD1-CB 3.45Å; D9-N11 PolarHBondContact OD1-N 3.17Å; D9-N11 PolarHBondContact OD1-ND2 3.37Å; D9-N11 VanDerWaalsContact OD1-ND2 3.11Å; N11-Y14 PolarHBondContact O-N 3.01Å; N11-A15 WeakPolarHBondContact O-CB 3.47Å; N11-A15 PolarHBondContact O-N 2.91Å
12	T	72.6	Confident	65.3	Low	68 Å²	68	114.3 Å²	114.3	42%	0.417	59%	0.592	S	S	.	*	H	α-helix	trans	-65.4	-40.8	175.7	-60	0	0	0	0	111.4	D9 L10 A15 Q16	D9-T12 WeakPolarHBondContact O-CB 3.37Å; D9-T12 PolarHBondContact O-N 2.95Å; D9-T12 PolarHBondContact OD2-N 2.92Å; D9-T12 PolarHBondContact OD2-OG1 3.16Å; L10-T12 VanDerWaalsContact C-N 3.29Å; L10-T12 PolarHBondContact O-N 3.43Å; T12-A15 PolarHBondContact O-N 3.37Å; T12-Q16 WeakPolarHBondContact O-CB 3.46Å; T12-Q16 VanDerWaalsContact O-CG 3.29Å; T12-Q16 WeakPolarHBondContact O-CG 3.39Å; T12-Q16 PolarHBondContact O-N 2.98Å
13	I	70.6	Confident	66.5	Low	50 Å²	50	112.9 Å²	112.9	26%	0.256	58%	0.575	S	S	.	*	H	α-helix	trans	-64.2	-44.3	175.4	-57.6	175.8	0	0	0	110.6	F8 D9 L10 Q16 K17	F8-I13 HydrophobicContact CB-CD1 4.38Å; F8-I13 HydrophobicContact CD1-CD1 3.67Å; F8-I13 HydrophobicContact CD1-CG1 3.77Å; F8-I13 HydrophobicContact CE1-CD1 4.4Å; F8-I13 HydrophobicContact CE1-CG1 4.29Å; F8-I13 HydrophobicContact CG-CD1 4.4Å; D9-I13 PolarHBondContact O-N 3.21Å; L10-I13 PolarHBondContact O-N 2.98Å; L10-I13 VanDerWaalsContact O-N 3.17Å; I13-Q16 PolarHBondContact O-N 2.91Å; I13-K17 HydrophobicContact CG2-CD 4.31Å; I13-K17 HydrophobicContact CG2-CG 4.5Å; I13-K17 WeakPolarHBondContact O-CG 3.05Å; I13-K17 PolarHBondContact O-N 3.38Å
14	Y	68.6	Low	67.2	Low	158 Å²	158	109 Å²	109	62%	0.62	56%	0.563	S	S	*	*	H	α-helix	trans	-63.8	-41.7	177.9	-77.5	-69.1	0	0	0	112.1	L10 N11 K17 S18	L10-Y14 HydrophobicContact CB-CD2 4.44Å; L10-Y14 HydrophobicContact CB-CE2 4.3Å; L10-Y14 HydrophobicContact CD2-CE2 4.15Å; L10-Y14 WeakPolarHBondContact O-CD2 3.29Å; L10-Y14 PolarHBondContact O-N 3.32Å; N11-Y14 PolarHBondContact O-N 3.01Å; Y14-K17 PolarHBondContact O-N 2.89Å; Y14-S18 WeakPolarHBondContact O-CB 3.33Å; Y14-S18 PolarHBondContact O-N 3.18Å; Y14-S18 PolarHBondContact O-OG 2.98Å
15	A	71.7	Confident	67.8	Low	56 Å²	56	104.5 Å²	104.5	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-65.3	-38.2	176.2	0	0	0	0	0	112.5	N11 T12 S18 S19	N11-A15 WeakPolarHBondContact O-CB 3.47Å; N11-A15 PolarHBondContact O-N 2.91Å; T12-A15 PolarHBondContact O-N 3.37Å; A15-S18 WeakPolarHBondContact CA-OG 3.33Å; A15-S18 PolarHBondContact O-OG 3.21Å; A15-S19 WeakPolarHBondContact O-CB 3.42Å; A15-S19 PolarHBondContact O-N 3.35Å
16	Q	70.1	Confident	68.9	Low	110 Å²	110	103.9 Å²	103.9	51%	0.514	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-50.7	174.2	-75.6	174.9	-17.4	0	0	111.1	T12 I13 S18 S19 D20	T12-Q16 WeakPolarHBondContact O-CB 3.46Å; T12-Q16 VanDerWaalsContact O-CG 3.29Å; T12-Q16 WeakPolarHBondContact O-CG 3.39Å; T12-Q16 PolarHBondContact O-N 2.98Å; I13-Q16 PolarHBondContact O-N 2.91Å; Q16-S18 VanDerWaalsContact C-N 3.32Å; Q16-S18 PolarHBondContact O-N 3.46Å; Q16-S19 PolarHBondContact O-N 2.95Å; Q16-D20 PolarHBondContact O-N 3.37Å
17	K	69.7	Low	69.3	Low	141 Å²	141	97.7 Å²	97.7	61%	0.613	51%	0.507	S	S	*	.	H	α-helix	trans	-60.2	-39.5	178	-73.6	-174.9	179.1	-174.7	0	112.7	I13 Y14 F21	I13-K17 HydrophobicContact CG2-CD 4.31Å; I13-K17 HydrophobicContact CG2-CG 4.5Å; I13-K17 WeakPolarHBondContact O-CG 3.05Å; I13-K17 PolarHBondContact O-N 3.38Å; Y14-K17 PolarHBondContact O-N 2.89Å; K17-F21 VanDerWaalsContact O-CB 3.28Å; K17-F21 WeakPolarHBondContact O-CB 3.29Å; K17-F21 PolarHBondContact O-N 3.12Å
18	S	67.5	Low	70	Confident	61 Å²	61	98 Å²	98	43%	0.427	50%	0.496	S	S	.	.	H	α-helix	trans	-70	-39.5	177.7	66.8	0	0	0	0	111.7	Y14 A15 Q16 F21 I22	Y14-S18 WeakPolarHBondContact O-CB 3.33Å; Y14-S18 PolarHBondContact O-N 3.18Å; Y14-S18 PolarHBondContact O-OG 2.98Å; A15-S18 WeakPolarHBondContact CA-OG 3.33Å; A15-S18 PolarHBondContact O-OG 3.21Å; Q16-S18 VanDerWaalsContact C-N 3.32Å; Q16-S18 PolarHBondContact O-N 3.46Å; S18-F21 PolarHBondContact O-N 3.24Å; S18-I22 WeakPolarHBondContact O-CB 3.17Å; S18-I22 WeakPolarHBondContact O-CD1 3.45Å; S18-I22 WeakPolarHBondContact O-CG1 3.39Å; S18-I22 PolarHBondContact O-N 2.65Å
19	S	71.5	Confident	70.5	Confident	49 Å²	49	94.2 Å²	94.2	34%	0.343	49%	0.486	S	S	.	.	H	α-helix	trans	-61.7	-45.4	174	-171	0	0	0	0	111.6	A15 Q16 I22 K23	A15-S19 WeakPolarHBondContact O-CB 3.42Å; A15-S19 PolarHBondContact O-N 3.35Å; Q16-S19 PolarHBondContact O-N 2.95Å; S19-I22 PolarHBondContact O-N 3.15Å; S19-K23 VanDerWaalsContact O-CG 3.29Å; S19-K23 WeakPolarHBondContact O-CG 3.48Å; S19-K23 PolarHBondContact O-N 3.31Å
20	D	71.7	Confident	70.6	Confident	94 Å²	94	93.6 Å²	93.6	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-66.3	-38.7	178.2	-66.4	-24.1	0	0	0	111.6	Q16 K23 A24	Q16-D20 PolarHBondContact O-N 3.37Å; D20-K23 PolarHBondContact O-N 3.34Å; D20-A24 VanDerWaalsContact O-CB 3.28Å; D20-A24 WeakPolarHBondContact O-CB 3.47Å; D20-A24 PolarHBondContact O-N 2.87Å
21	F	69.6	Low	71	Confident	141 Å²	141	90.1 Å²	90.1	62%	0.618	47%	0.47	S	S	*	.	H	α-helix	trans	-63.8	-42.5	173	-175.8	-94.8	0	0	0	112.1	K17 S18 A24 N25	K17-F21 VanDerWaalsContact O-CB 3.28Å; K17-F21 WeakPolarHBondContact O-CB 3.29Å; K17-F21 PolarHBondContact O-N 3.12Å; S18-F21 PolarHBondContact O-N 3.24Å; F21-A24 PolarHBondContact O-N 2.82Å; F21-N25 WeakPolarHBondContact O-CB 3.43Å; F21-N25 PolarHBondContact O-N 3.48Å
22	I	70.8	Confident	71.1	Confident	93 Å²	93	86.6 Å²	86.6	48%	0.477	46%	0.457	S	S	.	.	H	α-helix	trans	-63.6	-46.9	176.7	-71.7	163.7	0	0	0	110	S18 S19 N25 I26	S18-I22 WeakPolarHBondContact O-CB 3.17Å; S18-I22 WeakPolarHBondContact O-CD1 3.45Å; S18-I22 WeakPolarHBondContact O-CG1 3.39Å; S18-I22 PolarHBondContact O-N 2.65Å; S19-I22 PolarHBondContact O-N 3.15Å; I22-N25 PolarHBondContact O-N 3.45Å; I22-I26 HydrophobicContact CG2-CD1 3.54Å; I22-I26 HydrophobicContact CG2-CG1 4.22Å; I22-I26 WeakPolarHBondContact O-CB 3.28Å; I22-I26 WeakPolarHBondContact O-CG1 3.2Å; I22-I26 PolarHBondContact O-N 2.95Å
23	K	70.3	Confident	71.3	Confident	113 Å²	113	91.2 Å²	91.2	49%	0.491	47%	0.468	S	S	.	.	H	α-helix	trans	-58.8	-50.4	176.3	-71.7	170.7	-172.8	170.2	0	111	S19 D20 N25 I26 N27	S19-K23 VanDerWaalsContact O-CG 3.29Å; S19-K23 WeakPolarHBondContact O-CG 3.48Å; S19-K23 PolarHBondContact O-N 3.31Å; D20-K23 PolarHBondContact O-N 3.34Å; K23-N25 VanDerWaalsContact C-N 3.3Å; K23-N25 PolarHBondContact O-N 3.47Å; K23-I26 PolarHBondContact O-N 2.88Å; K23-N27 WeakPolarHBondContact O-CB 3.17Å; K23-N27 PolarHBondContact O-N 3.44Å; K23-N27 PolarHBondContact O-ND2 2.92Å; K23-N27 PolarHBondContact O-OD1 2.96Å; K23-N27 VanDerWaalsContact O-OD1 3.12Å
24	A	70.3	Confident	71.7	Confident	60 Å²	60	90.6 Å²	90.6	50%	0.496	47%	0.468	S	S	.	.	H	α-helix	trans	-59.4	-39.9	177.6	0	0	0	0	0	112.5	D20 F21 N27 Y28	D20-A24 VanDerWaalsContact O-CB 3.28Å; D20-A24 WeakPolarHBondContact O-CB 3.47Å; D20-A24 PolarHBondContact O-N 2.87Å; F21-A24 PolarHBondContact O-N 2.82Å; A24-N27 PolarHBondContact O-N 2.84Å; A24-Y28 WeakPolarHBondContact O-CB 3.28Å; A24-Y28 PolarHBondContact O-N 3.05Å
25	N	67.4	Low	72	Confident	76 Å²	76	85.5 Å²	85.5	41%	0.406	45%	0.451	S	S	.	.	H	α-helix	trans	-73.4	-37.8	179.8	-166	-3.6	0	0	0	112.6	F21 I22 K23 N27 Y28 T29	F21-N25 WeakPolarHBondContact O-CB 3.43Å; F21-N25 PolarHBondContact O-N 3.48Å; I22-N25 PolarHBondContact O-N 3.45Å; K23-N25 VanDerWaalsContact C-N 3.3Å; K23-N25 PolarHBondContact O-N 3.47Å; N25-N27 VanDerWaalsContact C-N 3.32Å; N25-Y28 PolarHBondContact O-N 3.27Å; N25-T29 VanDerWaalsContact O-CB 3.29Å; N25-T29 WeakPolarHBondContact O-CB 3.18Å; N25-T29 PolarHBondContact O-N 3.19Å; N25-T29 PolarHBondContact O-OG1 3.27Å; N25-T29 PolarHBondContact OD1-OG1 2.85Å
26	I	70.6	Confident	72.1	Confident	102 Å²	102	85.6 Å²	85.6	52%	0.523	45%	0.452	S	S	.	.	H	α-helix	trans	-59.9	-46.9	171.6	-71.7	167.8	0	0	0	109.6	I22 K23 T29 S30	I22-I26 HydrophobicContact CG2-CD1 3.54Å; I22-I26 HydrophobicContact CG2-CG1 4.22Å; I22-I26 WeakPolarHBondContact O-CB 3.28Å; I22-I26 WeakPolarHBondContact O-CG1 3.2Å; I22-I26 PolarHBondContact O-N 2.95Å; K23-I26 PolarHBondContact O-N 2.88Å; I26-T29 PolarHBondContact O-N 3.43Å; I26-S30 WeakPolarHBondContact O-CB 3.47Å; I26-S30 PolarHBondContact O-N 3.29Å
27	N	70.4	Confident	72.4	Confident	48 Å²	48	85.1 Å²	85.1	26%	0.257	45%	0.448	S	S	.	.	H	α-helix	trans	-65	-44.7	-179.5	-61.1	-1.5	0	0	0	110.5	K23 A24 N25 T29 S30 I31 P61	K23-N27 WeakPolarHBondContact O-CB 3.17Å; K23-N27 PolarHBondContact O-N 3.44Å; K23-N27 PolarHBondContact O-ND2 2.92Å; K23-N27 PolarHBondContact O-OD1 2.96Å; K23-N27 VanDerWaalsContact O-OD1 3.12Å; A24-N27 PolarHBondContact O-N 2.84Å; N25-N27 VanDerWaalsContact C-N 3.32Å; N27-T29 PolarHBondContact O-N 2.93Å; N27-S30 WeakPolarHBondContact O-CB 3.32Å; N27-S30 PolarHBondContact O-N 3.38Å; N27-I31 WeakPolarHBondContact O-CG1 3.39Å; N27-I31 PolarHBondContact O-N 3.43Å; N27-P61 WeakPolarHBondContact CB-O 3.2Å; N27-P61 WeakPolarHBondContact CB-OXT 3.32Å; N27-P61 VanDerWaalsContact CG-C 3.42Å; N27-P61 PolarHBondContact ND2-O 3.14Å; N27-P61 VanDerWaalsContact ND2-O 3.15Å; N27-P61 PolarHBondContact ND2-OXT 2.77Å; N27-P61 PolarHBondContact OD1-O 3.47Å
28	Y	70.3	Confident	72.5	Confident	171 Å²	171	79.9 Å²	79.9	67%	0.671	43%	0.428	S	S	*	.	H	α-helix	trans	-60.6	-43.8	175.3	-173.1	-94.1	0	0	0	112.7	A24 N25 I31 A32	A24-Y28 WeakPolarHBondContact O-CB 3.28Å; A24-Y28 PolarHBondContact O-N 3.05Å; N25-Y28 PolarHBondContact O-N 3.27Å; Y28-I31 PolarHBondContact O-N 3.32Å; Y28-A32 VanDerWaalsContact O-CB 3.3Å; Y28-A32 WeakPolarHBondContact O-CB 3.02Å; Y28-A32 PolarHBondContact O-N 2.85Å
29	T	74.5	Confident	72.5	Confident	80 Å²	80	81.4 Å²	81.4	49%	0.491	43%	0.427	S	S	.	.	H	α-helix	trans	-65.8	-40.1	178.2	-59.5	0	0	0	0	111.2	N25 I26 N27 A32 Y33	N25-T29 VanDerWaalsContact O-CB 3.29Å; N25-T29 WeakPolarHBondContact O-CB 3.18Å; N25-T29 PolarHBondContact O-N 3.19Å; N25-T29 PolarHBondContact O-OG1 3.27Å; N25-T29 PolarHBondContact OD1-OG1 2.85Å; I26-T29 PolarHBondContact O-N 3.43Å; N27-T29 PolarHBondContact O-N 2.93Å; T29-A32 PolarHBondContact O-N 2.9Å; T29-Y33 VanDerWaalsContact O-CB 3.3Å; T29-Y33 WeakPolarHBondContact O-CB 3.44Å; T29-Y33 PolarHBondContact O-N 3.44Å
30	S	75.1	Confident	72.5	Confident	64 Å²	64	88.7 Å²	88.7	45%	0.448	45%	0.447	S	S	.	.	H	α-helix	trans	-61.5	-47.5	175.7	-173.1	0	0	0	0	111.6	I26 N27 Y33 C34	I26-S30 WeakPolarHBondContact O-CB 3.47Å; I26-S30 PolarHBondContact O-N 3.29Å; N27-S30 WeakPolarHBondContact O-CB 3.32Å; N27-S30 PolarHBondContact O-N 3.38Å; S30-Y33 PolarHBondContact O-N 3.27Å; S30-C34 WeakPolarHBondContact O-CB 3.46Å; S30-C34 PolarHBondContact O-N 2.85Å
31	I	75	Confident	72.2	Confident	40 Å²	40	89 Å²	89	21%	0.205	45%	0.449	C	S	.	.	H	α-helix	trans	-62.1	-48.9	177.1	-65.5	165.2	0	0	0	110.3	N27 Y28 Y33 C34 I35 L58	N27-I31 WeakPolarHBondContact O-CG1 3.39Å; N27-I31 PolarHBondContact O-N 3.43Å; Y28-I31 PolarHBondContact O-N 3.32Å; I31-Y33 VanDerWaalsContact C-N 3.3Å; I31-Y33 PolarHBondContact O-N 3.47Å; I31-C34 WeakPolarHBondContact O-CB 3.21Å; I31-C34 PolarHBondContact O-N 3.41Å; I31-C34 VanDerWaalsContact O-N 3.16Å; I31-I35 HydrophobicContact CG2-CD1 3.8Å; I31-I35 HydrophobicContact CG2-CG1 4.42Å; I31-I35 WeakPolarHBondContact O-CG1 3.2Å; I31-I35 PolarHBondContact O-N 3.33Å; I31-L58 HydrophobicContact CG2-CD2 4.41Å
32	A	75.3	Confident	71.7	Confident	44 Å²	44	83.4 Å²	83.4	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-59.3	-41.5	178.7	0	0	0	0	0	111.9	Y28 T29 A36	Y28-A32 VanDerWaalsContact O-CB 3.3Å; Y28-A32 WeakPolarHBondContact O-CB 3.02Å; Y28-A32 PolarHBondContact O-N 2.85Å; T29-A32 PolarHBondContact O-N 2.9Å; A32-A36 VanDerWaalsContact O-CB 3.32Å; A32-A36 WeakPolarHBondContact O-CB 3.34Å; A32-A36 PolarHBondContact O-N 3.4Å
33	Y	77.1	Confident	71	Confident	164 Å²	164	83.3 Å²	83.3	64%	0.643	43%	0.432	S	S	*	.	H	α-helix	trans	-62.9	-44.9	174.6	-178.6	-96.7	0	0	0	112	T29 S30 I31 I35 A36 F37	T29-Y33 VanDerWaalsContact O-CB 3.3Å; T29-Y33 WeakPolarHBondContact O-CB 3.44Å; T29-Y33 PolarHBondContact O-N 3.44Å; S30-Y33 PolarHBondContact O-N 3.27Å; I31-Y33 VanDerWaalsContact C-N 3.3Å; I31-Y33 PolarHBondContact O-N 3.47Å; Y33-I35 PolarHBondContact O-N 3.34Å; Y33-A36 PolarHBondContact O-N 3.39Å; Y33-F37 VanDerWaalsContact O-CB 3.3Å; Y33-F37 WeakPolarHBondContact O-CB 3.3Å; Y33-F37 PolarHBondContact O-N 2.02Å
34	C	77.9	Confident	70.3	Confident	38 Å²	38	81.4 Å²	81.4	26%	0.257	43%	0.432	S	S	.	.	H	α-helix	trans	-61.6	-44.3	178.4	-177.8	0	0	0	0	111.9	S30 I31 F37 T38 C57	S30-C34 WeakPolarHBondContact O-CB 3.46Å; S30-C34 PolarHBondContact O-N 2.85Å; I31-C34 WeakPolarHBondContact O-CB 3.21Å; I31-C34 PolarHBondContact O-N 3.41Å; I31-C34 VanDerWaalsContact O-N 3.16Å; C34-F37 PolarHBondContact O-N 2.82Å; C34-T38 WeakPolarHBondContact O-CB 3.36Å; C34-T38 PolarHBondContact O-N 2.98Å; C34-T38 PolarHBondContact O-OG1 3.34Å; C34-C57 HydrophobicContact CB-CB 3.6Å; C34-C57 WeakPolarHBondContact CB-SG 3.08Å; C34-C57 WeakPolarHBondContact SG-CA 3.07Å; C34-C57 WeakPolarHBondContact SG-CB 3.32Å; C34-C57 CovalentContact SG-SG 2.02Å; C34-C57 PolarHBondContact SG-SG 3.31Å
35	I	75.9	Confident	69.6	Low	51 Å²	51	85.9 Å²	85.9	26%	0.262	45%	0.446	S	S	.	.	H	α-helix	trans	-61.9	-49.6	175.1	-66.5	170	0	0	0	110.2	I31 Y33 F37 T38 F39 C57	I31-I35 HydrophobicContact CG2-CD1 3.8Å; I31-I35 HydrophobicContact CG2-CG1 4.42Å; I31-I35 WeakPolarHBondContact O-CG1 3.2Å; I31-I35 PolarHBondContact O-N 3.33Å; Y33-I35 PolarHBondContact O-N 3.34Å; I35-F37 VanDerWaalsContact C-N 3.33Å; I35-F37 PolarHBondContact O-N 3.49Å; I35-T38 WeakPolarHBondContact O-CB 3Å; I35-T38 PolarHBondContact O-N 3.43Å; I35-F39 HydrophobicContact CG2-CD2 3.75Å; I35-F39 HydrophobicContact CG2-CE2 3.48Å; I35-F39 VanDerWaalsContact CG2-CE2 3.48Å; I35-F39 WeakPolarHBondContact O-CD2 3.29Å; I35-F39 PolarHBondContact O-N 2.89Å; I35-F39 VanDerWaalsContact O-N 3.08Å; I35-C57 HydrophobicContact CG1-CB 4.18Å
36	A	73.5	Confident	68.7	Low	58 Å²	58	91 Å²	91	48%	0.479	46%	0.464	S	S	.	.	H	α-helix	trans	-60.8	-40.1	179.5	0	0	0	0	0	112.6	A32 Y33 F39 R40	A32-A36 VanDerWaalsContact O-CB 3.32Å; A32-A36 WeakPolarHBondContact O-CB 3.34Å; A32-A36 PolarHBondContact O-N 3.4Å; Y33-A36 PolarHBondContact O-N 3.39Å; A36-F39 PolarHBondContact O-N 3.46Å; A36-R40 WeakPolarHBondContact O-CB 3.31Å; A36-R40 PolarHBondContact O-N 2.86Å
37	F	76.9	Confident	67.8	Low	100 Å²	100	89.1 Å²	89.1	44%	0.439	46%	0.455	S	S	.	.	H	α-helix	trans	-65.5	-39	176	-174.2	-96.9	0	0	0	112.1	Y33 C34 I35 R40 N41	Y33-F37 VanDerWaalsContact O-CB 3.3Å; Y33-F37 WeakPolarHBondContact O-CB 3.3Å; Y33-F37 PolarHBondContact O-N 2.02Å; C34-F37 PolarHBondContact O-N 2.82Å; I35-F37 VanDerWaalsContact C-N 3.33Å; I35-F37 PolarHBondContact O-N 3.49Å; F37-R40 PolarHBondContact O-N 2.92Å; F37-N41 VanDerWaalsContact CD1-ND2 3.32Å; F37-N41 WeakPolarHBondContact CD1-ND2 3.5Å; F37-N41 WeakPolarHBondContact CE1-ND2 3.5Å; F37-N41 VanDerWaalsContact CE2-ND2 3.31Å; F37-N41 WeakPolarHBondContact CE2-ND2 3.4Å; F37-N41 WeakPolarHBondContact CZ-ND2 3.3Å; F37-N41 PolarHBondContact O-N 2.98Å; F37-N41 VanDerWaalsContact O-N 3.09Å; F37-N41 PolarHBondContact O-ND2 2.9Å
38	T	71	Confident	66.7	Low	30 Å²	30	96.6 Å²	96.6	18%	0.184	48%	0.481	C	S	.	.	H	α-helix	trans	-60.4	-47.4	175	-59.7	0	0	0	0	110.8	C34 I35 R40 N41 S42 I54	C34-T38 WeakPolarHBondContact O-CB 3.36Å; C34-T38 PolarHBondContact O-N 2.98Å; C34-T38 PolarHBondContact O-OG1 3.34Å; I35-T38 WeakPolarHBondContact O-CB 3Å; I35-T38 PolarHBondContact O-N 3.43Å; T38-R40 VanDerWaalsContact C-N 3.33Å; T38-R40 PolarHBondContact O-N 3.16Å; T38-N41 PolarHBondContact O-N 2.91Å; T38-S42 PolarHBondContact O-N 3.37Å; T38-S42 PolarHBondContact O-OG 3.29Å; T38-I54 HydrophobicContact CG2-CG1 4.48Å
39	F	68.2	Low	65.6	Low	93 Å²	93	97 Å²	97	41%	0.408	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-34.4	176.6	-77.5	-67.5	0	0	0	113.4	I35 A36 S42 P44 I54	I35-F39 HydrophobicContact CG2-CD2 3.75Å; I35-F39 HydrophobicContact CG2-CE2 3.48Å; I35-F39 VanDerWaalsContact CG2-CE2 3.48Å; I35-F39 WeakPolarHBondContact O-CD2 3.29Å; I35-F39 PolarHBondContact O-N 2.89Å; I35-F39 VanDerWaalsContact O-N 3.08Å; A36-F39 PolarHBondContact O-N 3.46Å; F39-S42 CarbonylContact O-C 3.39Å; F39-S42 VanDerWaalsContact O-O 3.13Å; F39-P44 HydrophobicContact CD1-CB 3.96Å; F39-P44 HydrophobicContact CD1-CG 4.49Å; F39-P44 HydrophobicContact CE1-CB 3.95Å; F39-I54 HydrophobicContact CZ-CD1 4.25Å
40	R	70.1	Confident	64.5	Low	202 Å²	202	97.9 Å²	97.9	76%	0.762	49%	0.491	S	S	*	.	H	α-helix	trans	-66.3	-40.5	177.9	-175.9	-177.9	179	-150.7	-0.5	112.5	A36 F37 T38	A36-R40 WeakPolarHBondContact O-CB 3.31Å; A36-R40 PolarHBondContact O-N 2.86Å; F37-R40 PolarHBondContact O-N 2.92Å; T38-R40 VanDerWaalsContact C-N 3.33Å; T38-R40 PolarHBondContact O-N 3.16Å
41	N	65.7	Low	63.5	Low	101 Å²	101	101.1 Å²	101.1	54%	0.54	50%	0.499	S	S	.	.	H	α-helix	trans	-91.3	-16.6	-178.2	-63.3	-63.2	0	0	0	113.1	F37 T38	F37-N41 VanDerWaalsContact CD1-ND2 3.32Å; F37-N41 WeakPolarHBondContact CD1-ND2 3.5Å; F37-N41 WeakPolarHBondContact CE1-ND2 3.5Å; F37-N41 VanDerWaalsContact CE2-ND2 3.31Å; F37-N41 WeakPolarHBondContact CE2-ND2 3.4Å; F37-N41 WeakPolarHBondContact CZ-ND2 3.3Å; F37-N41 PolarHBondContact O-N 2.98Å; F37-N41 VanDerWaalsContact O-N 3.09Å; F37-N41 PolarHBondContact O-ND2 2.9Å; T38-N41 PolarHBondContact O-N 2.91Å
42	S	59.9	Low	62.6	Low	24 Å²	24	103.9 Å²	103.9	17%	0.168	52%	0.522	C	S	.	.	S	Bend	trans	-132.8	98.4	173.9	60.3	0	0	0	0	111.4	T38 F39 N47	T38-S42 PolarHBondContact O-N 3.37Å; T38-S42 PolarHBondContact O-OG 3.29Å; F39-S42 CarbonylContact O-C 3.39Å; F39-S42 VanDerWaalsContact O-O 3.13Å; S42-N47 WeakPolarHBondContact CB-ND2 3.34Å; S42-N47 PolarHBondContact OG-ND2 3.37Å
43	P	55.4	Low	61.8	Low	90 Å²	90	103.2 Å²	103.2	58%	0.584	52%	0.519	S	S	*	.			trans	-58.6	142.4	-176.8	19.6	-29.6	0	0	0	111.5	I45	P43-I45 PolarHBondContact O-N 3.02Å
44	P	56.5	Low	61.1	Low	74 Å²	74	99.1 Å²	99.1	48%	0.481	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	14.3	-164.9	24.4	-34.2	0	0	0	116.6	F39	F39-P44 HydrophobicContact CD1-CB 3.96Å; F39-P44 HydrophobicContact CD1-CG 4.49Å; F39-P44 HydrophobicContact CE1-CB 3.95Å
45	I	54.4	Low	60.3	Low	154 Å²	154	102.2 Å²	102.2	79%	0.79	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-8.3	-171.4	-73.3	164.1	0	0	0	112.8	P43	P43-I45 PolarHBondContact O-N 3.02Å
46	K	50.1	Low	59.7	Low	184 Å²	184	101.3 Å²	101.3	80%	0.8	52%	0.524	S	S	*	.	S	Bend	trans	-130.5	6.2	179.9	-76	-172.2	175.9	-177.2	0	116.5
47	N	50.7	Low	59.4	Low	61 Å²	61	98.6 Å²	98.6	33%	0.326	50%	0.502	S	S	.	.			trans	-130.2	16.5	-166.1	-103.2	4.5	0	0	0	116.6	S42 E49 N50	S42-N47 WeakPolarHBondContact CB-ND2 3.34Å; S42-N47 PolarHBondContact OG-ND2 3.37Å; N47-E49 PolarHBondContact O-N 3.44Å; N47-E49 VanDerWaalsContact O-N 3.14Å; N47-N50 HydrophobicContact CB-CB 4.46Å; N47-N50 PolarHBondContact O-N 3.28Å; N47-N50 PolarHBondContact OD1-ND2 3.09Å
48	Y	48.5	Very low	58.8	Low	205 Å²	205	99.1 Å²	99.1	80%	0.804	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.1	167	-90.1	-87	0	0	0	112.8	H51	Y48-H51 PolarHBondContact O-CD2 3.43Å; Y48-H51 PolarHBondContact O-NE2 2.7Å
49	E	46.8	Very low	58.2	Low	181 Å²	181	104.3 Å²	104.3	85%	0.846	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.5	173.5	-69.2	-178.1	139.3	0	0	113.7	N47 H51	N47-E49 PolarHBondContact O-N 3.44Å; N47-E49 VanDerWaalsContact O-N 3.14Å; E49-H51 PolarHBondContact O-N 2.92Å
50	N	50.1	Low	57.6	Low	98 Å²	98	106.4 Å²	106.4	52%	0.524	54%	0.544	S	S	.	.			trans	-95.7	67.1	174.7	-90.3	-38.7	0	0	0	110.3	N47 S52 G53	N47-N50 HydrophobicContact CB-CB 4.46Å; N47-N50 PolarHBondContact O-N 3.28Å; N47-N50 PolarHBondContact OD1-ND2 3.09Å; N50-S52 PolarHBondContact O-N 2.87Å; N50-G53 PolarHBondContact O-N 3.41Å
51	H	54	Low	56.5	Low	132 Å²	132	103.5 Å²	103.5	61%	0.611	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.1	-23.9	175.6	-79.6	-93.3	0	0	0	113.5	Y48 E49 G53 L55	Y48-H51 PolarHBondContact O-CD2 3.43Å; Y48-H51 PolarHBondContact O-NE2 2.7Å; E49-H51 PolarHBondContact O-N 2.92Å; H51-G53 PolarHBondContact O-N 3.43Å; H51-L55 HydrophobicContact CB-CD1 4.04Å; H51-L55 VanDerWaalsContact O-CB 3.31Å; H51-L55 WeakPolarHBondContact O-CB 3.06Å; H51-L55 WeakPolarHBondContact O-CD1 3.31Å; H51-L55 PolarHBondContact O-N 2.99Å
52	S	57.3	Low	56.1	Low	98 Å²	98	103.7 Å²	103.7	69%	0.685	55%	0.552	S	S	*	*	H	α-helix	trans	-68.5	-25.6	-174.7	-51.6	0	0	0	0	115.8	N50 G56	N50-S52 PolarHBondContact O-N 2.87Å; S52-G56 PolarHBondContact O-N 3.38Å
53	G	58	Low	55.9	Low	30 Å²	30	107.8 Å²	107.8	31%	0.309	57%	0.572	S	S	.	*	H	α-helix	trans	-72.5	-49	-175.5	0	0	0	0	0	113.1	N50 H51 C57	N50-G53 PolarHBondContact O-N 3.41Å; H51-G53 PolarHBondContact O-N 3.43Å; G53-C57 PolarHBondContact O-SG 3.41Å; G53-C57 VanDerWaalsContact O-SG 3.34Å
54	I	62	Low	55.9	Low	78 Å²	78	108.8 Å²	108.8	40%	0.4	57%	0.572	S	S	.	*	H	α-helix	trans	-76.4	-38.8	179.6	-64.7	164.4	0	0	0	110.8	T38 F39 G56 C57	T38-I54 HydrophobicContact CG2-CG1 4.48Å; F39-I54 HydrophobicContact CZ-CD1 4.25Å; I54-G56 VanDerWaalsContact C-N 3.31Å; I54-G56 PolarHBondContact O-N 2.84Å; I54-C57 WeakPolarHBondContact O-CB 3.3Å; I54-C57 PolarHBondContact O-N 3Å
55	L	60.9	Low	55.9	Low	103 Å²	103	110.9 Å²	110.9	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-65.1	-34.3	174.8	-80.9	159.9	0	0	0	112.1	H51 C57 L58 D59	H51-L55 HydrophobicContact CB-CD1 4.04Å; H51-L55 VanDerWaalsContact O-CB 3.31Å; H51-L55 WeakPolarHBondContact O-CB 3.06Å; H51-L55 WeakPolarHBondContact O-CD1 3.31Å; H51-L55 PolarHBondContact O-N 2.99Å; L55-C57 PolarHBondContact O-N 3.08Å; L55-L58 PolarHBondContact O-N 3.18Å; L55-D59 PolarHBondContact O-N 2.95Å
56	G	63.3	Low	56	Low	32 Å²	32	108.2 Å²	108.2	33%	0.33	56%	0.564	S	S	.	*	H	α-helix	trans	-63	-25.1	174.3	0	0	0	0	0	113.6	S52 I54 F60	S52-G56 PolarHBondContact O-N 3.38Å; I54-G56 VanDerWaalsContact C-N 3.31Å; I54-G56 PolarHBondContact O-N 2.84Å; G56-F60 WeakPolarHBondContact O-CD2 3.4Å; G56-F60 WeakPolarHBondContact O-CE2 3.49Å
57	C	68.2	Low	56.3	Low	1 Å²	1	103.1 Å²	103.1	1%	0.007	55%	0.548	C	S	.	.	H	α-helix	trans	-78.3	-21.2	173.9	-57	0	0	0	0	113.3	C34 I35 G53 I54 L55	C34-C57 HydrophobicContact CB-CB 3.6Å; C34-C57 WeakPolarHBondContact CB-SG 3.08Å; C34-C57 WeakPolarHBondContact SG-CA 3.07Å; C34-C57 WeakPolarHBondContact SG-CB 3.32Å; C34-C57 CovalentContact SG-SG 2.02Å; C34-C57 PolarHBondContact SG-SG 3.31Å; I35-C57 HydrophobicContact CG1-CB 4.18Å; G53-C57 PolarHBondContact O-SG 3.41Å; G53-C57 VanDerWaalsContact O-SG 3.34Å; I54-C57 WeakPolarHBondContact O-CB 3.3Å; I54-C57 PolarHBondContact O-N 3Å; L55-C57 PolarHBondContact O-N 3.08Å
58	L	62.8	Low	56.7	Low	110 Å²	110	106.1 Å²	106.1	58%	0.576	56%	0.564	S	S	*	*	H	α-helix	trans	-89.1	-8.4	-178.8	-68.1	171.2	0	0	0	113.3	I31 L55 F60	I31-L58 HydrophobicContact CG2-CD2 4.41Å; L55-L58 PolarHBondContact O-N 3.18Å; L58-F60 VanDerWaalsContact C-N 3.34Å
59	D	60.1	Low	57.4	Low	140 Å²	140	98.5 Å²	98.5	75%	0.749	55%	0.546	S	S	*	.	S	Bend	trans	-92.5	7	178	-150.8	0.5	0	0	0	112.8	L55	L55-D59 PolarHBondContact O-N 2.95Å
60	F	54.5	Low	58.3	Low	137 Å²	137	91.7 Å²	91.7	60%	0.601	52%	0.521	S	S	*	.			trans	-101.6	128.7	173.1	-71.2	-83.6	0	0	0	109.9	G56 L58	G56-F60 WeakPolarHBondContact O-CD2 3.4Å; G56-F60 WeakPolarHBondContact O-CE2 3.49Å; L58-F60 VanDerWaalsContact C-N 3.34Å
61	P	47.9	Very low	59	Low	141 Å²	141	91.1 Å²	91.1	92%	0.916	52%	0.52	S	S	*	.			trans	-59	0	-177.1	24.5	-33.8	0	0	0	112.6	N27	N27-P61 WeakPolarHBondContact CB-O 3.2Å; N27-P61 WeakPolarHBondContact CB-OXT 3.32Å; N27-P61 VanDerWaalsContact CG-C 3.42Å; N27-P61 PolarHBondContact ND2-O 3.14Å; N27-P61 VanDerWaalsContact ND2-O 3.15Å; N27-P61 PolarHBondContact ND2-OXT 2.77Å; N27-P61 PolarHBondContact OD1-O 3.47Å

Retrieved 61 of 61 residues in 14.6 ms (Link to these results)

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