A0A5K4F9D7_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F9D7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 80 aa.

						>A0A5K4F9D7_SCHMA|A0A5K4F9D7
MTKLIKLENPNLGIIIQCFDCNTLDGNFLPLDNNGEFAILQKRQQSNRPVLLSFQLIKLSKLKNQMFCGKILLFIYSYDS
					

Structure Viewer

Loading PAE data...

(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	74.2	Confident	80.1	Confident	173 Å²	173	104.2 Å²	104.2	85%	0.852	53%	0.525	S	S	*	.				0	138.8	0	179	-175	-180	0	0	108.7	Q17 C18	M1-Q17 WeakPolarHBondContact O-CA 2.77Å; M1-C18 PolarHBondContact N-O 3.06Å; M1-C18 VanDerWaalsContact N-O 3.08Å; M1-C18 PolarHBondContact O-N 3.25Å
2	T	74.3	Confident	80.6	Confident	54 Å²	54	99.3 Å²	99.3	33%	0.331	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.2	178	-52.9	0	0	0	0	110.6	I15 I16 Q17 L29	T2-I15 HydrophobicContact CG2-CG2 3.8Å; T2-I16 CarbonylContact C-O 3.54Å; T2-I16 VanDerWaalsContact CA-O 3.31Å; T2-I16 WeakPolarHBondContact CA-O 2.89Å; T2-Q17 HydrophobicContact CG2-CG 3.9Å; T2-L29 HydrophobicContact CG2-CD1 4.19Å; T2-L29 HydrophobicContact CG2-CD2 3.98Å; T2-L29 HydrophobicContact CG2-CG 4.11Å
3	K	77.6	Confident	81	Confident	123 Å²	123	92.1 Å²	92.1	54%	0.535	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.4	176.5	-171	175.1	-178.3	-180	0	110.3	I5 I16	K3-I5 HydrophobicContact CG-CG1 4.41Å; K3-I16 PolarHBondContact N-O 3.28Å; K3-I16 PolarHBondContact O-N 3.16Å
4	L	79.1	Confident	81.5	Confident	52 Å²	52	88.1 Å²	88.1	27%	0.272	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.8	168.2	179.7	68.9	0	0	0	109	I14 I15 I39 L40	L4-I14 CarbonylContact C-O 3.36Å; L4-I14 WeakPolarHBondContact CA-O 3.38Å; L4-I15 HydrophobicContact CD1-CG1 3.84Å; L4-I39 HydrophobicContact CB-CD1 4.39Å; L4-L40 HydrophobicContact CD1-CD2 4.21Å
5	I	81.6	Confident	81.8	Confident	62 Å²	62	82.3 Å²	82.3	32%	0.318	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.7	174.4	-58.1	-177.7	0	0	0	107.9	K3 I14 I16	K3-I5 HydrophobicContact CG-CG1 4.41Å; I5-I14 HydrophobicContact CB-CB 4.48Å; I5-I14 PolarHBondContact N-O 2.73Å; I5-I14 PolarHBondContact O-N 2.99Å; I5-I16 HydrophobicContact CD1-CD1 3.5Å; I5-I16 HydrophobicContact CD1-CG1 4.24Å; I5-I16 HydrophobicContact CG1-CD1 4.42Å
6	K	77.9	Confident	81.9	Confident	162 Å²	162	79.7 Å²	79.7	70%	0.704	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	139.1	168.8	-69.3	-170	173.7	-167.5	0	109.4
7	L	81.4	Confident	81.9	Confident	70 Å²	70	75.2 Å²	75.2	37%	0.366	38%	0.381	S	S	.	.			trans	-91.4	170.4	171.1	-60.4	-177.9	0	0	0	109.8	N9 L12 I14	L7-N9 PolarHBondContact O-N 3.34Å; L7-L12 HydrophobicContact CB-CB 4.33Å; L7-L12 HydrophobicContact CD1-CB 3.92Å; L7-L12 HydrophobicContact CD1-CD1 4.49Å; L7-I14 HydrophobicContact CD1-CD1 4.15Å; L7-I14 HydrophobicContact CD1-CG1 4.1Å; L7-I14 HydrophobicContact CD2-CD1 3.83Å; L7-I14 HydrophobicContact CD2-CG1 4.22Å; L7-I14 HydrophobicContact CG-CD1 4.35Å; L7-I14 HydrophobicContact CG-CG1 4.26Å
8	E	85.9	Confident	81.7	Confident	204 Å²	204	74.4 Å²	74.4	95%	0.953	38%	0.383	S	S	*	.	S	Bend	trans	-58.7	-31.6	174.9	-66.4	179.4	168.2	0	0	111.9	P10	E8-P10 WeakPolarHBondContact O-CD 3.48Å
9	N	82.8	Confident	81.6	Confident	75 Å²	75	71.3 Å²	71.3	40%	0.401	37%	0.366	S	S	.	.	S	Bend	trans	-76.4	117.8	167.8	-174.8	-20.5	0	0	0	109.8	L7 N11 L12	L7-N9 PolarHBondContact O-N 3.34Å; N9-N11 PolarHBondContact O-N 3.17Å; N9-N11 VanDerWaalsContact O-N 3.16Å; N9-N11 WeakPolarHBondContact OD1-CB 3.45Å; N9-N11 PolarHBondContact OD1-N 3.09Å; N9-L12 HydrophobicContact CB-CB 4.32Å; N9-L12 HydrophobicContact CB-CD1 4.03Å; N9-L12 HydrophobicContact CB-CG 4.17Å; N9-L12 PolarHBondContact O-N 3.23Å
10	P	82.2	Confident	81.4	Confident	110 Å²	110	71.8 Å²	71.8	71%	0.714	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.3	-178.9	27.6	-36.2	0	0	0	113.4	E8 L12	E8-P10 WeakPolarHBondContact O-CD 3.48Å; P10-L12 VanDerWaalsContact C-N 3.26Å; P10-L12 PolarHBondContact O-N 2.8Å
11	N	83.8	Confident	81	Confident	61 Å²	61	70.5 Å²	70.5	33%	0.326	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	4.3	179.3	-61.8	-5.1	0	0	0	111.8	N9 S77 Y78 D79	N9-N11 PolarHBondContact O-N 3.17Å; N9-N11 VanDerWaalsContact O-N 3.16Å; N9-N11 WeakPolarHBondContact OD1-CB 3.45Å; N9-N11 PolarHBondContact OD1-N 3.09Å; N11-S77 CarbonylContact O-C 3.51Å; N11-S77 WeakPolarHBondContact O-CA 3.28Å; N11-Y78 WeakPolarHBondContact CB-O 3.49Å; N11-Y78 PolarHBondContact O-N 2.9Å; N11-Y78 PolarHBondContact OD1-O 3.49Å; N11-D79 WeakPolarHBondContact CB-OD1 3.32Å; N11-D79 VanDerWaalsContact CG-OD1 3.32Å; N11-D79 PolarHBondContact ND2-OD1 3.11Å
12	L	86.5	Confident	80.8	Confident	46 Å²	46	69.6 Å²	69.6	24%	0.241	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.2	178.3	-63.2	176.2	0	0	0	111.8	L7 N9 P10 L52 Y76	L7-L12 HydrophobicContact CB-CB 4.33Å; L7-L12 HydrophobicContact CD1-CB 3.92Å; L7-L12 HydrophobicContact CD1-CD1 4.49Å; N9-L12 HydrophobicContact CB-CB 4.32Å; N9-L12 HydrophobicContact CB-CD1 4.03Å; N9-L12 HydrophobicContact CB-CG 4.17Å; N9-L12 PolarHBondContact O-N 3.23Å; P10-L12 VanDerWaalsContact C-N 3.26Å; P10-L12 PolarHBondContact O-N 2.8Å; L12-L52 HydrophobicContact CD2-CD1 3.78Å; L12-Y76 WeakPolarHBondContact CA-O 3.45Å
13	G	86.2	Confident	80.2	Confident	5 Å²	5	68.8 Å²	68.8	5%	0.052	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	150.6	176.4	0	0	0	0	0	112.4	I75 Y76	G13-I75 WeakPolarHBondContact O-CA 3.32Å; G13-Y76 PolarHBondContact N-O 3.12Å; G13-Y76 PolarHBondContact O-N 2.91Å
14	I	87.6	Confident	79.3	Confident	37 Å²	37	68 Å²	68	19%	0.19	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.6	172.7	-56.3	-179.3	0	0	0	109.3	L4 I5 L7 I16 L73 F74 I75	L4-I14 CarbonylContact C-O 3.36Å; L4-I14 WeakPolarHBondContact CA-O 3.38Å; I5-I14 HydrophobicContact CB-CB 4.48Å; I5-I14 PolarHBondContact N-O 2.73Å; I5-I14 PolarHBondContact O-N 2.99Å; L7-I14 HydrophobicContact CD1-CD1 4.15Å; L7-I14 HydrophobicContact CD1-CG1 4.1Å; L7-I14 HydrophobicContact CD2-CD1 3.83Å; L7-I14 HydrophobicContact CD2-CG1 4.22Å; L7-I14 HydrophobicContact CG-CD1 4.35Å; L7-I14 HydrophobicContact CG-CG1 4.26Å; I14-I16 HydrophobicContact CG2-CG1 3.98Å; I14-L73 HydrophobicContact CG2-CD2 4.47Å; I14-F74 CarbonylContact C-O 3.57Å; I14-F74 VanDerWaalsContact CA-O 3.25Å; I14-F74 WeakPolarHBondContact CA-O 3.38Å; I14-I75 HydrophobicContact CG1-CG1 4.36Å
15	I	85.8	Confident	78.1	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.2	164.2	-60.6	179.8	0	0	0	108.2	T2 L4 Q17 L29 F37 I39 L40 L73 F74 Y76	T2-I15 HydrophobicContact CG2-CG2 3.8Å; L4-I15 HydrophobicContact CD1-CG1 3.84Å; I15-Q17 HydrophobicContact CG2-CG 4.19Å; I15-L29 HydrophobicContact CD1-CD1 3.6Å; I15-L29 HydrophobicContact CG2-CD1 3.61Å; I15-F37 HydrophobicContact CD1-CB 4.37Å; I15-F37 HydrophobicContact CD1-CG 4.26Å; I15-I39 HydrophobicContact CD1-CG2 3.86Å; I15-L40 HydrophobicContact CD1-CD1 4.11Å; I15-L40 HydrophobicContact CD1-CD2 3.98Å; I15-L40 HydrophobicContact CD1-CG 4.09Å; I15-L40 HydrophobicContact CG1-CD2 4.42Å; I15-L73 CarbonylContact O-C 3.52Å; I15-L73 WeakPolarHBondContact O-CA 3.09Å; I15-F74 HydrophobicContact CB-CB 4.26Å; I15-F74 HydrophobicContact CB-CD2 4.23Å; I15-F74 HydrophobicContact CG2-CD2 4.2Å; I15-F74 PolarHBondContact N-O 2.64Å; I15-F74 PolarHBondContact O-N 3.04Å; I15-Y76 HydrophobicContact CB-CE2 4.12Å; I15-Y76 HydrophobicContact CD1-CD2 4.31Å; I15-Y76 HydrophobicContact CD1-CE2 3.5Å; I15-Y76 VanDerWaalsContact CD1-CE2 3.5Å; I15-Y76 HydrophobicContact CG1-CD2 4.26Å; I15-Y76 HydrophobicContact CG1-CE2 3.67Å
16	I	83.7	Confident	76.7	Confident	41 Å²	41	69.7 Å²	69.7	21%	0.21	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.9	171.5	-51.7	-168.7	0	0	0	108.5	T2 K3 I5 I14 I71 L73	T2-I16 CarbonylContact C-O 3.54Å; T2-I16 VanDerWaalsContact CA-O 3.31Å; T2-I16 WeakPolarHBondContact CA-O 2.89Å; K3-I16 PolarHBondContact N-O 3.28Å; K3-I16 PolarHBondContact O-N 3.16Å; I5-I16 HydrophobicContact CD1-CD1 3.5Å; I5-I16 HydrophobicContact CD1-CG1 4.24Å; I5-I16 HydrophobicContact CG1-CD1 4.42Å; I14-I16 HydrophobicContact CG2-CG1 3.98Å; I16-I71 HydrophobicContact CG2-CG2 3.74Å; I16-L73 HydrophobicContact CB-CD2 4.17Å; I16-L73 HydrophobicContact CD1-CD2 3.99Å; I16-L73 HydrophobicContact CG1-CD2 3.63Å; I16-L73 HydrophobicContact CG2-CD2 3.97Å
17	Q	82.5	Confident	75.5	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.019	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.6	169.8	-68.4	179	-21.1	0	0	110.1	M1 T2 I15 F19 I71 L72	M1-Q17 WeakPolarHBondContact O-CA 2.77Å; T2-Q17 HydrophobicContact CG2-CG 3.9Å; I15-Q17 HydrophobicContact CG2-CG 4.19Å; Q17-F19 HydrophobicContact CB-CE2 3.71Å; Q17-F19 HydrophobicContact CB-CZ 4.11Å; Q17-I71 CarbonylContact O-C 3.45Å; Q17-I71 WeakPolarHBondContact O-CA 3.07Å; Q17-L72 HydrophobicContact CB-CB 4.26Å; Q17-L72 PolarHBondContact N-O 3.08Å; Q17-L72 PolarHBondContact O-N 2.9Å
18	C	77.7	Confident	74.5	Confident	61 Å²	61	72 Å²	72	41%	0.412	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.8	172.5	-57.2	0	0	0	0	110.1	M1 K70	M1-C18 PolarHBondContact N-O 3.06Å; M1-C18 VanDerWaalsContact N-O 3.08Å; M1-C18 PolarHBondContact O-N 3.25Å; C18-K70 WeakPolarHBondContact CA-O 2.66Å
19	F	80	Confident	73.2	Confident	15 Å²	15	63 Å²	63	7%	0.066	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	144.9	175.5	-57.6	-97.6	0	0	0	109.7	Q17 L24 G26 G69 K70 L72	Q17-F19 HydrophobicContact CB-CE2 3.71Å; Q17-F19 HydrophobicContact CB-CZ 4.11Å; F19-L24 WeakPolarHBondContact CD1-O 3.4Å; F19-L24 WeakPolarHBondContact CE1-O 3.46Å; F19-G26 WeakPolarHBondContact CE1-O 3.38Å; F19-G69 WeakPolarHBondContact O-CA 3.14Å; F19-K70 HydrophobicContact CB-CB 4.25Å; F19-K70 HydrophobicContact CD2-CB 4.48Å; F19-K70 PolarHBondContact N-O 2.8Å; F19-K70 PolarHBondContact O-N 2.85Å; F19-L72 HydrophobicContact CD2-CB 4.46Å; F19-L72 HydrophobicContact CE2-CB 3.64Å; F19-L72 HydrophobicContact CE2-CD2 4.22Å; F19-L72 HydrophobicContact CZ-CB 4.49Å; F19-L72 HydrophobicContact CZ-CD2 4.31Å
20	D	77.8	Confident	72.2	Confident	81 Å²	81	63.6 Å²	63.6	43%	0.433	36%	0.356	S	S	.	.			trans	-73.1	176.5	169.9	70.9	59.4	0	0	0	111.3	N22 T23 K70	D20-N22 VanDerWaalsContact C-N 3.32Å; D20-N22 PolarHBondContact O-N 2.84Å; D20-N22 WeakPolarHBondContact OD1-CA 3.27Å; D20-N22 PolarHBondContact OD1-N 2.99Å; D20-T23 PolarHBondContact OD1-N 2.78Å; D20-T23 PolarHBondContact OD1-OG1 3.49Å; D20-T23 WeakPolarHBondContact OD2-CG2 3.44Å; D20-T23 PolarHBondContact OD2-OG1 2.86Å; D20-K70 PolarHBondContact O-NZ 3.22Å
21	C	72.7	Confident	70.9	Confident	44 Å²	44	63 Å²	63	30%	0.297	35%	0.347	S	S	.	.	S	Bend	trans	-58.7	-43.6	178.9	-67.5	0	0	0	0	114.1	C68 K70	C21-C68 HydrophobicContact CB-CB 4.27Å; C21-C68 WeakPolarHBondContact CB-SG 3.04Å; C21-C68 WeakPolarHBondContact SG-CA 3.37Å; C21-C68 WeakPolarHBondContact SG-CB 3.12Å; C21-C68 PolarHBondContact SG-O 3.18Å; C21-C68 CovalentContact SG-SG 2Å; C21-C68 PolarHBondContact SG-SG 2.85Å; C21-K70 PolarHBondContact O-NZ 2Å
22	N	68.9	Low	70	Confident	154 Å²	154	61.6 Å²	61.6	82%	0.824	34%	0.339	S	S	*	.	S	Bend	trans	-97.5	-16.4	-158.4	-61	-27.1	0	0	0	110.9	D20	D20-N22 VanDerWaalsContact C-N 3.32Å; D20-N22 PolarHBondContact O-N 2.84Å; D20-N22 WeakPolarHBondContact OD1-CA 3.27Å; D20-N22 PolarHBondContact OD1-N 2.99Å
23	T	61.7	Low	69.1	Low	37 Å²	37	67.6 Å²	67.6	23%	0.227	37%	0.371	C	S	.	.			trans	-110	131.8	176.4	67.9	0	0	0	0	110.3	D20 D25	D20-T23 PolarHBondContact OD1-N 2.78Å; D20-T23 PolarHBondContact OD1-OG1 3.49Å; D20-T23 WeakPolarHBondContact OD2-CG2 3.44Å; D20-T23 PolarHBondContact OD2-OG1 2.86Å; T23-D25 VanDerWaalsContact C-N 3.27Å
24	L	59.1	Low	67.9	Low	107 Å²	107	72.5 Å²	72.5	56%	0.56	40%	0.397	S	S	*	.	S	Bend	trans	-86.7	-11.8	144.1	-96.6	140.8	0	0	0	110.2	F19 G26 F28	F19-L24 WeakPolarHBondContact CD1-O 3.4Å; F19-L24 WeakPolarHBondContact CE1-O 3.46Å; L24-G26 PolarHBondContact O-N 2.83Å; L24-F28 WeakPolarHBondContact O-CE2 3.48Å
25	D	53.3	Low	66.6	Low	131 Å²	131	72.9 Å²	72.9	70%	0.701	41%	0.41	S	S	*	.			trans	-78.6	30.3	-179.9	-55.7	-29.9	0	0	0	113.6	T23 N27	T23-D25 VanDerWaalsContact C-N 3.27Å; D25-N27 PolarHBondContact O-N 3.08Å; D25-N27 VanDerWaalsContact O-N 3.07Å
26	G	52.6	Low	65.5	Low	18 Å²	18	74.2 Å²	74.2	19%	0.186	42%	0.416	C	S	.	.	S	Bend	trans	-61.8	117.9	162.6	0	0	0	0	0	105.9	F19 L24 F28	F19-G26 WeakPolarHBondContact CE1-O 3.38Å; L24-G26 PolarHBondContact O-N 2.83Å; G26-F28 PolarHBondContact O-N 2.83Å
27	N	54.4	Low	64.8	Low	151 Å²	151	73.7 Å²	73.7	81%	0.807	41%	0.412	S	S	*	.			trans	-29.4	98.8	-178.9	-71.2	-33.1	0	0	0	110.2	D25 L29	D25-N27 PolarHBondContact O-N 3.08Å; D25-N27 VanDerWaalsContact O-N 3.07Å; N27-L29 PolarHBondContact O-N 2.96Å
28	F	58.6	Low	63.9	Low	129 Å²	129	74.8 Å²	74.8	57%	0.566	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-55.1	139.1	175.6	-75.7	-87.3	0	0	0	105.1	L24 G26 P30	L24-F28 WeakPolarHBondContact O-CE2 3.48Å; G26-F28 PolarHBondContact O-N 2.83Å; F28-P30 VanDerWaalsContact O-N 3.13Å
29	L	60.1	Low	63.3	Low	16 Å²	16	74.8 Å²	74.8	8%	0.084	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-51.7	130.9	175.2	-90	162	0	0	0	106.9	T2 I15 N27 L31 F37 I39	T2-L29 HydrophobicContact CG2-CD1 4.19Å; T2-L29 HydrophobicContact CG2-CD2 3.98Å; T2-L29 HydrophobicContact CG2-CG 4.11Å; I15-L29 HydrophobicContact CD1-CD1 3.6Å; I15-L29 HydrophobicContact CG2-CD1 3.61Å; N27-L29 PolarHBondContact O-N 2.96Å; L29-L31 PolarHBondContact O-N 2.79Å; L29-F37 HydrophobicContact CB-CD1 3.36Å; L29-F37 HydrophobicContact CB-CE1 3.93Å; L29-F37 HydrophobicContact CB-CG 4.41Å; L29-F37 HydrophobicContact CD1-CB 4.22Å; L29-F37 HydrophobicContact CD1-CD1 3.33Å; L29-F37 HydrophobicContact CD1-CE1 3.83Å; L29-F37 HydrophobicContact CD1-CG 3.96Å; L29-F37 HydrophobicContact CG-CD1 3.96Å; L29-I39 HydrophobicContact CD1-CG2 4.18Å; L29-I39 HydrophobicContact CD2-CB 3.93Å; L29-I39 HydrophobicContact CD2-CG2 3.63Å
30	P	60.7	Low	62.5	Low	87 Å²	87	74.2 Å²	74.2	57%	0.565	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-57	117.6	176.4	17	-23.8	0	0	0	106.6	F28 A38	F28-P30 VanDerWaalsContact O-N 3.13Å; P30-A38 HydrophobicContact CB-CB 4.29Å; P30-A38 HydrophobicContact CG-CB 4.02Å; P30-A38 VanDerWaalsContact O-CB 3.3Å; P30-A38 WeakPolarHBondContact O-CB 3.45Å; P30-A38 PolarHBondContact O-N 3.47Å
31	L	55.3	Low	61.3	Low	98 Å²	98	73.5 Å²	73.5	51%	0.513	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-76.1	136.1	163.5	-60.9	-179.5	0	0	0	106	L29 E36 F37	L29-L31 PolarHBondContact O-N 2.79Å; L31-E36 CarbonylContact C-O 3.55Å; L31-E36 WeakPolarHBondContact CA-O 3.44Å; L31-F37 HydrophobicContact CD2-CD1 3.67Å; L31-F37 HydrophobicContact CD2-CE1 3.83Å; L31-F37 HydrophobicContact CD2-CG 4.15Å; L31-F37 HydrophobicContact CD2-CZ 4.27Å
32	D	64.7	Low	60.6	Low	32 Å²	32	80.5 Å²	80.5	17%	0.171	43%	0.434	C	S	.	.			trans	-72.1	-178.4	168.6	86.6	-44.2	0	0	0	110.2	N34 G35 E36 Q41	D32-N34 VanDerWaalsContact CG-N 3.27Å; D32-N34 PolarHBondContact O-N 2.85Å; D32-N34 VanDerWaalsContact O-N 3.08Å; D32-N34 WeakPolarHBondContact OD1-CA 3.25Å; D32-N34 WeakPolarHBondContact OD1-CB 3.42Å; D32-N34 PolarHBondContact OD1-N 2.88Å; D32-N34 VanDerWaalsContact OD2-CB 3.32Å; D32-N34 WeakPolarHBondContact OD2-CB 3.47Å; D32-N34 PolarHBondContact OD2-N 2.98Å; D32-N34 PolarHBondContact OD2-ND2 2.87Å; D32-N34 VanDerWaalsContact OD2-ND2 3.11Å; D32-G35 PolarHBondContact O-N 2.87Å; D32-G35 PolarHBondContact OD1-N 2.82Å; D32-G35 VanDerWaalsContact OD1-N 3.12Å; D32-E36 PolarHBondContact N-O 2.71Å; D32-E36 WeakPolarHBondContact OD1-CA 3.36Å; D32-E36 WeakPolarHBondContact OD1-CB 3.31Å; D32-E36 PolarHBondContact OD1-N 3.48Å; D32-Q41 VanDerWaalsContact CG-OE1 3.25Å; D32-Q41 PolarHBondContact OD1-NE2 3.34Å; D32-Q41 VanDerWaalsContact OD2-CD 3.27Å; D32-Q41 PolarHBondContact OD2-NE2 2.76Å; D32-Q41 PolarHBondContact OD2-OE1 2.7Å
33	N	68.3	Low	59.9	Low	171 Å²	171	81.8 Å²	81.8	91%	0.914	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.5	179.3	-63.7	-28.2	0	0	0	113.4
34	N	60.5	Low	59.4	Low	109 Å²	109	85.1 Å²	85.1	58%	0.583	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	1.2	176.8	-57.3	-35.2	0	0	0	113.2	D32 E36	D32-N34 VanDerWaalsContact CG-N 3.27Å; D32-N34 PolarHBondContact O-N 2.85Å; D32-N34 VanDerWaalsContact O-N 3.08Å; D32-N34 WeakPolarHBondContact OD1-CA 3.25Å; D32-N34 WeakPolarHBondContact OD1-CB 3.42Å; D32-N34 PolarHBondContact OD1-N 2.88Å; D32-N34 VanDerWaalsContact OD2-CB 3.32Å; D32-N34 WeakPolarHBondContact OD2-CB 3.47Å; D32-N34 PolarHBondContact OD2-N 2.98Å; D32-N34 PolarHBondContact OD2-ND2 2.87Å; D32-N34 VanDerWaalsContact OD2-ND2 3.11Å; N34-E36 HydrophobicContact CB-CG 4.44Å
35	G	59.9	Low	59.1	Low	45 Å²	45	90.2 Å²	90.2	46%	0.464	46%	0.461	S	S	.	.	S	Bend	trans	78.5	17.1	-177.8	0	0	0	0	0	114.1	D32	D32-G35 PolarHBondContact O-N 2.87Å; D32-G35 PolarHBondContact OD1-N 2.82Å; D32-G35 VanDerWaalsContact OD1-N 3.12Å
36	E	63.3	Low	59.5	Low	27 Å²	27	88.4 Å²	88.4	13%	0.126	46%	0.459	C	S	.	.			trans	-98.5	147.8	178.6	-62.3	176.4	-176.1	0	0	112	L31 D32 N34 A38 Q41 R48	L31-E36 CarbonylContact C-O 3.55Å; L31-E36 WeakPolarHBondContact CA-O 3.44Å; D32-E36 PolarHBondContact N-O 2.71Å; D32-E36 WeakPolarHBondContact OD1-CA 3.36Å; D32-E36 WeakPolarHBondContact OD1-CB 3.31Å; D32-E36 PolarHBondContact OD1-N 3.48Å; N34-E36 HydrophobicContact CB-CG 4.44Å; E36-A38 PolarHBondContact O-N 2.78Å; E36-A38 VanDerWaalsContact O-N 3.13Å; E36-Q41 HydrophobicContact CB-CG 4.08Å; E36-Q41 WeakPolarHBondContact OE2-CG 3.08Å; E36-Q41 PolarHBondContact OE2-NE2 2.71Å; E36-R48 WeakPolarHBondContact OE1-CD 3.32Å; E36-R48 WeakPolarHBondContact OE1-CG 3.44Å; E36-R48 IonicContact OE1-CZ 3.47Å; E36-R48 IonicContact OE1-NE 2.68Å; E36-R48 PolarHBondContact OE1-NE 3.31Å; E36-R48 IonicContact OE1-NH2 3.75Å
37	F	69.9	Low	60.2	Low	30 Å²	30	89.4 Å²	89.4	13%	0.132	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-63.4	117.5	175.4	-60.8	-75.3	0	0	0	110.7	I15 L29 L31 I39 L40 Q41 F74 Y76	I15-F37 HydrophobicContact CD1-CB 4.37Å; I15-F37 HydrophobicContact CD1-CG 4.26Å; L29-F37 HydrophobicContact CB-CD1 3.36Å; L29-F37 HydrophobicContact CB-CE1 3.93Å; L29-F37 HydrophobicContact CB-CG 4.41Å; L29-F37 HydrophobicContact CD1-CB 4.22Å; L29-F37 HydrophobicContact CD1-CD1 3.33Å; L29-F37 HydrophobicContact CD1-CE1 3.83Å; L29-F37 HydrophobicContact CD1-CG 3.96Å; L29-F37 HydrophobicContact CG-CD1 3.96Å; L31-F37 HydrophobicContact CD2-CD1 3.67Å; L31-F37 HydrophobicContact CD2-CE1 3.83Å; L31-F37 HydrophobicContact CD2-CG 4.15Å; L31-F37 HydrophobicContact CD2-CZ 4.27Å; F37-I39 HydrophobicContact CB-CG2 4.15Å; F37-I39 PolarHBondContact O-N 3.2Å; F37-L40 HydrophobicContact CB-CB 4.43Å; F37-L40 HydrophobicContact CB-CD1 3.77Å; F37-L40 HydrophobicContact CB-CG 3.85Å; F37-L40 HydrophobicContact CD2-CD1 3.83Å; F37-L40 HydrophobicContact CG-CD1 4.19Å; F37-L40 WeakPolarHBondContact O-CA 3.4Å; F37-L40 WeakPolarHBondContact O-CB 3.14Å; F37-L40 PolarHBondContact O-N 3.47Å; F37-Q41 PolarHBondContact O-N 2.85Å; F37-F74 HydrophobicContact CE1-CZ 4.24Å; F37-F74 HydrophobicContact CZ-CD1 4.13Å; F37-F74 AromaticContact CZ-CE1 3.79Å; F37-F74 HydrophobicContact CZ-CE1 3.79Å; F37-F74 HydrophobicContact CZ-CE2 4.47Å; F37-F74 AromaticContact CZ-CZ 3.96Å; F37-F74 HydrophobicContact CZ-CZ 3.96Å; F37-Y76 AromaticContact CD2-CE1 3.54Å; F37-Y76 HydrophobicContact CD2-CE1 3.54Å; F37-Y76 AromaticContact CD2-CZ 3.49Å; F37-Y76 VanDerWaalsContact CD2-CZ 3.49Å; F37-Y76 WeakPolarHBondContact CD2-OH 3.37Å; F37-Y76 AromaticContact CE2-CE1 3.5Å; F37-Y76 HydrophobicContact CE2-CE1 3.5Å; F37-Y76 VanDerWaalsContact CE2-CE1 3.5Å; F37-Y76 AromaticContact CE2-CZ 3.4Å; F37-Y76 VanDerWaalsContact CE2-CZ 3.4Å; F37-Y76 WeakPolarHBondContact CE2-OH 3.43Å; F37-Y76 WeakPolarHBondContact CZ-OH 3.16Å
38	A	63.6	Low	61.1	Low	28 Å²	28	89.6 Å²	89.6	23%	0.231	45%	0.45	C	S	.	.	H	α-helix	trans	-58.8	-24.4	-177.7	0	0	0	0	0	113.6	P30 E36 L40 Q41 K42	P30-A38 HydrophobicContact CB-CB 4.29Å; P30-A38 HydrophobicContact CG-CB 4.02Å; P30-A38 VanDerWaalsContact O-CB 3.3Å; P30-A38 WeakPolarHBondContact O-CB 3.45Å; P30-A38 PolarHBondContact O-N 3.47Å; E36-A38 PolarHBondContact O-N 2.78Å; E36-A38 VanDerWaalsContact O-N 3.13Å; A38-L40 PolarHBondContact O-N 2.84Å; A38-Q41 PolarHBondContact O-N 2.83Å; A38-K42 PolarHBondContact O-N 3.48Å
39	I	64.3	Low	62	Low	60 Å²	60	84.1 Å²	84.1	31%	0.308	43%	0.427	S	S	.	.	H	α-helix	trans	-64.9	-29.1	172.3	-163.3	170.2	0	0	0	112.5	L4 I15 L29 F37	L4-I39 HydrophobicContact CB-CD1 4.39Å; I15-I39 HydrophobicContact CD1-CG2 3.86Å; L29-I39 HydrophobicContact CD1-CG2 4.18Å; L29-I39 HydrophobicContact CD2-CB 3.93Å; L29-I39 HydrophobicContact CD2-CG2 3.63Å; F37-I39 HydrophobicContact CB-CG2 4.15Å; F37-I39 PolarHBondContact O-N 3.2Å
40	L	62	Low	63	Low	3 Å²	3	87 Å²	87	2%	0.016	45%	0.445	C	S	.	.	H	α-helix	trans	-83.6	-32.6	177.4	-55.6	176	0	0	0	111.1	L4 I15 F37 A38 P49 Y76 Y78	L4-L40 HydrophobicContact CD1-CD2 4.21Å; I15-L40 HydrophobicContact CD1-CD1 4.11Å; I15-L40 HydrophobicContact CD1-CD2 3.98Å; I15-L40 HydrophobicContact CD1-CG 4.09Å; I15-L40 HydrophobicContact CG1-CD2 4.42Å; F37-L40 HydrophobicContact CB-CB 4.43Å; F37-L40 HydrophobicContact CB-CD1 3.77Å; F37-L40 HydrophobicContact CB-CG 3.85Å; F37-L40 HydrophobicContact CD2-CD1 3.83Å; F37-L40 HydrophobicContact CG-CD1 4.19Å; F37-L40 WeakPolarHBondContact O-CA 3.4Å; F37-L40 WeakPolarHBondContact O-CB 3.14Å; F37-L40 PolarHBondContact O-N 3.47Å; A38-L40 PolarHBondContact O-N 2.84Å; L40-P49 HydrophobicContact CB-CB 4.13Å; L40-P49 HydrophobicContact CB-CG 3.68Å; L40-P49 HydrophobicContact CD1-CB 3.56Å; L40-P49 HydrophobicContact CD1-CG 3.64Å; L40-P49 HydrophobicContact CG-CB 4.36Å; L40-P49 HydrophobicContact CG-CG 4.28Å; L40-Y76 HydrophobicContact CD1-CD1 3.81Å; L40-Y76 HydrophobicContact CD1-CD2 4.14Å; L40-Y76 HydrophobicContact CD1-CE1 3.84Å; L40-Y76 HydrophobicContact CD1-CE2 4.15Å; L40-Y76 HydrophobicContact CD1-CG 3.99Å; L40-Y78 WeakPolarHBondContact CB-OH 3.09Å; L40-Y78 WeakPolarHBondContact CD2-OH 3.47Å
41	Q	54.4	Low	64.2	Low	66 Å²	66	86.5 Å²	86.5	31%	0.308	44%	0.437	S	S	.	.	H	α-helix	trans	-71.1	-34.8	-179.7	-65.6	-157.2	-36.4	0	0	115.2	D32 E36 F37 A38 R43	D32-Q41 VanDerWaalsContact CG-OE1 3.25Å; D32-Q41 PolarHBondContact OD1-NE2 3.34Å; D32-Q41 VanDerWaalsContact OD2-CD 3.27Å; D32-Q41 PolarHBondContact OD2-NE2 2.76Å; D32-Q41 PolarHBondContact OD2-OE1 2.7Å; E36-Q41 HydrophobicContact CB-CG 4.08Å; E36-Q41 WeakPolarHBondContact OE2-CG 3.08Å; E36-Q41 PolarHBondContact OE2-NE2 2.71Å; F37-Q41 PolarHBondContact O-N 2.85Å; A38-Q41 PolarHBondContact O-N 2.83Å; Q41-R43 PolarHBondContact O-N 3.03Å
42	K	57	Low	65.5	Low	191 Å²	191	86.4 Å²	86.4	83%	0.83	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-10.1	-179.4	-83.2	-169.6	177.1	-175.8	0	114	A38	A38-K42 PolarHBondContact O-N 3.48Å
43	R	54.2	Low	66.5	Low	182 Å²	182	87.3 Å²	87.3	69%	0.687	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-19.3	-166	-74.4	-161.1	169.3	-166.3	-2.5	117.7	Q41	Q41-R43 PolarHBondContact O-N 3.03Å
44	Q	51	Low	67.5	Low	106 Å²	106	85.4 Å²	85.4	50%	0.495	43%	0.429	S	S	.	.			trans	-148.8	118.1	175.1	-69.7	-168.3	-20.9	0	0	111.5	S46	Q44-S46 PolarHBondContact O-N 2.84Å
45	Q	53.4	Low	68.8	Low	214 Å²	214	86 Å²	86	100%	1	43%	0.428	S	S	*	.	S	Bend	trans	-73.7	-3.2	-179.1	-76.2	178.8	-24.3	0	0	113.9
46	S	60.5	Low	70	Confident	94 Å²	94	88.2 Å²	88.2	66%	0.657	43%	0.429	S	S	*	.	S	Bend	trans	-121.2	-21.1	-174.1	59.6	0	0	0	0	115.7	Q44	Q44-S46 PolarHBondContact O-N 2.84Å
47	N	67.5	Low	71.1	Confident	39 Å²	39	89.5 Å²	89.5	21%	0.209	44%	0.437	C	S	.	.			trans	-124	106.9	-168.9	-60.9	29.8	0	0	0	110.3	Y78 S80	N47-Y78 HydrophobicContact CB-CD1 4.49Å; N47-S80 WeakPolarHBondContact CA-OXT 3.45Å; N47-S80 WeakPolarHBondContact CB-OXT 3.43Å; N47-S80 PolarHBondContact ND2-OXT 2.96Å; N47-S80 PolarHBondContact OD1-OXT 3.21Å
48	R	73.1	Confident	71.9	Confident	155 Å²	155	93.4 Å²	93.4	59%	0.585	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-66.1	127.2	177.2	175.6	169.9	-163.5	-172.1	6.2	109.5	E36 V50	E36-R48 WeakPolarHBondContact OE1-CD 3.32Å; E36-R48 WeakPolarHBondContact OE1-CG 3.44Å; E36-R48 IonicContact OE1-CZ 3.47Å; E36-R48 IonicContact OE1-NE 2.68Å; E36-R48 PolarHBondContact OE1-NE 3.31Å; E36-R48 IonicContact OE1-NH2 3.75Å; R48-V50 PolarHBondContact O-N 2.89Å
49	P	77.5	Confident	72.8	Confident	14 Å²	14	93.8 Å²	93.8	9%	0.091	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-65.5	128.6	172.2	29	-36.8	0	0	0	110.5	L40 Y76 S77 Y78	L40-P49 HydrophobicContact CB-CB 4.13Å; L40-P49 HydrophobicContact CB-CG 3.68Å; L40-P49 HydrophobicContact CD1-CB 3.56Å; L40-P49 HydrophobicContact CD1-CG 3.64Å; L40-P49 HydrophobicContact CG-CB 4.36Å; L40-P49 HydrophobicContact CG-CG 4.28Å; P49-Y76 HydrophobicContact CB-CD1 4.28Å; P49-S77 WeakPolarHBondContact CA-O 3.48Å; P49-Y78 HydrophobicContact CB-CD1 4.28Å; P49-Y78 HydrophobicContact CB-CE1 3.79Å; P49-Y78 HydrophobicContact CG-CE1 4.4Å
50	V	82.1	Confident	73.6	Confident	76 Å²	76	94.3 Å²	94.3	46%	0.461	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.3	171.7	-179.8	0	0	0	0	108.8	R48 L52 Y76 S77	R48-V50 PolarHBondContact O-N 2.89Å; V50-L52 HydrophobicContact CG1-CD2 4.46Å; V50-L52 PolarHBondContact O-N 3.02Å; V50-Y76 CarbonylContact O-C 3.5Å; V50-Y76 WeakPolarHBondContact O-CA 3.3Å; V50-Y76 WeakPolarHBondContact O-CB 3.09Å; V50-S77 PolarHBondContact N-O 3.2Å; V50-S77 PolarHBondContact O-N 3.06Å
51	L	84.9	Confident	74.4	Confident	76 Å²	76	102.3 Å²	102.3	40%	0.398	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	113.4	171.1	179.4	67	0	0	0	109	S53 F54 F74 Y76	L51-S53 WeakPolarHBondContact CD1-O 3.37Å; L51-F54 HydrophobicContact CD2-CD1 4.37Å; L51-F74 HydrophobicContact CD1-CB 3.93Å; L51-F74 HydrophobicContact CD1-CD1 3.78Å; L51-F74 HydrophobicContact CD1-CG 4.37Å; L51-F74 HydrophobicContact CD2-CD1 4.48Å; L51-Y76 HydrophobicContact CB-CD1 3.93Å; L51-Y76 HydrophobicContact CB-CE1 3.75Å; L51-Y76 HydrophobicContact CD1-CD1 3.99Å; L51-Y76 HydrophobicContact CD1-CE1 3.45Å; L51-Y76 VanDerWaalsContact CD1-CE1 3.45Å; L51-Y76 HydrophobicContact CD1-CE2 4.3Å; L51-Y76 HydrophobicContact CG-CE1 4.17Å
52	L	84	Confident	75.3	Confident	96 Å²	96	103.3 Å²	103.3	50%	0.503	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-42.8	176.9	-64	-177.8	0	0	0	111.6	L12 V50 I75	L12-L52 HydrophobicContact CD2-CD1 3.78Å; V50-L52 HydrophobicContact CG1-CD2 4.46Å; V50-L52 PolarHBondContact O-N 3.02Å; L52-I75 HydrophobicContact CD1-CG2 4.37Å; L52-I75 PolarHBondContact N-O 2.76Å
53	S	86.1	Confident	76.1	Confident	51 Å²	51	104.8 Å²	104.8	36%	0.357	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	160.9	178.8	63.3	0	0	0	0	111.7	L51 I75	L51-S53 WeakPolarHBondContact CD1-O 3.37Å; S53-I75 PolarHBondContact N-O 3.28Å; S53-I75 PolarHBondContact O-N 3.39Å
54	F	88	Confident	76.6	Confident	131 Å²	131	99.8 Å²	99.8	58%	0.575	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.3	168.4	73.1	-86.9	0	0	0	110.9	L51 L72 L73 F74	L51-F54 HydrophobicContact CD2-CD1 4.37Å; F54-L72 HydrophobicContact CD2-CD1 3.97Å; F54-L73 CarbonylContact C-O 3.58Å; F54-L73 WeakPolarHBondContact CA-O 3.41Å; F54-L73 WeakPolarHBondContact CB-O 3.33Å; F54-F74 HydrophobicContact CB-CD1 3.63Å; F54-F74 HydrophobicContact CB-CE1 4.13Å; F54-F74 HydrophobicContact CB-CG 4.29Å
55	Q	87.5	Confident	77.1	Confident	121 Å²	121	103.3 Å²	103.3	57%	0.565	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.6	131.2	176.2	-67.6	-172.1	-2.2	0	0	111	L72 L73	Q55-L72 WeakPolarHBondContact O-CA 3.38Å; Q55-L73 PolarHBondContact N-O 3.41Å; Q55-L73 PolarHBondContact O-N 2.78Å
56	L	86.6	Confident	78.1	Confident	92 Å²	92	100.7 Å²	100.7	48%	0.482	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.1	172.1	-175.3	68.3	0	0	0	110.3	K70 I71 L72	L56-K70 HydrophobicContact CD1-CB 3.95Å; L56-I71 CarbonylContact C-O 3.55Å; L56-I71 WeakPolarHBondContact CA-O 3.41Å; L56-L72 HydrophobicContact CB-CD1 4.14Å; L56-L72 HydrophobicContact CD1-CB 4.13Å; L56-L72 HydrophobicContact CD1-CD1 4.2Å
57	I	85.9	Confident	78.5	Confident	55 Å²	55	101.5 Å²	101.5	28%	0.282	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.7	179.9	-56.2	171.2	0	0	0	108.5	L59 K70 I71 L73	I57-L59 PolarHBondContact O-N 3.44Å; I57-K70 CarbonylContact O-C 3.57Å; I57-K70 VanDerWaalsContact O-CA 3.27Å; I57-K70 WeakPolarHBondContact O-CA 3.08Å; I57-I71 HydrophobicContact CB-CB 4.41Å; I57-I71 PolarHBondContact N-O 3Å; I57-I71 PolarHBondContact O-N 2.68Å; I57-L73 HydrophobicContact CD1-CD1 3.89Å
58	K	85.4	Confident	78.9	Confident	112 Å²	112	103.5 Å²	103.5	49%	0.487	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	123.5	166.3	-68.8	-173.7	180	-177.5	0	108.8	S60 K61	K58-S60 PolarHBondContact O-N 2.92Å; K58-K61 HydrophobicContact CB-CG 4.35Å; K58-K61 WeakPolarHBondContact O-CB 3.49Å; K58-K61 PolarHBondContact O-N 3.28Å
59	L	83.1	Confident	79.4	Confident	35 Å²	35	96.4 Å²	96.4	18%	0.183	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-64.4	-24.6	179.5	-65.6	-178.4	0	0	0	112.6	I57 K61 L62 F67 G69 I71	I57-L59 PolarHBondContact O-N 3.44Å; L59-K61 PolarHBondContact O-N 3.24Å; L59-K61 VanDerWaalsContact O-N 3.09Å; L59-L62 HydrophobicContact CD2-CD1 3.6Å; L59-L62 VanDerWaalsContact O-CB 3.28Å; L59-L62 WeakPolarHBondContact O-CB 3.35Å; L59-L62 WeakPolarHBondContact O-CG 3.4Å; L59-L62 PolarHBondContact O-N 3.3Å; L59-F67 CarbonylContact C-O 3.26Å; L59-F67 VanDerWaalsContact C-O 3.26Å; L59-F67 HydrophobicContact CB-CB 4Å; L59-G69 WeakPolarHBondContact CB-O 3.42Å; L59-G69 PolarHBondContact N-O 3.02Å; L59-I71 HydrophobicContact CD2-CD1 3.64Å; L59-I71 HydrophobicContact CD2-CG1 3.84Å; L59-I71 HydrophobicContact CG-CG1 4.48Å
60	S	81	Confident	79.7	Confident	72 Å²	72	97.3 Å²	97.3	50%	0.503	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-63.1	-14.2	173.7	60.8	0	0	0	0	114	K58 F67	K58-S60 PolarHBondContact O-N 2.92Å; S60-F67 WeakPolarHBondContact CA-O 3.26Å; S60-F67 PolarHBondContact N-O 3.13Å
61	K	79	Confident	79.9	Confident	171 Å²	171	95.6 Å²	95.6	74%	0.743	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-81.6	-15.9	171.5	-66.8	-174.1	174	-174.2	0	113.1	K58 L59	K58-K61 HydrophobicContact CB-CG 4.35Å; K58-K61 WeakPolarHBondContact O-CB 3.49Å; K58-K61 PolarHBondContact O-N 3.28Å; L59-K61 PolarHBondContact O-N 3.24Å; L59-K61 VanDerWaalsContact O-N 3.09Å
62	L	74.1	Confident	80	Confident	87 Å²	87	93 Å²	93	46%	0.455	46%	0.461	S	S	.	.	S	Bend	trans	-72.1	141.3	174.3	-57.2	177.8	0	0	0	107.8	L59 N64	L59-L62 HydrophobicContact CD2-CD1 3.6Å; L59-L62 VanDerWaalsContact O-CB 3.28Å; L59-L62 WeakPolarHBondContact O-CB 3.35Å; L59-L62 WeakPolarHBondContact O-CG 3.4Å; L59-L62 PolarHBondContact O-N 3.3Å; L62-N64 CarbonylContact O-C 3.53Å; L62-N64 PolarHBondContact O-N 3.02Å
63	K	73.3	Confident	80.2	Confident	222 Å²	222	90.3 Å²	90.3	97%	0.965	45%	0.448	S	S	*	.	S	Bend	trans	-52.8	-11	-171.3	-70.9	-173.7	175.8	-177.8	0	115.5
64	N	64.2	Low	80.2	Confident	76 Å²	76	89 Å²	89	41%	0.406	44%	0.435	S	S	.	.			trans	-105	96.7	177	-163.6	-21	0	0	0	110.1	L62 M66 F67	L62-N64 CarbonylContact O-C 3.53Å; L62-N64 PolarHBondContact O-N 3.02Å; N64-M66 PolarHBondContact O-N 2.72Å; N64-F67 HydrophobicContact CB-CD2 4.04Å; N64-F67 HydrophobicContact CB-CE2 4.11Å; N64-F67 PolarHBondContact O-N 3.37Å
65	Q	61	Low	80.2	Confident	180 Å²	180	85.5 Å²	85.5	84%	0.841	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-8.8	-175.2	-64.9	-176.1	2.2	0	0	114.3	F67	Q65-F67 PolarHBondContact O-N 3.07Å
66	M	75.1	Confident	80.1	Confident	159 Å²	159	79.9 Å²	79.9	78%	0.783	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-17.7	175.4	-64.5	-163.4	-67.2	0	0	113.3	N64 C68	N64-M66 PolarHBondContact O-N 2.72Å; M66-C68 PolarHBondContact O-N 2.93Å
67	F	69.3	Low	80	Confident	112 Å²	112	76 Å²	76	49%	0.491	38%	0.377	S	S	.	.			trans	-92.4	108	178.6	-61.9	-67.7	0	0	0	111.2	L59 S60 N64 Q65	L59-F67 CarbonylContact C-O 3.26Å; L59-F67 VanDerWaalsContact C-O 3.26Å; L59-F67 HydrophobicContact CB-CB 4Å; S60-F67 WeakPolarHBondContact CA-O 3.26Å; S60-F67 PolarHBondContact N-O 3.13Å; N64-F67 HydrophobicContact CB-CD2 4.04Å; N64-F67 HydrophobicContact CB-CE2 4.11Å; N64-F67 PolarHBondContact O-N 3.37Å; Q65-F67 PolarHBondContact O-N 3.07Å
68	C	76.6	Confident	79.7	Confident	80 Å²	80	74.8 Å²	74.8	54%	0.541	37%	0.369	S	S	.	.			trans	-106	134.1	165.3	166.1	0	0	0	0	108.6	C21 M66	C21-C68 HydrophobicContact CB-CB 4.27Å; C21-C68 WeakPolarHBondContact CB-SG 3.04Å; C21-C68 WeakPolarHBondContact SG-CA 3.37Å; C21-C68 WeakPolarHBondContact SG-CB 3.12Å; C21-C68 PolarHBondContact SG-O 3.18Å; C21-C68 CovalentContact SG-SG 2Å; C21-C68 PolarHBondContact SG-SG 2.85Å; M66-C68 PolarHBondContact O-N 2.93Å
69	G	83.3	Confident	79.2	Confident	7 Å²	7	73.6 Å²	73.6	7%	0.072	37%	0.368	C	S	.	.			trans	153.1	176.8	-172.3	0	0	0	0	0	110.9	F19 L59	F19-G69 WeakPolarHBondContact O-CA 3.14Å; L59-G69 WeakPolarHBondContact CB-O 3.42Å; L59-G69 PolarHBondContact N-O 3.02Å
70	K	84.1	Confident	78.1	Confident	32 Å²	32	78.4 Å²	78.4	14%	0.139	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	141.1	-179.5	-47.5	173	-162	73.9	0	109.7	C18 F19 D20 C21 L56 I57	C18-K70 WeakPolarHBondContact CA-O 2.66Å; F19-K70 HydrophobicContact CB-CB 4.25Å; F19-K70 HydrophobicContact CD2-CB 4.48Å; F19-K70 PolarHBondContact N-O 2.8Å; F19-K70 PolarHBondContact O-N 2.85Å; D20-K70 PolarHBondContact O-NZ 3.22Å; C21-K70 PolarHBondContact O-NZ 2Å; L56-K70 HydrophobicContact CD1-CB 3.95Å; I57-K70 CarbonylContact O-C 3.57Å; I57-K70 VanDerWaalsContact O-CA 3.27Å; I57-K70 WeakPolarHBondContact O-CA 3.08Å
71	I	85.5	Confident	77.9	Confident	41 Å²	41	78.7 Å²	78.7	21%	0.21	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.3	168.2	-61.4	173.2	0	0	0	107.4	I16 Q17 L56 I57 L59 L73	I16-I71 HydrophobicContact CG2-CG2 3.74Å; Q17-I71 CarbonylContact O-C 3.45Å; Q17-I71 WeakPolarHBondContact O-CA 3.07Å; L56-I71 CarbonylContact C-O 3.55Å; L56-I71 WeakPolarHBondContact CA-O 3.41Å; I57-I71 HydrophobicContact CB-CB 4.41Å; I57-I71 PolarHBondContact N-O 3Å; I57-I71 PolarHBondContact O-N 2.68Å; L59-I71 HydrophobicContact CD2-CD1 3.64Å; L59-I71 HydrophobicContact CD2-CG1 3.84Å; L59-I71 HydrophobicContact CG-CG1 4.48Å; I71-L73 HydrophobicContact CG2-CD2 3.69Å; I71-L73 HydrophobicContact CG2-CG 3.98Å
72	L	86.3	Confident	77.9	Confident	20 Å²	20	73.8 Å²	73.8	11%	0.105	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	119	165.5	-173.3	56.6	0	0	0	108.4	Q17 F19 F54 Q55 L56 F74	Q17-L72 HydrophobicContact CB-CB 4.26Å; Q17-L72 PolarHBondContact N-O 3.08Å; Q17-L72 PolarHBondContact O-N 2.9Å; F19-L72 HydrophobicContact CD2-CB 4.46Å; F19-L72 HydrophobicContact CE2-CB 3.64Å; F19-L72 HydrophobicContact CE2-CD2 4.22Å; F19-L72 HydrophobicContact CZ-CB 4.49Å; F19-L72 HydrophobicContact CZ-CD2 4.31Å; F54-L72 HydrophobicContact CD2-CD1 3.97Å; Q55-L72 WeakPolarHBondContact O-CA 3.38Å; L56-L72 HydrophobicContact CB-CD1 4.14Å; L56-L72 HydrophobicContact CD1-CB 4.13Å; L56-L72 HydrophobicContact CD1-CD1 4.2Å; L72-F74 HydrophobicContact CB-CE2 4.4Å; L72-F74 HydrophobicContact CD1-CZ 4.39Å; L72-F74 HydrophobicContact CD2-CD2 4.47Å; L72-F74 HydrophobicContact CD2-CE1 4.21Å; L72-F74 HydrophobicContact CD2-CE2 3.42Å; L72-F74 VanDerWaalsContact CD2-CE2 3.42Å; L72-F74 HydrophobicContact CD2-CZ 3.26Å; L72-F74 HydrophobicContact CG-CD2 4.08Å; L72-F74 HydrophobicContact CG-CE1 4.37Å; L72-F74 HydrophobicContact CG-CE2 3.47Å; L72-F74 VanDerWaalsContact CG-CE2 3.47Å; L72-F74 HydrophobicContact CG-CZ 3.66Å
73	L	88.7	Confident	78.1	Confident	41 Å²	41	73.1 Å²	73.1	22%	0.215	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.3	173	-59.5	176.8	0	0	0	108.2	I14 I15 I16 F54 Q55 I57 I71	I14-L73 HydrophobicContact CG2-CD2 4.47Å; I15-L73 CarbonylContact O-C 3.52Å; I15-L73 WeakPolarHBondContact O-CA 3.09Å; I16-L73 HydrophobicContact CB-CD2 4.17Å; I16-L73 HydrophobicContact CD1-CD2 3.99Å; I16-L73 HydrophobicContact CG1-CD2 3.63Å; I16-L73 HydrophobicContact CG2-CD2 3.97Å; F54-L73 CarbonylContact C-O 3.58Å; F54-L73 WeakPolarHBondContact CA-O 3.41Å; F54-L73 WeakPolarHBondContact CB-O 3.33Å; Q55-L73 PolarHBondContact N-O 3.41Å; Q55-L73 PolarHBondContact O-N 2.78Å; I57-L73 HydrophobicContact CD1-CD1 3.89Å; I71-L73 HydrophobicContact CG2-CD2 3.69Å; I71-L73 HydrophobicContact CG2-CG 3.98Å
74	F	87.2	Confident	78.4	Confident	22 Å²	22	64.4 Å²	64.4	10%	0.096	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133	167.2	-58.3	-95.1	0	0	0	109	I14 I15 F37 L51 F54 L72 Y76	I14-F74 CarbonylContact C-O 3.57Å; I14-F74 VanDerWaalsContact CA-O 3.25Å; I14-F74 WeakPolarHBondContact CA-O 3.38Å; I15-F74 HydrophobicContact CB-CB 4.26Å; I15-F74 HydrophobicContact CB-CD2 4.23Å; I15-F74 HydrophobicContact CG2-CD2 4.2Å; I15-F74 PolarHBondContact N-O 2.64Å; I15-F74 PolarHBondContact O-N 3.04Å; F37-F74 HydrophobicContact CE1-CZ 4.24Å; F37-F74 HydrophobicContact CZ-CD1 4.13Å; F37-F74 AromaticContact CZ-CE1 3.79Å; F37-F74 HydrophobicContact CZ-CE1 3.79Å; F37-F74 HydrophobicContact CZ-CE2 4.47Å; F37-F74 AromaticContact CZ-CZ 3.96Å; F37-F74 HydrophobicContact CZ-CZ 3.96Å; L51-F74 HydrophobicContact CD1-CB 3.93Å; L51-F74 HydrophobicContact CD1-CD1 3.78Å; L51-F74 HydrophobicContact CD1-CG 4.37Å; L51-F74 HydrophobicContact CD2-CD1 4.48Å; F54-F74 HydrophobicContact CB-CD1 3.63Å; F54-F74 HydrophobicContact CB-CE1 4.13Å; F54-F74 HydrophobicContact CB-CG 4.29Å; L72-F74 HydrophobicContact CB-CE2 4.4Å; L72-F74 HydrophobicContact CD1-CZ 4.39Å; L72-F74 HydrophobicContact CD2-CD2 4.47Å; L72-F74 HydrophobicContact CD2-CE1 4.21Å; L72-F74 HydrophobicContact CD2-CE2 3.42Å; L72-F74 VanDerWaalsContact CD2-CE2 3.42Å; L72-F74 HydrophobicContact CD2-CZ 3.26Å; L72-F74 HydrophobicContact CG-CD2 4.08Å; L72-F74 HydrophobicContact CG-CE1 4.37Å; L72-F74 HydrophobicContact CG-CE2 3.47Å; L72-F74 VanDerWaalsContact CG-CE2 3.47Å; L72-F74 HydrophobicContact CG-CZ 3.66Å; F74-Y76 HydrophobicContact CB-CD2 4.24Å; F74-Y76 HydrophobicContact CB-CE2 3.23Å; F74-Y76 VanDerWaalsContact CB-CZ 3.42Å; F74-Y76 WeakPolarHBondContact CB-OH 3.42Å; F74-Y76 VanDerWaalsContact CD1-OH 3.26Å; F74-Y76 WeakPolarHBondContact CD1-OH 3.22Å; F74-Y76 HydrophobicContact CG-CE2 4.21Å; F74-Y76 WeakPolarHBondContact CG-OH 3.47Å
75	I	87	Confident	79.3	Confident	58 Å²	58	63.6 Å²	63.6	30%	0.297	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128.4	175.1	-53	-176.8	0	0	0	107.6	G13 I14 L52 S53	G13-I75 WeakPolarHBondContact O-CA 3.32Å; I14-I75 HydrophobicContact CG1-CG1 4.36Å; L52-I75 HydrophobicContact CD1-CG2 4.37Å; L52-I75 PolarHBondContact N-O 2.76Å; S53-I75 PolarHBondContact N-O 3.28Å; S53-I75 PolarHBondContact O-N 3.39Å
76	Y	85.4	Confident	80.5	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	152.8	176.6	-53.4	-97.4	0	0	0	110.9	L12 G13 I15 F37 L40 P49 V50 L51 F74	L12-Y76 WeakPolarHBondContact CA-O 3.45Å; G13-Y76 PolarHBondContact N-O 3.12Å; G13-Y76 PolarHBondContact O-N 2.91Å; I15-Y76 HydrophobicContact CB-CE2 4.12Å; I15-Y76 HydrophobicContact CD1-CD2 4.31Å; I15-Y76 HydrophobicContact CD1-CE2 3.5Å; I15-Y76 VanDerWaalsContact CD1-CE2 3.5Å; I15-Y76 HydrophobicContact CG1-CD2 4.26Å; I15-Y76 HydrophobicContact CG1-CE2 3.67Å; F37-Y76 AromaticContact CD2-CE1 3.54Å; F37-Y76 HydrophobicContact CD2-CE1 3.54Å; F37-Y76 AromaticContact CD2-CZ 3.49Å; F37-Y76 VanDerWaalsContact CD2-CZ 3.49Å; F37-Y76 WeakPolarHBondContact CD2-OH 3.37Å; F37-Y76 AromaticContact CE2-CE1 3.5Å; F37-Y76 HydrophobicContact CE2-CE1 3.5Å; F37-Y76 VanDerWaalsContact CE2-CE1 3.5Å; F37-Y76 AromaticContact CE2-CZ 3.4Å; F37-Y76 VanDerWaalsContact CE2-CZ 3.4Å; F37-Y76 WeakPolarHBondContact CE2-OH 3.43Å; F37-Y76 WeakPolarHBondContact CZ-OH 3.16Å; L40-Y76 HydrophobicContact CD1-CD1 3.81Å; L40-Y76 HydrophobicContact CD1-CD2 4.14Å; L40-Y76 HydrophobicContact CD1-CE1 3.84Å; L40-Y76 HydrophobicContact CD1-CE2 4.15Å; L40-Y76 HydrophobicContact CD1-CG 3.99Å; P49-Y76 HydrophobicContact CB-CD1 4.28Å; V50-Y76 CarbonylContact O-C 3.5Å; V50-Y76 WeakPolarHBondContact O-CA 3.3Å; V50-Y76 WeakPolarHBondContact O-CB 3.09Å; L51-Y76 HydrophobicContact CB-CD1 3.93Å; L51-Y76 HydrophobicContact CB-CE1 3.75Å; L51-Y76 HydrophobicContact CD1-CD1 3.99Å; L51-Y76 HydrophobicContact CD1-CE1 3.45Å; L51-Y76 VanDerWaalsContact CD1-CE1 3.45Å; L51-Y76 HydrophobicContact CD1-CE2 4.3Å; L51-Y76 HydrophobicContact CG-CE1 4.17Å; F74-Y76 HydrophobicContact CB-CD2 4.24Å; F74-Y76 HydrophobicContact CB-CE2 3.23Å; F74-Y76 VanDerWaalsContact CB-CZ 3.42Å; F74-Y76 WeakPolarHBondContact CB-OH 3.42Å; F74-Y76 VanDerWaalsContact CD1-OH 3.26Å; F74-Y76 WeakPolarHBondContact CD1-OH 3.22Å; F74-Y76 HydrophobicContact CG-CE2 4.21Å; F74-Y76 WeakPolarHBondContact CG-OH 3.47Å
77	S	84.9	Confident	80.9	Confident	11 Å²	11	48.5 Å²	48.5	8%	0.077	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	154	158.8	60.1	0	0	0	0	112.6	N11 P49 V50	N11-S77 CarbonylContact O-C 3.51Å; N11-S77 WeakPolarHBondContact O-CA 3.28Å; P49-S77 WeakPolarHBondContact CA-O 3.48Å; V50-S77 PolarHBondContact N-O 3.2Å; V50-S77 PolarHBondContact O-N 3.06Å
78	Y	79.1	Confident	81.8	Confident	29 Å²	29	43.6 Å²	43.6	11%	0.114	25%	0.253	C	S	.	.			trans	-119.7	84.6	166.2	-68.2	-84.5	0	0	0	106.3	N11 L40 N47 P49	N11-Y78 WeakPolarHBondContact CB-O 3.49Å; N11-Y78 PolarHBondContact O-N 2.9Å; N11-Y78 PolarHBondContact OD1-O 3.49Å; L40-Y78 WeakPolarHBondContact CB-OH 3.09Å; L40-Y78 WeakPolarHBondContact CD2-OH 3.47Å; N47-Y78 HydrophobicContact CB-CD1 4.49Å; P49-Y78 HydrophobicContact CB-CD1 4.28Å; P49-Y78 HydrophobicContact CB-CE1 3.79Å; P49-Y78 HydrophobicContact CG-CE1 4.4Å
79	D	76.1	Confident	82.2	Confident	87 Å²	87	40.6 Å²	40.6	47%	0.465	23%	0.229	S	C	.	.			trans	-119.4	122.1	171.4	-76.5	-42.4	0	0	0	108	N11	N11-D79 WeakPolarHBondContact CB-OD1 3.32Å; N11-D79 VanDerWaalsContact CG-OD1 3.32Å; N11-D79 PolarHBondContact ND2-OD1 3.11Å
80	S	58.8	Low	82.1	Confident	135 Å²	135	43.6 Å²	43.6	94%	0.944	24%	0.243	S	C	*	.			trans	44	0	-178.7	61.2	0	0	0	0	115.7	N47	N47-S80 WeakPolarHBondContact CA-OXT 3.45Å; N47-S80 WeakPolarHBondContact CB-OXT 3.43Å; N47-S80 PolarHBondContact ND2-OXT 2.96Å; N47-S80 PolarHBondContact OD1-OXT 3.21Å

Retrieved 80 of 80 residues in 164 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).