C4QG05_SCHMA Loading...

MEG-2 (ESP15) family AlphaSync

AlphaFold DB , UniProt , Accession C4QG05, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 76 aa.

						>C4QG05_SCHMA|C4QG05
MFSMINHIVNLKSELPFLCFTETTCCDEDGNSKICCVGNDCKDVIKPRSSGADDLNLFLRKRGMAYKLGEILKKLN
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	47.9	Very low	45.1	Very low	219 Å²	219	106.9 Å²	106.9	100%	1.079	55%	0.549	S	S	*	.				0	-31.9	0	-144.2	167.9	-176.6	0	0	113.3	S3	M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.48Å
2	F	42.9	Very low	45	Very low	186 Å²	186	105.1 Å²	105.1	82%	0.816	53%	0.534	S	S	*	.	H	α-helix	trans	-63.7	-24.6	-178.8	-76.9	-89.1	0	0	0	116.4
3	S	49.9	Very low	45	Very low	79 Å²	79	104.8 Å²	104.8	55%	0.552	55%	0.547	S	S	*	.	H	α-helix	trans	-66.4	-40.1	-176.1	161.6	0	0	0	0	112.9	M1 I5 N6 H7	M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.48Å; S3-I5 PolarHBondContact O-N 3Å; S3-N6 PolarHBondContact O-N 3.43Å; S3-H7 PolarHBondContact O-CD2 3.48Å; S3-H7 PolarHBondContact O-N 3.39Å
4	M	43.9	Very low	45	Very low	142 Å²	142	106.9 Å²	106.9	70%	0.7	55%	0.553	S	S	*	*	H	α-helix	trans	-68	-33	-175.8	-70.2	-176.3	78.7	0	0	113.3	N6 H7 I8	M4-N6 PolarHBondContact O-N 3.38Å; M4-H7 PolarHBondContact O-N 3.11Å; M4-I8 WeakPolarHBondContact O-CG1 3.5Å; M4-I8 PolarHBondContact O-N 3Å
5	I	46.7	Very low	45	Very low	88 Å²	88	100.9 Å²	100.9	45%	0.451	52%	0.522	S	S	.	.	H	α-helix	trans	-63.7	-43.9	180	-59.2	173.6	0	0	0	110.1	S3 H7 I8 V9	S3-I5 PolarHBondContact O-N 3Å; I5-H7 VanDerWaalsContact C-N 3.26Å; I5-H7 PolarHBondContact O-N 3.23Å; I5-I8 PolarHBondContact O-N 3.37Å; I5-I8 VanDerWaalsContact O-N 3.17Å; I5-V9 HydrophobicContact CG2-CG2 4.48Å; I5-V9 WeakPolarHBondContact O-CG2 3.45Å; I5-V9 PolarHBondContact O-N 3.3Å
6	N	44.5	Very low	44.9	Very low	109 Å²	109	99.4 Å²	99.4	58%	0.583	52%	0.521	S	S	*	.	H	α-helix	trans	-63.1	-31.6	177.2	-95.8	-0.9	0	0	0	113	S3 M4 N10	S3-N6 PolarHBondContact O-N 3.43Å; M4-N6 PolarHBondContact O-N 3.38Å; N6-N10 WeakPolarHBondContact O-CB 3.4Å; N6-N10 PolarHBondContact O-N 2.88Å; N6-N10 PolarHBondContact O-ND2 2.93Å; N6-N10 VanDerWaalsContact O-ND2 3.12Å
7	H	46.4	Very low	45	Very low	79 Å²	79	100.5 Å²	100.5	37%	0.366	52%	0.52	S	S	.	.	H	α-helix	trans	-72.7	-39	174.9	-67.9	-66.5	0	0	0	111.8	S3 M4 I5 V9 N10 L11	S3-H7 PolarHBondContact O-CD2 3.48Å; S3-H7 PolarHBondContact O-N 3.39Å; M4-H7 PolarHBondContact O-N 3.11Å; I5-H7 VanDerWaalsContact C-N 3.26Å; I5-H7 PolarHBondContact O-N 3.23Å; H7-V9 VanDerWaalsContact C-N 3.31Å; H7-V9 PolarHBondContact O-N 3.41Å; H7-N10 PolarHBondContact O-N 3.44Å; H7-L11 WeakPolarHBondContact O-CB 3.47Å; H7-L11 WeakPolarHBondContact O-CG 3.41Å; H7-L11 PolarHBondContact O-N 3.48Å
8	I	43.8	Very low	45.4	Very low	86 Å²	86	95.8 Å²	95.8	44%	0.441	50%	0.496	S	S	.	.	H	α-helix	trans	-63.1	-39.2	173.6	-65.6	167.4	0	0	0	110.9	M4 I5 L11 K12	M4-I8 WeakPolarHBondContact O-CG1 3.5Å; M4-I8 PolarHBondContact O-N 3Å; I5-I8 PolarHBondContact O-N 3.37Å; I5-I8 VanDerWaalsContact O-N 3.17Å; I8-L11 WeakPolarHBondContact O-CB 3.41Å; I8-L11 PolarHBondContact O-N 2.93Å; I8-K12 PolarHBondContact O-N 3.23Å
9	V	43.8	Very low	45.5	Very low	69 Å²	69	92.7 Å²	92.7	42%	0.418	48%	0.484	S	S	.	.	H	α-helix	trans	-70.1	-38.9	175.5	178.2	0	0	0	0	111.5	I5 H7 L11 K12	I5-V9 HydrophobicContact CG2-CG2 4.48Å; I5-V9 WeakPolarHBondContact O-CG2 3.45Å; I5-V9 PolarHBondContact O-N 3.3Å; H7-V9 VanDerWaalsContact C-N 3.31Å; H7-V9 PolarHBondContact O-N 3.41Å; V9-L11 VanDerWaalsContact C-N 3.31Å; V9-L11 PolarHBondContact O-N 3.17Å; V9-K12 VanDerWaalsContact O-CB 3.23Å; V9-K12 WeakPolarHBondContact O-CB 3.45Å; V9-K12 PolarHBondContact O-N 2.92Å
10	N	43.6	Very low	45.7	Very low	95 Å²	95	94.9 Å²	94.9	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-62.5	-38.8	173.1	-93.9	-67.6	0	0	0	112.1	N6 H7 K12 S13 E14	N6-N10 WeakPolarHBondContact O-CB 3.4Å; N6-N10 PolarHBondContact O-N 2.88Å; N6-N10 PolarHBondContact O-ND2 2.93Å; N6-N10 VanDerWaalsContact O-ND2 3.12Å; H7-N10 PolarHBondContact O-N 3.44Å; N10-K12 PolarHBondContact O-N 3.12Å; N10-S13 PolarHBondContact O-N 3.31Å; N10-E14 PolarHBondContact O-N 3.2Å
11	L	42.6	Very low	46	Very low	24 Å²	24	93.3 Å²	93.3	13%	0.126	48%	0.484	C	S	.	.	H	α-helix	trans	-56.9	-30.3	171.6	-79.1	159.5	0	0	0	112.1	H7 I8 V9 S13 L15 L68 I71 L75	H7-L11 WeakPolarHBondContact O-CB 3.47Å; H7-L11 WeakPolarHBondContact O-CG 3.41Å; H7-L11 PolarHBondContact O-N 3.48Å; I8-L11 WeakPolarHBondContact O-CB 3.41Å; I8-L11 PolarHBondContact O-N 2.93Å; V9-L11 VanDerWaalsContact C-N 3.31Å; V9-L11 PolarHBondContact O-N 3.17Å; L11-S13 VanDerWaalsContact C-N 3.35Å; L11-S13 PolarHBondContact O-N 2.75Å; L11-L15 HydrophobicContact CD2-CD1 3.86Å; L11-L15 VanDerWaalsContact O-CB 3.31Å; L11-L15 WeakPolarHBondContact O-CB 3.44Å; L11-L15 VanDerWaalsContact O-CD1 3.25Å; L11-L15 WeakPolarHBondContact O-CD1 3.33Å; L11-L15 PolarHBondContact O-N 3.14Å; L11-L68 HydrophobicContact CD1-CD1 4.26Å; L11-L68 HydrophobicContact CD2-CD1 4.36Å; L11-I71 HydrophobicContact CD2-CB 3.99Å; L11-I71 HydrophobicContact CD2-CD1 4.28Å; L11-I71 HydrophobicContact CD2-CG2 3.35Å; L11-L75 HydrophobicContact CD1-CD1 4.43Å; L11-L75 HydrophobicContact CD2-CD1 4.47Å; L11-L75 HydrophobicContact CG-CD1 4.28Å
12	K	44.6	Very low	46.4	Very low	85 Å²	85	89.7 Å²	89.7	37%	0.37	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-37.9	173.8	-70.2	-176.1	165.8	-171.1	0	113.1	I8 V9 N10 L15	I8-K12 PolarHBondContact O-N 3.23Å; V9-K12 VanDerWaalsContact O-CB 3.23Å; V9-K12 WeakPolarHBondContact O-CB 3.45Å; V9-K12 PolarHBondContact O-N 2.92Å; N10-K12 PolarHBondContact O-N 3.12Å; K12-L15 CarbonylContact O-C 3.38Å
13	S	44.9	Very low	47.1	Very low	101 Å²	101	84.9 Å²	84.9	71%	0.706	45%	0.45	S	S	*	.	H	α-helix	trans	-71	-37.2	-176.3	-176	0	0	0	0	111.7	N10 L11	N10-S13 PolarHBondContact O-N 3.31Å; L11-S13 VanDerWaalsContact C-N 3.35Å; L11-S13 PolarHBondContact O-N 2.75Å
14	E	44.3	Very low	47.7	Very low	135 Å²	135	82.5 Å²	82.5	63%	0.631	43%	0.432	S	S	*	.	H	α-helix	trans	-87.5	-14.7	179.1	-63.4	-167.1	112.8	0	0	112.7	N10	N10-E14 PolarHBondContact O-N 3.2Å
15	L	44.9	Very low	48.7	Very low	16 Å²	16	77.1 Å²	77.1	8%	0.084	41%	0.409	C	S	.	.			trans	-133.3	77.8	-178.5	-64.7	94.2	0	0	0	113.1	L11 K12 F17 L18 I71	L11-L15 HydrophobicContact CD2-CD1 3.86Å; L11-L15 VanDerWaalsContact O-CB 3.31Å; L11-L15 WeakPolarHBondContact O-CB 3.44Å; L11-L15 VanDerWaalsContact O-CD1 3.25Å; L11-L15 WeakPolarHBondContact O-CD1 3.33Å; L11-L15 PolarHBondContact O-N 3.14Å; K12-L15 CarbonylContact O-C 3.38Å; L15-F17 PolarHBondContact O-N 3.47Å; L15-F17 VanDerWaalsContact O-N 3.09Å; L15-L18 HydrophobicContact CB-CB 3.75Å; L15-L18 HydrophobicContact CD2-CB 3.62Å; L15-L18 HydrophobicContact CD2-CD1 3.63Å; L15-L18 HydrophobicContact CD2-CD2 4.08Å; L15-L18 HydrophobicContact CD2-CG 3.95Å; L15-L18 HydrophobicContact CG-CB 4.33Å; L15-L18 PolarHBondContact O-N 3.31Å; L15-L18 VanDerWaalsContact O-N 3.12Å; L15-I71 HydrophobicContact CD1-CD1 3.22Å; L15-I71 HydrophobicContact CD1-CG1 4.34Å; L15-I71 HydrophobicContact CD2-CD1 3.34Å; L15-I71 HydrophobicContact CG-CD1 3.74Å
16	P	44.7	Very low	49.7	Very low	77 Å²	77	73.3 Å²	73.3	50%	0.5	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-23.4	166.8	24.3	-32.6	0	0	0	112.1
17	F	46.8	Very low	50.9	Low	118 Å²	118	68.9 Å²	68.9	52%	0.518	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-1.8	-179.4	-26.7	-81.8	0	0	0	114.6	L15 C26	L15-F17 PolarHBondContact O-N 3.47Å; L15-F17 VanDerWaalsContact O-N 3.09Å; F17-C26 CarbonylContact C-O 3.43Å; F17-C26 CarbonylContact O-C 3.49Å
18	L	50.6	Low	52	Low	16 Å²	16	70.3 Å²	70.3	8%	0.084	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-57.8	171.8	-120.7	79	0	0	0	110.4	L15 C25 C26 M64 K67 L68	L15-L18 HydrophobicContact CB-CB 3.75Å; L15-L18 HydrophobicContact CD2-CB 3.62Å; L15-L18 HydrophobicContact CD2-CD1 3.63Å; L15-L18 HydrophobicContact CD2-CD2 4.08Å; L15-L18 HydrophobicContact CD2-CG 3.95Å; L15-L18 HydrophobicContact CG-CB 4.33Å; L15-L18 PolarHBondContact O-N 3.31Å; L15-L18 VanDerWaalsContact O-N 3.12Å; L18-C25 CarbonylContact O-C 3.46Å; L18-C25 WeakPolarHBondContact O-CA 3.48Å; L18-C25 WeakPolarHBondContact O-CB 3.41Å; L18-C26 PolarHBondContact O-N 3.02Å; L18-M64 HydrophobicContact CD1-CB 4.47Å; L18-M64 HydrophobicContact CD1-CG 4.35Å; L18-K67 HydrophobicContact CD1-CB 4.35Å; L18-K67 HydrophobicContact CD1-CD 4.38Å; L18-L68 HydrophobicContact CD2-CB 4.03Å; L18-L68 HydrophobicContact CD2-CD1 4.18Å
19	C	48.2	Very low	53	Low	38 Å²	38	70.8 Å²	70.8	26%	0.257	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-138.9	113.4	-170	-50.9	0	0	0	0	115.5	T24 C25	C19-T24 CarbonylContact C-O 3.49Å; C19-T24 VanDerWaalsContact CA-O 3.23Å; C19-T24 WeakPolarHBondContact CA-O 3.26Å; C19-C25 HydrophobicContact CB-CB 4.15Å; C19-C25 WeakPolarHBondContact CB-SG 3.31Å; C19-C25 WeakPolarHBondContact SG-CB 3.35Å; C19-C25 CovalentContact SG-SG 2.07Å; C19-C25 PolarHBondContact SG-SG 2.92Å
20	F	48.9	Very low	54.1	Low	136 Å²	136	71 Å²	71	60%	0.596	39%	0.393	S	S	*	.	S	Bend	trans	-71.8	-35.9	174.4	-102.7	-94.7	0	0	0	111.5	T24 C26	F20-T24 PolarHBondContact N-O 3.44Å; F20-C26 HydrophobicContact CD2-CB 4.27Å
21	T	53.1	Low	55.2	Low	62 Å²	62	73.9 Å²	73.9	38%	0.38	41%	0.408	S	S	.	.	S	Bend	trans	-131.3	169.9	172.9	66.5	0	0	0	0	110.2	T23 T24	T21-T23 PolarHBondContact O-N 3.39Å; T21-T23 PolarHBondContact OG1-N 3.42Å; T21-T23 PolarHBondContact OG1-OG1 2.89Å; T21-T24 PolarHBondContact N-O 3.01Å; T21-T24 PolarHBondContact O-N 3.15Å; T21-T24 WeakPolarHBondContact OG1-CA 3.43Å; T21-T24 WeakPolarHBondContact OG1-CB 3.39Å; T21-T24 PolarHBondContact OG1-N 3.45Å; T21-T24 PolarHBondContact OG1-OG1 3.41Å
22	E	55.7	Low	56.3	Low	142 Å²	142	73.7 Å²	73.7	66%	0.664	41%	0.409	S	S	*	.	S	Bend	trans	-55.9	-22.9	176	-64.7	-172.8	162.2	0	0	112.9
23	T	57.8	Low	57.4	Low	85 Å²	85	72.2 Å²	72.2	52%	0.521	40%	0.402	S	S	.	.	S	Bend	trans	-111.5	-17.1	-178.1	55.1	0	0	0	0	113.5	T21 V37 G38	T21-T23 PolarHBondContact O-N 3.39Å; T21-T23 PolarHBondContact OG1-N 3.42Å; T21-T23 PolarHBondContact OG1-OG1 2.89Å; T23-V37 CarbonylContact O-C 3.49Å; T23-V37 VanDerWaalsContact O-CA 3.26Å; T23-V37 WeakPolarHBondContact O-CA 3.23Å; T23-G38 PolarHBondContact O-N 2.89Å
24	T	62.4	Low	58.7	Low	29 Å²	29	67.4 Å²	67.4	18%	0.178	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.1	-172.1	-54.9	0	0	0	0	111.7	C19 F20 T21 C35 C36 V37	C19-T24 CarbonylContact C-O 3.49Å; C19-T24 VanDerWaalsContact CA-O 3.23Å; C19-T24 WeakPolarHBondContact CA-O 3.26Å; F20-T24 PolarHBondContact N-O 3.44Å; T21-T24 PolarHBondContact N-O 3.01Å; T21-T24 PolarHBondContact O-N 3.15Å; T21-T24 WeakPolarHBondContact OG1-CA 3.43Å; T21-T24 WeakPolarHBondContact OG1-CB 3.39Å; T21-T24 PolarHBondContact OG1-N 3.45Å; T21-T24 PolarHBondContact OG1-OG1 3.41Å; T24-C35 HydrophobicContact CG2-CB 4.46Å; T24-C36 CarbonylContact C-O 3.4Å; T24-C36 WeakPolarHBondContact CA-O 2.83Å; T24-V37 HydrophobicContact CG2-CG2 4Å
25	C	64.9	Low	59.9	Low	30 Å²	30	62 Å²	62	20%	0.203	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	119.1	-179.3	-57.4	0	0	0	0	113.5	L18 C19 C35 C36	L18-C25 CarbonylContact O-C 3.46Å; L18-C25 WeakPolarHBondContact O-CA 3.48Å; L18-C25 WeakPolarHBondContact O-CB 3.41Å; C19-C25 HydrophobicContact CB-CB 4.15Å; C19-C25 WeakPolarHBondContact CB-SG 3.31Å; C19-C25 WeakPolarHBondContact SG-CB 3.35Å; C19-C25 CovalentContact SG-SG 2.07Å; C19-C25 PolarHBondContact SG-SG 2.92Å; C25-C35 CarbonylContact O-C 3.43Å; C25-C35 WeakPolarHBondContact O-CA 3.4Å; C25-C36 HydrophobicContact CB-CB 4.44Å; C25-C36 PolarHBondContact N-O 2.98Å; C25-C36 PolarHBondContact O-N 3.2Å
26	C	67.1	Low	60.9	Low	7 Å²	7	61.8 Å²	61.8	5%	0.047	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	115.9	-169.6	-65.9	0	0	0	0	112.8	F17 L18 F20 I34 C35	F17-C26 CarbonylContact C-O 3.43Å; F17-C26 CarbonylContact O-C 3.49Å; L18-C26 PolarHBondContact O-N 3.02Å; F20-C26 HydrophobicContact CD2-CB 4.27Å; C26-I34 CarbonylContact C-O 3.14Å; C26-I34 VanDerWaalsContact CA-O 3.26Å; C26-I34 WeakPolarHBondContact CA-O 3.47Å; C26-C35 HydrophobicContact CB-CB 4.16Å; C26-C35 WeakPolarHBondContact CB-SG 3.49Å; C26-C35 WeakPolarHBondContact SG-CB 3.25Å; C26-C35 CovalentContact SG-SG 2.04Å; C26-C35 PolarHBondContact SG-SG 3.09Å
27	D	69.7	Low	62	Low	17 Å²	17	61.9 Å²	61.9	9%	0.091	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134	171.7	-171.7	70.2	0	0	0	109.5	K33 I34 R60 M64 K67	D27-K33 WeakPolarHBondContact O-CA 3.31Å; D27-I34 PolarHBondContact N-O 2.87Å; D27-I34 PolarHBondContact O-N 3.42Å; D27-R60 PolarHBondContact O-NH2 3.21Å; D27-R60 IonicContact OD2-CZ 3.75Å; D27-R60 VanDerWaalsContact OD2-CZ 3.26Å; D27-R60 IonicContact OD2-NE 2.72Å; D27-R60 PolarHBondContact OD2-NE 2.87Å; D27-R60 IonicContact OD2-NH2 3.26Å; D27-R60 PolarHBondContact OD2-NH2 3.49Å; D27-M64 HydrophobicContact CB-CE 4.06Å; D27-M64 HydrophobicContact CB-CG 4.05Å; D27-M64 HydrophobicContact CB-SD 3.82Å; D27-K67 IonicContact OD1-NZ 2.75Å
28	E	69.3	Low	62.8	Low	109 Å²	109	58.8 Å²	58.8	51%	0.509	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.6	176.8	-69	-177.9	146.8	0	0	108.6	K33	E28-K33 HydrophobicContact CG-CB 4.42Å; E28-K33 HydrophobicContact CG-CD 4.02Å; E28-K33 HydrophobicContact CG-CG 3.94Å; E28-K33 WeakPolarHBondContact OE1-CD 3.24Å; E28-K33 VanDerWaalsContact OE1-CE 3.26Å; E28-K33 WeakPolarHBondContact OE1-CE 3.19Å; E28-K33 IonicContact OE1-NZ 2.71Å; E28-K33 PolarHBondContact OE1-NZ 3.03Å
29	D	64.6	Low	63.2	Low	95 Å²	95	65.3 Å²	65.3	51%	0.508	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	100.7	176.5	-176.1	23.3	0	0	0	108.7	N31 S32 R60	D29-N31 PolarHBondContact O-N 3.29Å; D29-N31 VanDerWaalsContact O-N 3.11Å; D29-S32 PolarHBondContact N-O 2.94Å; D29-S32 PolarHBondContact O-N 3.47Å; D29-S32 PolarHBondContact O-OG 2.94Å; D29-R60 VanDerWaalsContact N-NH2 3.19Å
30	G	68.7	Low	63.9	Low	74 Å²	74	69.3 Å²	69.3	76%	0.763	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	-114.4	-171.6	0	0	0	0	0	112
31	N	65.5	Low	64.6	Low	155 Å²	155	63.7 Å²	63.7	83%	0.829	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	8.5	-179.8	-66.1	-23.7	0	0	0	113.7	D29 I45	D29-N31 PolarHBondContact O-N 3.29Å; D29-N31 VanDerWaalsContact O-N 3.11Å; N31-I45 WeakPolarHBondContact O-CD1 3.41Å
32	S	64.9	Low	65.3	Low	21 Å²	21	68.4 Å²	68.4	15%	0.147	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.7	-177.7	65.9	0	0	0	0	111.1	D29 R60	D29-S32 PolarHBondContact N-O 2.94Å; D29-S32 PolarHBondContact O-N 3.47Å; D29-S32 PolarHBondContact O-OG 2.94Å; S32-R60 PolarHBondContact O-NH1 3.47Å; S32-R60 PolarHBondContact O-NH2 3.39Å; S32-R60 PolarHBondContact OG-NH1 3.36Å
33	K	69.4	Low	65.6	Low	54 Å²	54	63.7 Å²	63.7	24%	0.235	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	113.8	178.5	-173.5	167.1	-171.9	155.3	0	109.1	D27 E28 V44 I45	D27-K33 WeakPolarHBondContact O-CA 3.31Å; E28-K33 HydrophobicContact CG-CB 4.42Å; E28-K33 HydrophobicContact CG-CD 4.02Å; E28-K33 HydrophobicContact CG-CG 3.94Å; E28-K33 WeakPolarHBondContact OE1-CD 3.24Å; E28-K33 VanDerWaalsContact OE1-CE 3.26Å; E28-K33 WeakPolarHBondContact OE1-CE 3.19Å; E28-K33 IonicContact OE1-NZ 2.71Å; E28-K33 PolarHBondContact OE1-NZ 3.03Å; K33-V44 PolarHBondContact O-N 3.33Å; K33-I45 HydrophobicContact CB-CD1 4.01Å
34	I	71.6	Confident	65.7	Low	0 Å²	0	64.3 Å²	64.3	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.6	176	-68.1	173.4	0	0	0	107.4	C26 D27 C41 D43 L57 R60 M64	C26-I34 CarbonylContact C-O 3.14Å; C26-I34 VanDerWaalsContact CA-O 3.26Å; C26-I34 WeakPolarHBondContact CA-O 3.47Å; D27-I34 PolarHBondContact N-O 2.87Å; D27-I34 PolarHBondContact O-N 3.42Å; I34-C41 HydrophobicContact CG2-CB 4.17Å; I34-D43 HydrophobicContact CG1-CB 4.09Å; I34-L57 HydrophobicContact CD1-CD1 3.71Å; I34-L57 HydrophobicContact CG1-CD1 4.26Å; I34-L57 HydrophobicContact CG2-CD1 3.5Å; I34-L57 VanDerWaalsContact CG2-CD1 3.5Å; I34-R60 HydrophobicContact CD1-CB 4.04Å; I34-R60 VanDerWaalsContact CD1-CD 3.47Å; I34-R60 HydrophobicContact CD1-CG 4.3Å; I34-R60 VanDerWaalsContact CD1-NH1 3.3Å; I34-M64 HydrophobicContact CG2-CE 4.23Å
35	C	69.4	Low	65.5	Low	20 Å²	20	67.5 Å²	67.5	14%	0.135	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.7	175.5	-69.1	0	0	0	0	110	T24 C25 C26 C41 K42 V44	T24-C35 HydrophobicContact CG2-CB 4.46Å; C25-C35 CarbonylContact O-C 3.43Å; C25-C35 WeakPolarHBondContact O-CA 3.4Å; C26-C35 HydrophobicContact CB-CB 4.16Å; C26-C35 WeakPolarHBondContact CB-SG 3.49Å; C26-C35 WeakPolarHBondContact SG-CB 3.25Å; C26-C35 CovalentContact SG-SG 2.04Å; C26-C35 PolarHBondContact SG-SG 3.09Å; C35-C41 WeakPolarHBondContact O-CA 3.23Å; C35-K42 PolarHBondContact N-O 3.12Å; C35-K42 PolarHBondContact O-N 2.07Å; C35-V44 HydrophobicContact CB-CG2 4.29Å
36	C	65	Low	65.2	Low	12 Å²	12	72.3 Å²	72.3	8%	0.081	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.1	175.3	-60.6	0	0	0	0	109.5	T24 C25 D40 C41	T24-C36 CarbonylContact C-O 3.4Å; T24-C36 WeakPolarHBondContact CA-O 2.83Å; C25-C36 HydrophobicContact CB-CB 4.44Å; C25-C36 PolarHBondContact N-O 2.98Å; C25-C36 PolarHBondContact O-N 3.2Å; C36-D40 CarbonylContact C-O 3.49Å; C36-D40 VanDerWaalsContact CA-O 3.3Å; C36-D40 WeakPolarHBondContact CA-O 3.36Å; C36-C41 HydrophobicContact CB-CB 3.98Å; C36-C41 WeakPolarHBondContact CB-SG 3.35Å; C36-C41 WeakPolarHBondContact SG-CB 2.75Å; C36-C41 CovalentContact SG-SG 2.02Å; C36-C41 PolarHBondContact SG-SG 2.99Å
37	V	68.4	Low	64.8	Low	80 Å²	80	77 Å²	77	49%	0.485	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.8	169.8	-172.9	0	0	0	0	107.8	T23 T24 N39 D40	T23-V37 CarbonylContact O-C 3.49Å; T23-V37 VanDerWaalsContact O-CA 3.26Å; T23-V37 WeakPolarHBondContact O-CA 3.23Å; T24-V37 HydrophobicContact CG2-CG2 4Å; V37-N39 PolarHBondContact O-N 3.47Å; V37-D40 PolarHBondContact N-O 3.28Å; V37-D40 PolarHBondContact O-N 3.34Å; V37-D40 VanDerWaalsContact O-N 3.08Å
38	G	63.6	Low	64.3	Low	53 Å²	53	82.7 Å²	82.7	55%	0.546	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	-120.5	-169	0	0	0	0	0	111	T23	T23-G38 PolarHBondContact O-N 2.89Å
39	N	58.7	Low	64.1	Low	153 Å²	153	82.3 Å²	82.3	82%	0.818	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-10.3	177.9	-74.6	16.3	0	0	0	113.6	V37	V37-N39 PolarHBondContact O-N 3.47Å
40	D	63.3	Low	64	Low	122 Å²	122	80.5 Å²	80.5	65%	0.652	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	114.4	-174.1	-74.3	-45.9	0	0	0	111.2	C36 V37	C36-D40 CarbonylContact C-O 3.49Å; C36-D40 VanDerWaalsContact CA-O 3.3Å; C36-D40 WeakPolarHBondContact CA-O 3.36Å; V37-D40 PolarHBondContact N-O 3.28Å; V37-D40 PolarHBondContact O-N 3.34Å; V37-D40 VanDerWaalsContact O-N 3.08Å
41	C	64.2	Low	63.8	Low	18 Å²	18	79.6 Å²	79.6	12%	0.122	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	128.9	174.2	-49.9	0	0	0	0	111.3	I34 C35 C36 L57 K61	I34-C41 HydrophobicContact CG2-CB 4.17Å; C35-C41 WeakPolarHBondContact O-CA 3.23Å; C36-C41 HydrophobicContact CB-CB 3.98Å; C36-C41 WeakPolarHBondContact CB-SG 3.35Å; C36-C41 WeakPolarHBondContact SG-CB 2.75Å; C36-C41 CovalentContact SG-SG 2.02Å; C36-C41 PolarHBondContact SG-SG 2.99Å; C41-L57 HydrophobicContact CB-CD1 4.03Å; C41-K61 VanDerWaalsContact CB-CE 3.44Å; C41-K61 WeakPolarHBondContact SG-CE 3.34Å
42	K	66.5	Low	64	Low	160 Å²	160	75.4 Å²	75.4	70%	0.696	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.8	174.8	-64.7	-174	178.7	-178.4	0	108.6	C35 V44	C35-K42 PolarHBondContact N-O 3.12Å; C35-K42 PolarHBondContact O-N 2.07Å; K42-V44 PolarHBondContact O-N 3.25Å
43	D	63.2	Low	64.2	Low	43 Å²	43	76.5 Å²	76.5	23%	0.23	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	123.8	161.8	-165	-46.3	0	0	0	107.1	I34 I45 K46	I34-D43 HydrophobicContact CG1-CB 4.09Å; D43-I45 VanDerWaalsContact C-N 3.31Å; D43-I45 PolarHBondContact OD1-N 3.04Å; D43-K46 PolarHBondContact OD1-N 3.48Å
44	V	60	Low	64.3	Low	98 Å²	98	77.5 Å²	77.5	59%	0.594	45%	0.452	S	S	*	.	S	Bend	trans	-77.1	-24.4	-175	-179.9	0	0	0	0	110.9	K33 C35 K42	K33-V44 PolarHBondContact O-N 3.33Å; C35-V44 HydrophobicContact CB-CG2 4.29Å; K42-V44 PolarHBondContact O-N 3.25Å
45	I	57.1	Low	64.4	Low	97 Å²	97	82.5 Å²	82.5	50%	0.497	48%	0.478	S	S	.	.	S	Bend	trans	-108.8	-31.1	-161.1	-62	176.5	0	0	0	112	N31 K33 D43	N31-I45 WeakPolarHBondContact O-CD1 3.41Å; K33-I45 HydrophobicContact CB-CD1 4.01Å; D43-I45 VanDerWaalsContact C-N 3.31Å; D43-I45 PolarHBondContact OD1-N 3.04Å
46	K	59	Low	64.6	Low	130 Å²	130	84.5 Å²	84.5	57%	0.565	49%	0.487	S	S	*	.			trans	-120	127	-177.7	-68	-170.8	178.5	-177.9	0	112.9	D43 R48	D43-K46 PolarHBondContact OD1-N 3.48Å; K46-R48 PolarHBondContact O-N 3.2Å
47	P	59.6	Low	64.9	Low	105 Å²	105	84.4 Å²	84.4	68%	0.682	49%	0.486	S	S	*	.			trans	-59.3	128.3	161.7	25.4	-30.1	0	0	0	108	S49	P47-S49 PolarHBondContact O-N 3.32Å; P47-S49 PolarHBondContact O-OG 2.83Å
48	R	59.3	Low	65.1	Low	137 Å²	137	86.3 Å²	86.3	52%	0.517	49%	0.488	S	S	.	.			trans	-58.4	110	175.3	-59.2	174.7	80.2	141.9	1.5	107.3	K46 D54 L57	K46-R48 PolarHBondContact O-N 3.2Å; R48-D54 IonicContact CZ-OD1 3.1Å; R48-D54 IonicContact NE-OD1 2.78Å; R48-D54 PolarHBondContact NE-OD1 2.69Å; R48-D54 VanDerWaalsContact NH2-CG 3.31Å; R48-D54 IonicContact NH2-OD1 2.64Å; R48-D54 PolarHBondContact NH2-OD1 2.84Å; R48-L57 VanDerWaalsContact CZ-CD2 3.49Å
49	S	63.2	Low	65.6	Low	101 Å²	101	88.1 Å²	88.1	71%	0.706	49%	0.485	S	S	*	.			trans	-111.4	-16.7	-172.7	-58.8	0	0	0	0	111.2	P47 D53	P47-S49 PolarHBondContact O-N 3.32Å; P47-S49 PolarHBondContact O-OG 2.83Å; S49-D53 PolarHBondContact N-OD2 2.88Å
50	S	63.7	Low	66.4	Low	57 Å²	57	81.5 Å²	81.5	40%	0.399	45%	0.448	S	S	.	.	S	Bend	trans	-150.5	161.2	-174.9	69.5	0	0	0	0	113.1	A52 D53 D54	S50-A52 PolarHBondContact O-N 2.9Å; S50-A52 VanDerWaalsContact O-N 3.14Å; S50-A52 PolarHBondContact OG-N 3.41Å; S50-D53 PolarHBondContact N-OD2 3.36Å; S50-D53 WeakPolarHBondContact O-CB 3.03Å; S50-D53 PolarHBondContact O-N 3.35Å; S50-D53 PolarHBondContact OG-OD2 2.91Å; S50-D53 VanDerWaalsContact OG-OD2 3.1Å; S50-D54 PolarHBondContact O-N 3.43Å
51	G	63.8	Low	66.8	Low	55 Å²	55	79.4 Å²	79.4	57%	0.567	43%	0.433	S	S	*	.	H	α-helix	trans	-61	-18	171	0	0	0	0	0	113.9	D54 L55	G51-D54 PolarHBondContact O-N 2.94Å; G51-L55 PolarHBondContact O-N 2.02Å
52	A	70.8	Confident	67.2	Low	67 Å²	67	86.5 Å²	86.5	55%	0.554	46%	0.457	S	S	*	.	H	α-helix	trans	-69.4	-34.8	172.5	0	0	0	0	0	111.9	S50 D54 L55 N56	S50-A52 PolarHBondContact O-N 2.9Å; S50-A52 VanDerWaalsContact O-N 3.14Å; S50-A52 PolarHBondContact OG-N 3.41Å; A52-D54 VanDerWaalsContact C-N 3.31Å; A52-L55 PolarHBondContact O-N 2.71Å; A52-N56 WeakPolarHBondContact O-CB 3.03Å; A52-N56 PolarHBondContact O-N 2.81Å
53	D	69.2	Low	67.6	Low	45 Å²	45	80.3 Å²	80.3	24%	0.241	44%	0.439	C	S	.	.	H	α-helix	trans	-67.2	-36.9	174.5	-56.5	-50	0	0	0	110.6	S49 S50 N56 L57	S49-D53 PolarHBondContact N-OD2 2.88Å; S50-D53 PolarHBondContact N-OD2 3.36Å; S50-D53 WeakPolarHBondContact O-CB 3.03Å; S50-D53 PolarHBondContact O-N 3.35Å; S50-D53 PolarHBondContact OG-OD2 2.91Å; S50-D53 VanDerWaalsContact OG-OD2 3.1Å; D53-N56 PolarHBondContact O-N 3.34Å; D53-L57 WeakPolarHBondContact O-CB 3.2Å; D53-L57 PolarHBondContact O-N 3.08Å
54	D	71.5	Confident	68.1	Low	74 Å²	74	78.9 Å²	78.9	40%	0.396	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-43.8	175.9	-63	-16.7	0	0	0	111.7	R48 S50 G51 A52 L57 F58	R48-D54 IonicContact CZ-OD1 3.1Å; R48-D54 IonicContact NE-OD1 2.78Å; R48-D54 PolarHBondContact NE-OD1 2.69Å; R48-D54 VanDerWaalsContact NH2-CG 3.31Å; R48-D54 IonicContact NH2-OD1 2.64Å; R48-D54 PolarHBondContact NH2-OD1 2.84Å; S50-D54 PolarHBondContact O-N 3.43Å; G51-D54 PolarHBondContact O-N 2.94Å; A52-D54 VanDerWaalsContact C-N 3.31Å; D54-L57 PolarHBondContact O-N 3.24Å; D54-F58 WeakPolarHBondContact O-CB 3.49Å; D54-F58 PolarHBondContact O-N 2.76Å
55	L	72.8	Confident	68.6	Low	105 Å²	105	77.3 Å²	77.3	55%	0.55	43%	0.428	S	S	.	.	H	α-helix	trans	-63.9	-44.1	175	-178.1	62.8	0	0	0	111.2	G51 A52 L57 F58 L59	G51-L55 PolarHBondContact O-N 2.02Å; A52-L55 PolarHBondContact O-N 2.71Å; L55-L57 PolarHBondContact O-N 2.99Å; L55-F58 PolarHBondContact O-N 3.21Å; L55-L59 HydrophobicContact CD1-CD1 4.47Å; L55-L59 HydrophobicContact CD1-CG 4.35Å; L55-L59 HydrophobicContact CG-CD1 4.15Å; L55-L59 HydrophobicContact CG-CG 4.44Å; L55-L59 WeakPolarHBondContact O-CG 3.26Å; L55-L59 PolarHBondContact O-N 2.91Å
56	N	73.4	Confident	69.4	Low	62 Å²	62	79.7 Å²	79.7	33%	0.332	43%	0.432	S	S	.	.	H	α-helix	trans	-61.3	-45.7	178	-168.6	29	0	0	0	111.2	A52 D53 F58 L59 R60	A52-N56 WeakPolarHBondContact O-CB 3.03Å; A52-N56 PolarHBondContact O-N 2.81Å; D53-N56 PolarHBondContact O-N 3.34Å; N56-F58 VanDerWaalsContact C-N 3.32Å; N56-F58 PolarHBondContact O-N 2.72Å; N56-L59 PolarHBondContact O-N 2.76Å; N56-R60 WeakPolarHBondContact O-CB 3.3Å; N56-R60 VanDerWaalsContact O-CG 3.32Å; N56-R60 WeakPolarHBondContact O-CG 3.35Å; N56-R60 PolarHBondContact O-N 2.91Å
57	L	71.2	Confident	69.9	Low	10 Å²	10	78.1 Å²	78.1	5%	0.052	43%	0.425	C	S	.	.	H	α-helix	trans	-59.2	-43.8	174.6	179.5	66.4	0	0	0	111.6	I34 C41 R48 D53 D54 L55 R60 K61	I34-L57 HydrophobicContact CD1-CD1 3.71Å; I34-L57 HydrophobicContact CG1-CD1 4.26Å; I34-L57 HydrophobicContact CG2-CD1 3.5Å; I34-L57 VanDerWaalsContact CG2-CD1 3.5Å; C41-L57 HydrophobicContact CB-CD1 4.03Å; R48-L57 VanDerWaalsContact CZ-CD2 3.49Å; D53-L57 WeakPolarHBondContact O-CB 3.2Å; D53-L57 PolarHBondContact O-N 3.08Å; D54-L57 PolarHBondContact O-N 3.24Å; L55-L57 PolarHBondContact O-N 2.99Å; L57-R60 PolarHBondContact O-N 3.39Å; L57-K61 WeakPolarHBondContact O-CB 3.32Å; L57-K61 WeakPolarHBondContact O-CG 3.06Å; L57-K61 PolarHBondContact O-N 2.92Å
58	F	72.1	Confident	70.4	Confident	121 Å²	121	76.3 Å²	76.3	53%	0.531	41%	0.409	S	S	.	.	H	α-helix	trans	-62	-46.4	177.4	175.9	-99.2	0	0	0	112.2	D54 L55 N56 R60 K61 R62	D54-F58 WeakPolarHBondContact O-CB 3.49Å; D54-F58 PolarHBondContact O-N 2.76Å; L55-F58 PolarHBondContact O-N 3.21Å; N56-F58 VanDerWaalsContact C-N 3.32Å; N56-F58 PolarHBondContact O-N 2.72Å; F58-R60 VanDerWaalsContact C-N 3.31Å; F58-R60 PolarHBondContact O-N 3.22Å; F58-K61 PolarHBondContact O-N 3.3Å; F58-R62 WeakPolarHBondContact O-CB 3.45Å; F58-R62 PolarHBondContact O-N 3.4Å
59	L	74.8	Confident	70.9	Confident	91 Å²	91	71.1 Å²	71.1	48%	0.476	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-40.7	177.4	-71.6	174.2	0	0	0	111.5	L55 N56 R62 G63	L55-L59 HydrophobicContact CD1-CD1 4.47Å; L55-L59 HydrophobicContact CD1-CG 4.35Å; L55-L59 HydrophobicContact CG-CD1 4.15Å; L55-L59 HydrophobicContact CG-CG 4.44Å; L55-L59 WeakPolarHBondContact O-CG 3.26Å; L55-L59 PolarHBondContact O-N 2.91Å; N56-L59 PolarHBondContact O-N 2.76Å; L59-R62 PolarHBondContact O-N 2.92Å; L59-G63 PolarHBondContact O-N 3.47Å
60	R	75.1	Confident	71.3	Confident	14 Å²	14	69.5 Å²	69.5	5%	0.053	38%	0.38	C	S	.	.	H	α-helix	trans	-69.2	-41.4	177.3	-69.6	-173.6	63.9	-175.4	10.9	112.6	D27 D29 S32 I34 N56 L57 F58 R62 G63 M64	D27-R60 PolarHBondContact O-NH2 3.21Å; D27-R60 IonicContact OD2-CZ 3.75Å; D27-R60 VanDerWaalsContact OD2-CZ 3.26Å; D27-R60 IonicContact OD2-NE 2.72Å; D27-R60 PolarHBondContact OD2-NE 2.87Å; D27-R60 IonicContact OD2-NH2 3.26Å; D27-R60 PolarHBondContact OD2-NH2 3.49Å; D29-R60 VanDerWaalsContact N-NH2 3.19Å; S32-R60 PolarHBondContact O-NH1 3.47Å; S32-R60 PolarHBondContact O-NH2 3.39Å; S32-R60 PolarHBondContact OG-NH1 3.36Å; I34-R60 HydrophobicContact CD1-CB 4.04Å; I34-R60 VanDerWaalsContact CD1-CD 3.47Å; I34-R60 HydrophobicContact CD1-CG 4.3Å; I34-R60 VanDerWaalsContact CD1-NH1 3.3Å; N56-R60 WeakPolarHBondContact O-CB 3.3Å; N56-R60 VanDerWaalsContact O-CG 3.32Å; N56-R60 WeakPolarHBondContact O-CG 3.35Å; N56-R60 PolarHBondContact O-N 2.91Å; L57-R60 PolarHBondContact O-N 3.39Å; F58-R60 VanDerWaalsContact C-N 3.31Å; F58-R60 PolarHBondContact O-N 3.22Å; R60-R62 VanDerWaalsContact C-N 3.31Å; R60-R62 PolarHBondContact O-N 2.94Å; R60-G63 PolarHBondContact O-N 2.83Å; R60-M64 WeakPolarHBondContact O-CG 3.26Å; R60-M64 PolarHBondContact O-N 2.94Å
61	K	71.9	Confident	71.4	Confident	77 Å²	77	67.8 Å²	67.8	34%	0.335	37%	0.366	S	S	.	.	H	α-helix	trans	-56	-45.8	169.4	-76	-174.7	-174.2	-149	0	111.7	C41 L57 F58 M64 A65	C41-K61 VanDerWaalsContact CB-CE 3.44Å; C41-K61 WeakPolarHBondContact SG-CE 3.34Å; L57-K61 WeakPolarHBondContact O-CB 3.32Å; L57-K61 WeakPolarHBondContact O-CG 3.06Å; L57-K61 PolarHBondContact O-N 2.92Å; F58-K61 PolarHBondContact O-N 3.3Å; K61-M64 PolarHBondContact O-N 2.04Å; K61-A65 PolarHBondContact O-N 2.85Å
62	R	73.5	Confident	71.5	Confident	167 Å²	167	69.7 Å²	69.7	63%	0.63	36%	0.362	S	S	*	.	H	α-helix	trans	-64.1	-41	177.7	-173.4	178.8	178.5	-178.6	-0.1	111.7	F58 L59 R60 A65 Y66	F58-R62 WeakPolarHBondContact O-CB 3.45Å; F58-R62 PolarHBondContact O-N 3.4Å; L59-R62 PolarHBondContact O-N 2.92Å; R60-R62 VanDerWaalsContact C-N 3.31Å; R60-R62 PolarHBondContact O-N 2.94Å; R62-A65 PolarHBondContact O-N 2.89Å; R62-Y66 WeakPolarHBondContact O-CB 3.46Å; R62-Y66 PolarHBondContact O-N 2.99Å
63	G	75.1	Confident	71.5	Confident	30 Å²	30	73.1 Å²	73.1	31%	0.309	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-44.2	175	0	0	0	0	0	112.4	L59 R60 Y66 K67	L59-G63 PolarHBondContact O-N 3.47Å; R60-G63 PolarHBondContact O-N 2.83Å; G63-Y66 PolarHBondContact O-N 2.77Å; G63-K67 WeakPolarHBondContact O-CG 3.45Å; G63-K67 PolarHBondContact O-N 2.91Å
64	M	72	Confident	71.3	Confident	14 Å²	14	79.2 Å²	79.2	7%	0.069	39%	0.389	C	S	.	.	H	α-helix	trans	-61	-47	174.2	-73.6	-174.2	-95.4	0	0	111.8	L18 D27 I34 R60 K61 Y66 K67 L68	L18-M64 HydrophobicContact CD1-CB 4.47Å; L18-M64 HydrophobicContact CD1-CG 4.35Å; D27-M64 HydrophobicContact CB-CE 4.06Å; D27-M64 HydrophobicContact CB-CG 4.05Å; D27-M64 HydrophobicContact CB-SD 3.82Å; I34-M64 HydrophobicContact CG2-CE 4.23Å; R60-M64 WeakPolarHBondContact O-CG 3.26Å; R60-M64 PolarHBondContact O-N 2.94Å; K61-M64 PolarHBondContact O-N 2.04Å; M64-Y66 VanDerWaalsContact C-N 3.32Å; M64-Y66 PolarHBondContact O-N 2.81Å; M64-K67 PolarHBondContact O-N 2.92Å; M64-L68 WeakPolarHBondContact O-CB 3.43Å; M64-L68 PolarHBondContact O-N 3.03Å
65	A	71.8	Confident	70.9	Confident	64 Å²	64	79.1 Å²	79.1	53%	0.529	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-38.5	177.2	0	0	0	0	0	112.4	K61 R62 L68 G69	K61-A65 PolarHBondContact O-N 2.85Å; R62-A65 PolarHBondContact O-N 2.89Å; A65-L68 PolarHBondContact O-N 2.71Å; A65-G69 PolarHBondContact O-N 3.41Å
66	Y	73.1	Confident	70.1	Confident	147 Å²	147	83.6 Å²	83.6	58%	0.576	41%	0.413	S	S	*	.	H	α-helix	trans	-65	-48.5	176.1	-177	-93.4	0	0	0	111.6	R62 G63 M64 L68 G69 E70	R62-Y66 WeakPolarHBondContact O-CB 3.46Å; R62-Y66 PolarHBondContact O-N 2.99Å; G63-Y66 PolarHBondContact O-N 2.77Å; M64-Y66 VanDerWaalsContact C-N 3.32Å; M64-Y66 PolarHBondContact O-N 2.81Å; Y66-L68 VanDerWaalsContact C-N 3.3Å; Y66-L68 PolarHBondContact O-N 3.11Å; Y66-G69 PolarHBondContact O-N 3.04Å; Y66-G69 VanDerWaalsContact O-N 3.15Å; Y66-E70 HydrophobicContact CD1-CG 4.01Å; Y66-E70 HydrophobicContact CE1-CG 3.51Å; Y66-E70 HydrophobicContact CE2-CG 4.38Å; Y66-E70 WeakPolarHBondContact O-CG 3.41Å; Y66-E70 PolarHBondContact O-N 3.28Å
67	K	70.8	Confident	69.9	Low	98 Å²	98	84.7 Å²	84.7	43%	0.426	42%	0.417	S	S	.	.	H	α-helix	trans	-55.8	-47.8	175.3	-73.2	177.1	-177.9	178.1	0	110.5	L18 D27 G63 M64 G69 E70 I71	L18-K67 HydrophobicContact CD1-CB 4.35Å; L18-K67 HydrophobicContact CD1-CD 4.38Å; D27-K67 IonicContact OD1-NZ 2.75Å; G63-K67 WeakPolarHBondContact O-CG 3.45Å; G63-K67 PolarHBondContact O-N 2.91Å; M64-K67 PolarHBondContact O-N 2.92Å; K67-G69 PolarHBondContact O-N 3.01Å; K67-E70 PolarHBondContact O-N 2.96Å; K67-I71 VanDerWaalsContact O-CD1 3.26Å; K67-I71 WeakPolarHBondContact O-CD1 3.05Å; K67-I71 VanDerWaalsContact O-CG1 3.31Å; K67-I71 WeakPolarHBondContact O-CG1 3.07Å; K67-I71 PolarHBondContact O-N 3.4Å; K67-I71 VanDerWaalsContact O-N 3.14Å
68	L	68.6	Low	69.8	Low	66 Å²	66	88.6 Å²	88.6	35%	0.346	44%	0.436	S	S	.	.	H	α-helix	trans	-58.2	-46.7	176.5	-176.2	63.2	0	0	0	111.8	L11 L18 M64 A65 Y66 E70 I71 L72	L11-L68 HydrophobicContact CD1-CD1 4.26Å; L11-L68 HydrophobicContact CD2-CD1 4.36Å; L18-L68 HydrophobicContact CD2-CB 4.03Å; L18-L68 HydrophobicContact CD2-CD1 4.18Å; M64-L68 WeakPolarHBondContact O-CB 3.43Å; M64-L68 PolarHBondContact O-N 3.03Å; A65-L68 PolarHBondContact O-N 2.71Å; Y66-L68 VanDerWaalsContact C-N 3.3Å; Y66-L68 PolarHBondContact O-N 3.11Å; L68-E70 PolarHBondContact O-N 2.98Å; L68-I71 PolarHBondContact O-N 3.47Å; L68-L72 HydrophobicContact CG-CD1 4.13Å; L68-L72 HydrophobicContact CG-CG 4.49Å; L68-L72 WeakPolarHBondContact O-CG 3.26Å; L68-L72 PolarHBondContact O-N 3.5Å
69	G	69.5	Low	69.7	Low	28 Å²	28	86.8 Å²	86.8	29%	0.289	43%	0.431	S	S	.	.	H	α-helix	trans	-60.9	-42.1	178.1	0	0	0	0	0	113.3	A65 Y66 K67 I71 L72 K73	A65-G69 PolarHBondContact O-N 3.41Å; Y66-G69 PolarHBondContact O-N 3.04Å; Y66-G69 VanDerWaalsContact O-N 3.15Å; K67-G69 PolarHBondContact O-N 3.01Å; G69-I71 VanDerWaalsContact C-N 3.28Å; G69-I71 PolarHBondContact O-N 3.4Å; G69-L72 PolarHBondContact O-N 3.14Å; G69-K73 WeakPolarHBondContact O-CG 3.4Å; G69-K73 PolarHBondContact O-N 3.1Å; G69-K73 VanDerWaalsContact O-N 3.11Å
70	E	72.4	Confident	69.4	Low	67 Å²	67	86.5 Å²	86.5	31%	0.313	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-33.1	176.7	-71.9	-70.4	97.9	0	0	112.5	Y66 K67 L68 K73 K74	Y66-E70 HydrophobicContact CD1-CG 4.01Å; Y66-E70 HydrophobicContact CE1-CG 3.51Å; Y66-E70 HydrophobicContact CE2-CG 4.38Å; Y66-E70 WeakPolarHBondContact O-CG 3.41Å; Y66-E70 PolarHBondContact O-N 3.28Å; K67-E70 PolarHBondContact O-N 2.96Å; L68-E70 PolarHBondContact O-N 2.98Å; E70-K73 WeakPolarHBondContact O-CB 3.37Å; E70-K73 IonicContact OE1-NZ 2.92Å; E70-K73 PolarHBondContact OE1-NZ 2.78Å; E70-K74 PolarHBondContact O-N 2.64Å
71	I	65.7	Low	69.1	Low	22 Å²	22	91.1 Å²	91.1	11%	0.113	45%	0.451	C	S	.	.	H	α-helix	trans	-80.1	-38.8	178.7	-60.5	153.4	0	0	0	111.4	L11 L15 K67 L68 G69 K73 K74 L75	L11-I71 HydrophobicContact CD2-CB 3.99Å; L11-I71 HydrophobicContact CD2-CD1 4.28Å; L11-I71 HydrophobicContact CD2-CG2 3.35Å; L15-I71 HydrophobicContact CD1-CD1 3.22Å; L15-I71 HydrophobicContact CD1-CG1 4.34Å; L15-I71 HydrophobicContact CD2-CD1 3.34Å; L15-I71 HydrophobicContact CG-CD1 3.74Å; K67-I71 VanDerWaalsContact O-CD1 3.26Å; K67-I71 WeakPolarHBondContact O-CD1 3.05Å; K67-I71 VanDerWaalsContact O-CG1 3.31Å; K67-I71 WeakPolarHBondContact O-CG1 3.07Å; K67-I71 PolarHBondContact O-N 3.4Å; K67-I71 VanDerWaalsContact O-N 3.14Å; L68-I71 PolarHBondContact O-N 3.47Å; G69-I71 VanDerWaalsContact C-N 3.28Å; G69-I71 PolarHBondContact O-N 3.4Å; I71-K73 PolarHBondContact O-N 2.96Å; I71-K74 WeakPolarHBondContact O-CA 3.4Å; I71-K74 WeakPolarHBondContact O-CB 3.1Å; I71-K74 PolarHBondContact O-N 2.89Å; I71-L75 HydrophobicContact CG2-CD1 4.35Å; I71-L75 HydrophobicContact CG2-CG 4.5Å; I71-L75 PolarHBondContact O-N 2.97Å
72	L	65.4	Low	68.9	Low	94 Å²	94	92 Å²	92	49%	0.492	46%	0.459	S	S	.	.	H	α-helix	trans	-56.9	-34	171.8	-72.5	172.8	0	0	0	111.4	L68 G69 L75 N76	L68-L72 HydrophobicContact CG-CD1 4.13Å; L68-L72 HydrophobicContact CG-CG 4.49Å; L68-L72 WeakPolarHBondContact O-CG 3.26Å; L68-L72 PolarHBondContact O-N 3.5Å; G69-L72 PolarHBondContact O-N 3.14Å; L72-L75 PolarHBondContact O-N 3.27Å; L72-N76 PolarHBondContact O-N 2.82Å
73	K	70.7	Confident	68.5	Low	140 Å²	140	86.6 Å²	86.6	61%	0.609	45%	0.447	S	S	*	.	H	α-helix	trans	-66.7	-32	171.1	-71.2	175.1	-172.7	169.5	0	113.9	G69 E70 I71	G69-K73 WeakPolarHBondContact O-CG 3.4Å; G69-K73 PolarHBondContact O-N 3.1Å; G69-K73 VanDerWaalsContact O-N 3.11Å; E70-K73 WeakPolarHBondContact O-CB 3.37Å; E70-K73 IonicContact OE1-NZ 2.92Å; E70-K73 PolarHBondContact OE1-NZ 2.78Å; I71-K73 PolarHBondContact O-N 2.96Å
74	K	65.8	Low	68	Low	173 Å²	173	91 Å²	91	75%	0.752	46%	0.458	S	S	*	.	H	α-helix	trans	-77.6	-26.5	177.5	-69.2	-176.8	-176.2	-177	0	112.9	E70 I71 N76	E70-K74 PolarHBondContact O-N 2.64Å; I71-K74 WeakPolarHBondContact O-CA 3.4Å; I71-K74 WeakPolarHBondContact O-CB 3.1Å; I71-K74 PolarHBondContact O-N 2.89Å; K74-N76 VanDerWaalsContact C-N 3.3Å
75	L	63.4	Low	67.7	Low	71 Å²	71	97.4 Å²	97.4	37%	0.372	49%	0.49	S	S	.	.	H	α-helix	trans	-78.1	-15.3	177.6	-74.1	171	0	0	0	113.2	L11 I71 L72	L11-L75 HydrophobicContact CD1-CD1 4.43Å; L11-L75 HydrophobicContact CD2-CD1 4.47Å; L11-L75 HydrophobicContact CG-CD1 4.28Å; I71-L75 HydrophobicContact CG2-CD1 4.35Å; I71-L75 HydrophobicContact CG2-CG 4.5Å; I71-L75 PolarHBondContact O-N 2.97Å; L72-L75 PolarHBondContact O-N 3.27Å
76	N	55.3	Low	67.3	Low	199 Å²	199	100.5 Å²	100.5	100%	1.064	49%	0.487	S	S	*	.			trans	-102.2	0	-177.9	-154.1	74.9	0	0	0	111.1	L72 K74	L72-N76 PolarHBondContact O-N 2.82Å; K74-N76 VanDerWaalsContact C-N 3.3Å

Retrieved 76 of 76 residues in 49.3 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).