A0A3Q0KND3_SCHMA Loading...

Protein shisa-5

AlphaFold DB , UniProt , Accession A0A3Q0KND3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 188 aa.

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	51.6	Low	62.2	Low	225 Å²	225	124.6 Å²	124.6	100%	1.108	67%	0.665	S	S	*	*				0	46.2	0	-159.3	169.4	172.7	0	0	111.1
2	F	54.4	Low	64	Low	180 Å²	180	117.2 Å²	117.2	79%	0.789	64%	0.64	S	S	*	*			trans	-124.5	-9.7	-177.1	-84.8	-80.4	0	0	0	113.6	Y4	F2-Y4 VanDerWaalsContact C-N 3.34Å; F2-Y4 PolarHBondContact O-N 3.09Å
3	S	52.4	Low	65.9	Low	101 Å²	101	114.8 Å²	114.8	71%	0.706	63%	0.631	S	S	*	*	H	α-helix	trans	-74.9	-17.6	-173.4	-45.8	0	0	0	0	114.8	T7	S3-T7 PolarHBondContact O-OG1 2.78Å
4	Y	54.7	Low	67.4	Low	198 Å²	198	114.3 Å²	114.3	78%	0.776	63%	0.626	S	S	*	*	H	α-helix	trans	-80.7	-20.8	179.2	-72	-78.4	0	0	0	113.8	F2 T7 G8	F2-Y4 VanDerWaalsContact C-N 3.34Å; F2-Y4 PolarHBondContact O-N 3.09Å; Y4-T7 PolarHBondContact O-OG1 3.37Å; Y4-G8 PolarHBondContact O-N 3.09Å
5	W	53.5	Low	68.7	Low	222 Å²	222	110.3 Å²	110.3	84%	0.841	61%	0.614	S	S	*	*	H	α-helix	trans	-80.5	-30.4	-179.5	-77.9	41.3	0	0	0	111.7	G8 A9	W5-G8 PolarHBondContact O-N 3.27Å; W5-A9 PolarHBondContact O-N 2.9Å
6	A	57	Low	70	Confident	69 Å²	69	111 Å²	111	57%	0.57	62%	0.615	S	S	*	*	H	α-helix	trans	-66.6	-39.6	176.6	0	0	0	0	0	112.3
7	T	62	Low	71.2	Confident	75 Å²	75	110.3 Å²	110.3	46%	0.46	61%	0.609	S	S	.	*	H	α-helix	trans	-74.2	-28.7	177.1	30.3	0	0	0	0	113.2	S3 Y4 T10 L11	S3-T7 PolarHBondContact O-OG1 2.78Å; Y4-T7 PolarHBondContact O-OG1 3.37Å; T7-T10 WeakPolarHBondContact CA-OG1 3.3Å; T7-T10 PolarHBondContact O-N 3.39Å; T7-T10 PolarHBondContact O-OG1 3.12Å; T7-L11 VanDerWaalsContact O-CG 3.31Å; T7-L11 WeakPolarHBondContact O-CG 3.44Å; T7-L11 PolarHBondContact O-N 3.1Å; T7-L11 VanDerWaalsContact O-N 3.09Å
8	G	65.2	Low	72.2	Confident	44 Å²	44	109.7 Å²	109.7	45%	0.454	60%	0.604	S	S	.	*	H	α-helix	trans	-62.6	-43.8	175.4	0	0	0	0	0	112.6	Y4 W5 L11 G12	Y4-G8 PolarHBondContact O-N 3.09Å; W5-G8 PolarHBondContact O-N 3.27Å; G8-L11 PolarHBondContact O-N 3.28Å; G8-G12 PolarHBondContact O-N 3Å; G8-G12 VanDerWaalsContact O-N 3.08Å
9	A	74	Confident	73.2	Confident	65 Å²	65	109 Å²	109	54%	0.537	60%	0.603	S	S	.	*	H	α-helix	trans	-64.7	-42	178.2	0	0	0	0	0	112.1	W5 L11 G12 V13	W5-A9 PolarHBondContact O-N 2.9Å; A9-L11 PolarHBondContact O-N 2.77Å; A9-G12 PolarHBondContact O-N 3.03Å; A9-V13 WeakPolarHBondContact O-CG2 3.39Å; A9-V13 PolarHBondContact O-N 2.82Å
10	T	79.1	Confident	74	Confident	75 Å²	75	108.3 Å²	108.3	46%	0.46	60%	0.598	S	S	.	*	H	α-helix	trans	-66.6	-38.7	179.1	56.1	0	0	0	0	112	T7 V13 L14	T7-T10 WeakPolarHBondContact CA-OG1 3.3Å; T7-T10 PolarHBondContact O-N 3.39Å; T7-T10 PolarHBondContact O-OG1 3.12Å; T10-V13 PolarHBondContact O-N 3.25Å; T10-L14 WeakPolarHBondContact O-CB 2.92Å; T10-L14 VanDerWaalsContact O-CG 3.23Å; T10-L14 WeakPolarHBondContact O-CG 3.38Å; T10-L14 PolarHBondContact O-N 3.12Å
11	L	79.9	Confident	74.7	Confident	117 Å²	117	109 Å²	109	61%	0.613	60%	0.595	S	S	*	*	H	α-helix	trans	-65.5	-39.4	176	-70.8	174.3	0	0	0	111.8	T7 G8 A9 L14 A15	T7-L11 VanDerWaalsContact O-CG 3.31Å; T7-L11 WeakPolarHBondContact O-CG 3.44Å; T7-L11 PolarHBondContact O-N 3.1Å; T7-L11 VanDerWaalsContact O-N 3.09Å; G8-L11 PolarHBondContact O-N 3.28Å; A9-L11 PolarHBondContact O-N 2.77Å; L11-L14 PolarHBondContact O-N 3.44Å; L11-A15 WeakPolarHBondContact O-CB 3.47Å; L11-A15 PolarHBondContact O-N 3.29Å
12	G	84.8	Confident	76.4	Confident	35 Å²	35	102.5 Å²	102.5	36%	0.361	56%	0.564	S	S	.	*	H	α-helix	trans	-62.7	-45.9	175	0	0	0	0	0	112.5	G8 A9 A15 I16	G8-G12 PolarHBondContact O-N 3Å; G8-G12 VanDerWaalsContact O-N 3.08Å; A9-G12 PolarHBondContact O-N 3.03Å; G12-A15 PolarHBondContact O-N 3.29Å; G12-I16 WeakPolarHBondContact O-CG1 3.5Å; G12-I16 PolarHBondContact O-N 3.21Å
13	V	88.1	Confident	77.8	Confident	86 Å²	86	98.7 Å²	98.7	52%	0.521	55%	0.552	S	S	.	*	H	α-helix	trans	-63	-44.2	177	175	0	0	0	0	111	A9 T10 A15 I16 L17	A9-V13 WeakPolarHBondContact O-CG2 3.39Å; A9-V13 PolarHBondContact O-N 2.82Å; T10-V13 PolarHBondContact O-N 3.25Å; V13-A15 VanDerWaalsContact C-N 3.33Å; V13-A15 PolarHBondContact O-N 3.01Å; V13-I16 PolarHBondContact O-N 3.09Å; V13-L17 HydrophobicContact CG1-CD1 4.03Å; V13-L17 HydrophobicContact CG1-CG 4.41Å; V13-L17 WeakPolarHBondContact O-CB 3.19Å; V13-L17 WeakPolarHBondContact O-CG 3.39Å; V13-L17 PolarHBondContact O-N 2.94Å
14	L	86.8	Confident	79.2	Confident	108 Å²	108	98.1 Å²	98.1	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-62.3	-39.7	176.7	-72	173.4	0	0	0	112.1	T10 L11 L17 L18	T10-L14 WeakPolarHBondContact O-CB 2.92Å; T10-L14 VanDerWaalsContact O-CG 3.23Å; T10-L14 WeakPolarHBondContact O-CG 3.38Å; T10-L14 PolarHBondContact O-N 3.12Å; L11-L14 PolarHBondContact O-N 3.44Å; L14-L17 PolarHBondContact O-N 2.97Å; L14-L18 WeakPolarHBondContact O-CB 3.01Å; L14-L18 PolarHBondContact O-N 2.74Å
15	A	87.3	Confident	80.4	Confident	54 Å²	54	93.3 Å²	93.3	45%	0.446	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-44.2	176.3	0	0	0	0	0	112	L11 G12 V13 L18 V19	L11-A15 WeakPolarHBondContact O-CB 3.47Å; L11-A15 PolarHBondContact O-N 3.29Å; G12-A15 PolarHBondContact O-N 3.29Å; V13-A15 VanDerWaalsContact C-N 3.33Å; V13-A15 PolarHBondContact O-N 3.01Å; A15-L18 PolarHBondContact O-N 2.97Å; A15-V19 WeakPolarHBondContact O-CG2 3.34Å; A15-V19 PolarHBondContact O-N 2.82Å
16	I	88.8	Confident	81.7	Confident	122 Å²	122	87.8 Å²	87.8	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-63.3	-43.8	177	-65.3	164.9	0	0	0	110.7	G12 V13 L18 V19 L20	G12-I16 WeakPolarHBondContact O-CG1 3.5Å; G12-I16 PolarHBondContact O-N 3.21Å; V13-I16 PolarHBondContact O-N 3.09Å; I16-L18 VanDerWaalsContact C-N 3.32Å; I16-L18 PolarHBondContact O-N 2.76Å; I16-V19 PolarHBondContact O-N 2.8Å; I16-L20 WeakPolarHBondContact O-CB 3.28Å; I16-L20 PolarHBondContact O-N 2.75Å
17	L	90.1	Very high	82.2	Confident	99 Å²	99	88.1 Å²	88.1	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-40	176.2	-72.9	173.8	0	0	0	111.9	V13 L14 L20 F21	V13-L17 HydrophobicContact CG1-CD1 4.03Å; V13-L17 HydrophobicContact CG1-CG 4.41Å; V13-L17 WeakPolarHBondContact O-CB 3.19Å; V13-L17 WeakPolarHBondContact O-CG 3.39Å; V13-L17 PolarHBondContact O-N 2.94Å; L14-L17 PolarHBondContact O-N 2.97Å; L17-L20 PolarHBondContact O-N 3.37Å; L17-F21 VanDerWaalsContact O-CB 3.27Å; L17-F21 WeakPolarHBondContact O-CB 3.3Å; L17-F21 PolarHBondContact O-N 2.84Å
18	L	90	Very high	82.3	Confident	100 Å²	100	88 Å²	88	52%	0.524	51%	0.514	S	S	.	.	H	α-helix	trans	-65.9	-45	177.4	-149.8	-174.2	0	0	0	111	L14 A15 I16 L20 F21 L22	L14-L18 WeakPolarHBondContact O-CB 3.01Å; L14-L18 PolarHBondContact O-N 2.74Å; A15-L18 PolarHBondContact O-N 2.97Å; I16-L18 VanDerWaalsContact C-N 3.32Å; I16-L18 PolarHBondContact O-N 2.76Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L18-L20 PolarHBondContact O-N 2.92Å; L18-F21 PolarHBondContact O-N 3.15Å; L18-L22 HydrophobicContact CD2-CD1 3.59Å; L18-L22 HydrophobicContact CD2-CD2 4.43Å; L18-L22 HydrophobicContact CD2-CG 3.65Å; L18-L22 WeakPolarHBondContact O-CG 3.45Å; L18-L22 PolarHBondContact O-N 3.26Å
19	V	91.5	Very high	82.2	Confident	96 Å²	96	94.5 Å²	94.5	58%	0.582	53%	0.525	S	S	*	.	H	α-helix	trans	-61	-43.9	176.2	172.5	0	0	0	0	110.9	A15 I16 F21 L22 L23	A15-V19 WeakPolarHBondContact O-CG2 3.34Å; A15-V19 PolarHBondContact O-N 2.82Å; I16-V19 PolarHBondContact O-N 2.8Å; V19-F21 VanDerWaalsContact C-N 3.34Å; V19-F21 PolarHBondContact O-N 2.96Å; V19-L22 PolarHBondContact O-N 3.49Å; V19-L23 WeakPolarHBondContact O-CB 3.15Å; V19-L23 PolarHBondContact O-N 2.94Å
20	L	89.3	Confident	81.3	Confident	95 Å²	95	98.4 Å²	98.4	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-62.2	-42.4	176	-174.9	69.8	0	0	0	111.6	I16 L17 L18 L23 L24	I16-L20 WeakPolarHBondContact O-CB 3.28Å; I16-L20 PolarHBondContact O-N 2.75Å; L17-L20 PolarHBondContact O-N 3.37Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L18-L20 PolarHBondContact O-N 2.92Å; L20-L23 PolarHBondContact O-N 3.27Å; L20-L24 HydrophobicContact CG-CD1 4.47Å; L20-L24 WeakPolarHBondContact O-CG 3.12Å; L20-L24 PolarHBondContact O-N 2.58Å
21	F	87.9	Confident	80.1	Confident	123 Å²	123	101 Å²	101	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-64.7	-43.7	178.1	-175.3	-103.1	0	0	0	112.2	L17 L18 V19 L23 L24 L25	L17-F21 VanDerWaalsContact O-CB 3.27Å; L17-F21 WeakPolarHBondContact O-CB 3.3Å; L17-F21 PolarHBondContact O-N 2.84Å; L18-F21 PolarHBondContact O-N 3.15Å; V19-F21 VanDerWaalsContact C-N 3.34Å; V19-F21 PolarHBondContact O-N 2.96Å; F21-L23 VanDerWaalsContact C-N 3.32Å; F21-L23 PolarHBondContact O-N 3.44Å; F21-L24 PolarHBondContact O-N 3.28Å; F21-L25 HydrophobicContact CD1-CD1 3.69Å; F21-L25 HydrophobicContact CD1-CG 4.45Å; F21-L25 HydrophobicContact CE1-CD1 3.28Å; F21-L25 HydrophobicContact CE1-CG 4.16Å; F21-L25 HydrophobicContact CZ-CD1 3.85Å; F21-L25 HydrophobicContact CZ-CG 4.35Å; F21-L25 WeakPolarHBondContact O-CG 3.35Å; F21-L25 PolarHBondContact O-N 3.29Å
22	L	86.8	Confident	78.8	Confident	89 Å²	89	97.3 Å²	97.3	47%	0.466	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-38.4	173.4	-73.3	176.1	0	0	0	111.7	L18 V19 L25 C26	L18-L22 HydrophobicContact CD2-CD1 3.59Å; L18-L22 HydrophobicContact CD2-CD2 4.43Å; L18-L22 HydrophobicContact CD2-CG 3.65Å; L18-L22 WeakPolarHBondContact O-CG 3.45Å; L18-L22 PolarHBondContact O-N 3.26Å; V19-L22 PolarHBondContact O-N 3.49Å; L22-L25 PolarHBondContact O-N 3.02Å; L22-C26 WeakPolarHBondContact O-CB 3.5Å; L22-C26 PolarHBondContact O-N 3.36Å; L22-C26 PolarHBondContact O-SG 3.27Å
23	L	84.8	Confident	77.1	Confident	99 Å²	99	102 Å²	102	52%	0.518	54%	0.542	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.3	-166.6	142.5	0	0	0	110.1	V19 L20 F21 L25 C26 L27	V19-L23 WeakPolarHBondContact O-CB 3.15Å; V19-L23 PolarHBondContact O-N 2.94Å; L20-L23 PolarHBondContact O-N 3.27Å; F21-L23 VanDerWaalsContact C-N 3.32Å; F21-L23 PolarHBondContact O-N 3.44Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.44Å; L23-C26 CarbonylContact O-C 3.52Å; L23-C26 PolarHBondContact O-N 2.94Å; L23-L27 HydrophobicContact CD2-CD1 3.42Å; L23-L27 VanDerWaalsContact CD2-CD1 3.42Å; L23-L27 HydrophobicContact CG-CD1 4.21Å; L23-L27 WeakPolarHBondContact O-CD1 3.23Å; L23-L27 PolarHBondContact O-N 2.7Å
24	L	82.3	Confident	75.4	Confident	90 Å²	90	105.4 Å²	105.4	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-61.5	-34.6	174.6	-72.3	170.1	0	0	0	113.9	L20 F21 W29	L20-L24 HydrophobicContact CG-CD1 4.47Å; L20-L24 WeakPolarHBondContact O-CG 3.12Å; L20-L24 PolarHBondContact O-N 2.58Å; F21-L24 PolarHBondContact O-N 3.28Å; L24-W29 PolarHBondContact O-NE1 2.78Å
25	L	80.1	Confident	73.7	Confident	97 Å²	97	107.7 Å²	107.7	51%	0.508	55%	0.547	S	S	.	.	H	α-helix	trans	-75.5	-36.9	174.7	-75.9	172.5	0	0	0	112.7	F21 L22 L23 L27	F21-L25 HydrophobicContact CD1-CD1 3.69Å; F21-L25 HydrophobicContact CD1-CG 4.45Å; F21-L25 HydrophobicContact CE1-CD1 3.28Å; F21-L25 HydrophobicContact CE1-CG 4.16Å; F21-L25 HydrophobicContact CZ-CD1 3.85Å; F21-L25 HydrophobicContact CZ-CG 4.35Å; F21-L25 WeakPolarHBondContact O-CG 3.35Å; F21-L25 PolarHBondContact O-N 3.29Å; L22-L25 PolarHBondContact O-N 3.02Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.44Å; L25-L27 VanDerWaalsContact C-N 3.32Å
26	C	79.1	Confident	71.8	Confident	106 Å²	106	108.7 Å²	108.7	72%	0.716	55%	0.55	S	S	*	*	H	α-helix	trans	-77.1	-18	176.6	-74	0	0	0	0	112.7	L22 L23	L22-C26 WeakPolarHBondContact O-CB 3.5Å; L22-C26 PolarHBondContact O-N 3.36Å; L22-C26 PolarHBondContact O-SG 3.27Å; L23-C26 CarbonylContact O-C 3.52Å; L23-C26 PolarHBondContact O-N 2.94Å
27	L	67.9	Low	69.9	Low	75 Å²	75	106.6 Å²	106.6	39%	0.393	55%	0.547	S	S	.	.	S	Bend	trans	-55.4	128.2	165.8	-100.2	87.3	0	0	0	106.9	L23 L25 W29	L23-L27 HydrophobicContact CD2-CD1 3.42Å; L23-L27 VanDerWaalsContact CD2-CD1 3.42Å; L23-L27 HydrophobicContact CG-CD1 4.21Å; L23-L27 WeakPolarHBondContact O-CD1 3.23Å; L23-L27 PolarHBondContact O-N 2.7Å; L25-L27 VanDerWaalsContact C-N 3.32Å; L27-W29 VanDerWaalsContact C-N 3.28Å; L27-W29 PolarHBondContact O-N 3.36Å
28	P	65.4	Low	68	Low	73 Å²	73	105.1 Å²	105.1	47%	0.474	54%	0.544	S	S	.	.			trans	-66.7	90.9	-176.3	26.4	-33.6	0	0	0	109.1	N30 K31 C32	P28-N30 PolarHBondContact O-N 3.39Å; P28-N30 VanDerWaalsContact O-N 3.08Å; P28-K31 HydrophobicContact CG-CB 4.45Å; P28-K31 PolarHBondContact O-N 3.28Å; P28-C32 PolarHBondContact O-N 2.81Å; P28-C32 VanDerWaalsContact O-N 3.13Å; P28-C32 PolarHBondContact O-SG 3.04Å
29	W	61.4	Low	66.2	Low	181 Å²	181	103.9 Å²	103.9	69%	0.686	54%	0.543	S	S	*	.	H	α-helix	trans	-55	-25.7	170.6	-76.2	79.5	0	0	0	111.1	L24 L27 K31 C32 D33	L24-W29 PolarHBondContact O-NE1 2.78Å; L27-W29 VanDerWaalsContact C-N 3.28Å; L27-W29 PolarHBondContact O-N 3.36Å; W29-K31 PolarHBondContact O-N 3.15Å; W29-C32 PolarHBondContact O-N 2.81Å; W29-C32 VanDerWaalsContact O-N 3.13Å; W29-D33 PolarHBondContact O-N 3.4Å
30	N	56.1	Low	64.3	Low	147 Å²	147	108.7 Å²	108.7	79%	0.786	55%	0.55	S	S	*	*	H	α-helix	trans	-51.9	-38.1	168	173.9	-19.5	0	0	0	112.9	P28	P28-N30 PolarHBondContact O-N 3.39Å; P28-N30 VanDerWaalsContact O-N 3.08Å
31	K	54.1	Low	62.4	Low	128 Å²	128	108 Å²	108	56%	0.557	55%	0.553	S	S	*	*	H	α-helix	trans	-94.9	-20.1	176.4	-68.1	-178.4	179.9	175.4	0	112.8	P28 W29 D33 R34 Y35	P28-K31 HydrophobicContact CG-CB 4.45Å; P28-K31 PolarHBondContact O-N 3.28Å; W29-K31 PolarHBondContact O-N 3.15Å; K31-D33 PolarHBondContact O-N 3.06Å; K31-R34 WeakPolarHBondContact O-CB 3.02Å; K31-R34 PolarHBondContact O-N 3.4Å; K31-R34 VanDerWaalsContact O-N 3.15Å; K31-Y35 HydrophobicContact CB-CE2 4.45Å; K31-Y35 VanDerWaalsContact O-CD2 3.27Å; K31-Y35 WeakPolarHBondContact O-CD2 3.18Å; K31-Y35 PolarHBondContact O-N 3.16Å
32	C	52.3	Low	60.5	Low	40 Å²	40	112 Å²	112	27%	0.27	56%	0.564	S	S	.	*	H	α-helix	trans	-69.9	-15.8	179.8	-64.5	0	0	0	0	113.7	P28 W29 R34 Y35 C36	P28-C32 PolarHBondContact O-N 2.81Å; P28-C32 VanDerWaalsContact O-N 3.13Å; P28-C32 PolarHBondContact O-SG 3.04Å; W29-C32 PolarHBondContact O-N 2.81Å; W29-C32 VanDerWaalsContact O-N 3.13Å; C32-R34 VanDerWaalsContact C-N 3.33Å; C32-Y35 PolarHBondContact O-N 3.11Å; C32-C36 WeakPolarHBondContact O-CA 3.22Å; C32-C36 WeakPolarHBondContact O-CB 3.36Å; C32-C36 PolarHBondContact O-N 3.37Å
33	D	50	Low	58.8	Low	133 Å²	133	114.7 Å²	114.7	71%	0.711	58%	0.578	S	S	*	*	H	α-helix	trans	-68.7	-35.8	170.2	-139.8	-8.4	0	0	0	111.3	W29 K31 S37	W29-D33 PolarHBondContact O-N 3.4Å; K31-D33 PolarHBondContact O-N 3.06Å; D33-S37 PolarHBondContact O-N 3.21Å
34	R	50.4	Low	57.1	Low	159 Å²	159	116.7 Å²	116.7	60%	0.6	58%	0.583	S	S	*	*	H	α-helix	trans	-68.5	-38.8	172.1	-68	-169.9	-169.5	-157.3	1.3	112.1	K31 C32 C38	K31-R34 WeakPolarHBondContact O-CB 3.02Å; K31-R34 PolarHBondContact O-N 3.4Å; K31-R34 VanDerWaalsContact O-N 3.15Å; C32-R34 VanDerWaalsContact C-N 3.33Å; R34-C38 PolarHBondContact O-N 3.43Å; R34-C38 PolarHBondContact O-SG 2.71Å
35	Y	51.5	Low	55.4	Low	155 Å²	155	115.1 Å²	115.1	61%	0.608	58%	0.58	S	S	*	*	H	α-helix	trans	-79.5	-26.3	177.4	-71.1	-76.8	0	0	0	113.7	K31 C32 C38 C39	K31-Y35 HydrophobicContact CB-CE2 4.45Å; K31-Y35 VanDerWaalsContact O-CD2 3.27Å; K31-Y35 WeakPolarHBondContact O-CD2 3.18Å; K31-Y35 PolarHBondContact O-N 3.16Å; C32-Y35 PolarHBondContact O-N 3.11Å; Y35-C38 CarbonylContact O-C 3.55Å; Y35-C38 PolarHBondContact O-N 3.43Å; Y35-C39 VanDerWaalsContact O-CB 3.28Å; Y35-C39 WeakPolarHBondContact O-CB 3.35Å; Y35-C39 PolarHBondContact O-N 2.87Å; Y35-C39 PolarHBondContact O-SG 3.42Å
36	C	48.1	Very low	54	Low	75 Å²	75	115.4 Å²	115.4	51%	0.507	59%	0.59	S	S	.	*	H	α-helix	trans	-73.9	-33.5	177.4	-160.5	0	0	0	0	110.9	C32 R40	C32-C36 WeakPolarHBondContact O-CA 3.22Å; C32-C36 WeakPolarHBondContact O-CB 3.36Å; C32-C36 PolarHBondContact O-N 3.37Å; C36-R40 WeakPolarHBondContact O-CB 3.33Å; C36-R40 PolarHBondContact O-N 3.43Å
37	S	49	Very low	52.6	Low	78 Å²	78	117.6 Å²	117.6	55%	0.545	59%	0.594	S	S	.	*	H	α-helix	trans	-65	-44.2	168.4	-155.4	0	0	0	0	111.4	D33 R40 C41	D33-S37 PolarHBondContact O-N 3.21Å; S37-R40 PolarHBondContact O-N 3.42Å; S37-C41 PolarHBondContact O-N 3.31Å; S37-C41 PolarHBondContact O-SG 3.05Å
38	C	50	Low	51.7	Low	68 Å²	68	117.9 Å²	117.9	46%	0.459	59%	0.594	S	S	.	*	H	α-helix	trans	-66.8	-40.4	174.9	-73.3	0	0	0	0	113.4	R34 Y35 C41 W42	R34-C38 PolarHBondContact O-N 3.43Å; R34-C38 PolarHBondContact O-SG 2.71Å; Y35-C38 CarbonylContact O-C 3.55Å; Y35-C38 PolarHBondContact O-N 3.43Å; C38-C41 CarbonylContact O-C 3.6Å; C38-C41 WeakPolarHBondContact O-CB 3.46Å; C38-C41 PolarHBondContact O-N 3.25Å; C38-W42 VanDerWaalsContact O-CD1 3.24Å; C38-W42 PolarHBondContact O-N 3.21Å
39	C	52.7	Low	50.7	Low	74 Å²	74	120.9 Å²	120.9	50%	0.5	61%	0.606	S	S	.	*	H	α-helix	trans	-70.6	-33.2	178.7	-75.6	0	0	0	0	111.6	Y35 W42 L43	Y35-C39 VanDerWaalsContact O-CB 3.28Å; Y35-C39 WeakPolarHBondContact O-CB 3.35Å; Y35-C39 PolarHBondContact O-N 2.87Å; Y35-C39 PolarHBondContact O-SG 3.42Å; C39-W42 PolarHBondContact O-N 3.18Å; C39-L43 WeakPolarHBondContact O-CB 3.43Å; C39-L43 PolarHBondContact O-N 2.83Å
40	R	51	Low	50.3	Low	197 Å²	197	119.3 Å²	119.3	74%	0.743	61%	0.61	S	S	*	*	H	α-helix	trans	-65.9	-38	168.6	-93.8	-169.2	164.9	175.7	-2.5	112.2	C36 S37 F44	C36-R40 WeakPolarHBondContact O-CB 3.33Å; C36-R40 PolarHBondContact O-N 3.43Å; S37-R40 PolarHBondContact O-N 3.42Å; R40-F44 PolarHBondContact O-N 3.45Å
41	C	49.1	Very low	50.1	Low	82 Å²	82	120.6 Å²	120.6	55%	0.554	61%	0.61	S	S	*	*	H	α-helix	trans	-65.3	-40.2	172.5	-68.1	0	0	0	0	112	S37 C38 S45	S37-C41 PolarHBondContact O-N 3.31Å; S37-C41 PolarHBondContact O-SG 3.05Å; C38-C41 CarbonylContact O-C 3.6Å; C38-C41 WeakPolarHBondContact O-CB 3.46Å; C38-C41 PolarHBondContact O-N 3.25Å; C41-S45 WeakPolarHBondContact O-CB 3.28Å; C41-S45 PolarHBondContact O-N 2.88Å
42	W	48.1	Very low	49.9	Very low	206 Å²	206	124 Å²	124	78%	0.78	62%	0.62	S	S	*	*	H	α-helix	trans	-72.7	-36.9	178.3	-87	93.1	0	0	0	113.6	C38 C39 S46	C38-W42 VanDerWaalsContact O-CD1 3.24Å; C38-W42 PolarHBondContact O-N 3.21Å; C39-W42 PolarHBondContact O-N 3.18Å; W42-S46 PolarHBondContact O-N 2.85Å
43	L	51.1	Low	49.8	Very low	145 Å²	145	131.7 Å²	131.7	76%	0.759	65%	0.652	S	S	*	*	H	α-helix	trans	-71.5	-30	178.2	-117.8	132.2	0	0	0	112.8	C39	C39-L43 WeakPolarHBondContact O-CB 3.43Å; C39-L43 PolarHBondContact O-N 2.83Å
44	F	49.3	Very low	50	Low	141 Å²	141	129.8 Å²	129.8	62%	0.618	65%	0.649	S	S	*	*	H	α-helix	trans	-83.3	-37.7	172	-105.9	-83	0	0	0	112	R40 S46 N47 E48	R40-F44 PolarHBondContact O-N 3.45Å; F44-S46 PolarHBondContact O-N 2.83Å; F44-N47 PolarHBondContact O-N 3.38Å; F44-E48 WeakPolarHBondContact CB-OE1 3.12Å; F44-E48 WeakPolarHBondContact CD1-OE1 3.06Å; F44-E48 WeakPolarHBondContact O-CG 3.43Å
45	S	47.4	Very low	50.2	Low	57 Å²	57	128 Å²	128	40%	0.399	65%	0.651	S	S	.	*	H	α-helix	trans	-62.2	-20.9	-179.6	-169.1	0	0	0	0	113.9	C41 N47 N49	C41-S45 WeakPolarHBondContact O-CB 3.28Å; C41-S45 PolarHBondContact O-N 2.88Å; S45-N47 VanDerWaalsContact C-N 3.3Å; S45-N47 PolarHBondContact O-N 3.36Å; S45-N49 PolarHBondContact O-ND2 3.25Å
46	S	50.4	Low	50.4	Low	103 Å²	103	125.4 Å²	125.4	72%	0.72	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-7.7	175.9	-168.5	0	0	0	0	114.7	W42 F44	W42-S46 PolarHBondContact O-N 2.85Å; F44-S46 PolarHBondContact O-N 2.83Å
47	N	50.1	Low	50.8	Low	152 Å²	152	126 Å²	126	81%	0.813	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	-5.9	-176.8	-149.7	-84	0	0	0	115	F44 S45	F44-N47 PolarHBondContact O-N 3.38Å; S45-N47 VanDerWaalsContact C-N 3.3Å; S45-N47 PolarHBondContact O-N 3.36Å
48	E	49	Very low	51	Low	82 Å²	82	129.3 Å²	129.3	38%	0.383	66%	0.663	S	S	.	*			trans	-131.9	46.3	-174.6	45.2	168.8	162	0	0	113.3	F44 I50	F44-E48 WeakPolarHBondContact CB-OE1 3.12Å; F44-E48 WeakPolarHBondContact CD1-OE1 3.06Å; F44-E48 WeakPolarHBondContact O-CG 3.43Å; E48-I50 VanDerWaalsContact C-N 3.29Å; E48-I50 PolarHBondContact O-N 3.39Å
49	N	44.4	Very low	51.1	Low	135 Å²	135	134 Å²	134	72%	0.722	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	29.6	178.6	-94	-48.2	0	0	0	114.9	S45	S45-N49 PolarHBondContact O-ND2 3.25Å
50	I	52.3	Low	51.2	Low	149 Å²	149	134.9 Å²	134.9	76%	0.764	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	-17.1	-179.8	-57.1	-175	0	0	0	113.8	E48	E48-I50 VanDerWaalsContact C-N 3.29Å; E48-I50 PolarHBondContact O-N 3.39Å
51	H	51	Low	51.1	Low	174 Å²	174	129.6 Å²	129.6	81%	0.806	68%	0.682	S	S	*	*	S	Bend	trans	-154.5	12.9	-172.2	-101.5	-57	0	0	0	120.7
52	R	51.5	Low	51.1	Low	198 Å²	198	134.7 Å²	134.7	75%	0.747	69%	0.69	S	S	*	*			trans	-120.1	19.5	-172.5	-94.9	-167.5	167.5	166.4	-2.6	117.9	S54	R52-S54 VanDerWaalsContact C-N 3.33Å; R52-S54 PolarHBondContact O-N 3.49Å; R52-S54 VanDerWaalsContact O-N 3.15Å
53	Q	49.7	Very low	51.2	Low	202 Å²	202	130 Å²	130	94%	0.944	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	4.1	-166.6	-156.2	171.3	6.9	0	0	117.1
54	S	53.6	Low	51.1	Low	93 Å²	93	128.1 Å²	128.1	65%	0.65	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	-15.1	-168.7	52.1	0	0	0	0	117.8	R52	R52-S54 VanDerWaalsContact C-N 3.33Å; R52-S54 PolarHBondContact O-N 3.49Å; R52-S54 VanDerWaalsContact O-N 3.15Å
55	D	55.5	Low	51.3	Low	123 Å²	123	125.1 Å²	125.1	66%	0.658	68%	0.683	S	S	*	*	S	Bend	trans	-108.6	-5.7	-166.1	-60.9	-22.2	0	0	0	115.3
56	D	55.2	Low	51.3	Low	99 Å²	99	128.5 Å²	128.5	53%	0.529	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-91.7	-9.1	-171.2	-70.5	-37.2	0	0	0	115.1	F58 R59 A60	D56-F58 PolarHBondContact O-N 2.96Å; D56-R59 PolarHBondContact O-N 3.4Å; D56-R59 VanDerWaalsContact O-N 3.16Å; D56-A60 PolarHBondContact O-N 3.23Å
57	A	55.8	Low	51.3	Low	87 Å²	87	133.3 Å²	133.3	72%	0.719	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-62	-27.6	176.8	0	0	0	0	0	112.8
58	F	52.8	Low	51.7	Low	149 Å²	149	131.7 Å²	131.7	65%	0.654	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-91.4	-11.7	178.9	-69	-83.9	0	0	0	114	D56 M71	D56-F58 PolarHBondContact O-N 2.96Å; F58-M71 HydrophobicContact CD1-CE 4.07Å; F58-M71 HydrophobicContact CE1-CE 3.57Å; F58-M71 HydrophobicContact CE1-SD 4.19Å; F58-M71 HydrophobicContact CZ-CE 4.46Å
59	R	53.9	Low	51.9	Low	166 Å²	166	134.8 Å²	134.8	63%	0.626	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-19.3	179.4	-73.3	-176.6	71.8	-164.6	3.7	113.3	D56 A61 R62	D56-R59 PolarHBondContact O-N 3.4Å; D56-R59 VanDerWaalsContact O-N 3.16Å; R59-A61 PolarHBondContact O-N 2.99Å; R59-R62 PolarHBondContact O-N 3Å
60	A	52.9	Low	52.5	Low	93 Å²	93	132 Å²	132	77%	0.769	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-15.4	-177.9	0	0	0	0	0	114.9	D56	D56-A60 PolarHBondContact O-N 3.23Å
61	A	49.5	Very low	52.8	Low	85 Å²	85	131 Å²	131	70%	0.702	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	1	179.1	0	0	0	0	0	114.5	R59 M63	R59-A61 PolarHBondContact O-N 2.99Å; A61-M63 VanDerWaalsContact C-N 3.34Å; A61-M63 PolarHBondContact O-N 2.73Å
62	R	50.2	Low	53.1	Low	190 Å²	190	130.1 Å²	130.1	72%	0.717	69%	0.687	S	S	*	*			trans	-82.5	76.9	179.2	-71.9	-168.3	176.8	114	-1.8	111.3	R59	R59-R62 PolarHBondContact O-N 3Å
63	M	49.2	Very low	53.3	Low	107 Å²	107	126.9 Å²	126.9	53%	0.527	69%	0.685	S	S	.	*			trans	-65.8	132.2	156.8	-70.4	-85.8	-166.1	0	0	108.3	A61 G65 E66	A61-M63 VanDerWaalsContact C-N 3.34Å; A61-M63 PolarHBondContact O-N 2.73Å; M63-G65 PolarHBondContact O-N 3.49Å; M63-E66 HydrophobicContact CB-CB 4.35Å; M63-E66 WeakPolarHBondContact CB-OE2 3.48Å; M63-E66 WeakPolarHBondContact CG-OE2 3.49Å; M63-E66 PolarHBondContact O-N 3.32Å
64	P	49.5	Very low	53.5	Low	106 Å²	106	126 Å²	126	69%	0.688	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	104.3	176.8	27.6	-30.9	0	0	0	108.8
65	G	54.2	Low	53.6	Low	78 Å²	78	124.9 Å²	124.9	80%	0.804	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	122.1	-4.1	177.1	0	0	0	0	0	116	M63	M63-G65 PolarHBondContact O-N 3.49Å
66	E	45.6	Very low	53.8	Low	127 Å²	127	122.6 Å²	122.6	59%	0.593	66%	0.656	S	S	*	*			trans	-106.2	121.8	175.6	-84.1	156.8	107.9	0	0	110.1	M63	M63-E66 HydrophobicContact CB-CB 4.35Å; M63-E66 WeakPolarHBondContact CB-OE2 3.48Å; M63-E66 WeakPolarHBondContact CG-OE2 3.49Å; M63-E66 PolarHBondContact O-N 3.32Å
67	Y	52.1	Low	54	Low	205 Å²	205	123.4 Å²	123.4	80%	0.804	67%	0.667	S	S	*	*			trans	-52.8	137.4	168.5	-87.8	-97.7	0	0	0	108.6	M69	Y67-M69 PolarHBondContact O-N 3.36Å
68	P	57.6	Low	54.2	Low	117 Å²	117	124.7 Å²	124.7	76%	0.76	67%	0.671	S	S	*	*			trans	-58.1	105.2	177	24.1	-32	0	0	0	108.4	P70	P68-P70 WeakPolarHBondContact O-CD 3.27Å; P68-P70 VanDerWaalsContact O-N 3.11Å
69	M	53.4	Low	54.7	Low	147 Å²	147	120.6 Å²	120.6	72%	0.724	66%	0.664	S	S	*	*			trans	-59.6	116.8	171.7	-76.6	-170.6	-74.3	0	0	106.4	Y67 M71	Y67-M69 PolarHBondContact O-N 3.36Å; M69-M71 PolarHBondContact O-N 2.72Å
70	P	57.9	Low	55	Low	78 Å²	78	117.4 Å²	117.4	51%	0.506	66%	0.659	S	S	.	*			trans	-65.3	139.2	-178	31.1	-35.7	0	0	0	107.7	P68 F72 D73	P68-P70 WeakPolarHBondContact O-CD 3.27Å; P68-P70 VanDerWaalsContact O-N 3.11Å; P70-F72 HydrophobicContact CB-CD2 3.54Å; P70-F72 HydrophobicContact CB-CE2 3.84Å; P70-F72 HydrophobicContact CG-CD2 4.07Å; P70-F72 PolarHBondContact O-N 3.27Å; P70-D73 PolarHBondContact O-N 3.42Å
71	M	57.7	Low	55.4	Low	128 Å²	128	118.1 Å²	118.1	63%	0.631	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-56.6	2.9	-176.1	-74.4	174.3	152.9	0	0	115.2	F58 M69 D73	F58-M71 HydrophobicContact CD1-CE 4.07Å; F58-M71 HydrophobicContact CE1-CE 3.57Å; F58-M71 HydrophobicContact CE1-SD 4.19Å; F58-M71 HydrophobicContact CZ-CE 4.46Å; M69-M71 PolarHBondContact O-N 2.72Å; M71-D73 VanDerWaalsContact C-N 3.27Å; M71-D73 PolarHBondContact O-N 3.24Å
72	F	57.1	Low	56.3	Low	155 Å²	155	123.9 Å²	123.9	68%	0.68	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-72.4	-15.6	177.5	-51.8	-62	0	0	0	113.5	P70 F74 I75	P70-F72 HydrophobicContact CB-CD2 3.54Å; P70-F72 HydrophobicContact CB-CE2 3.84Å; P70-F72 HydrophobicContact CG-CD2 4.07Å; P70-F72 PolarHBondContact O-N 3.27Å; F72-F74 VanDerWaalsContact C-N 3.28Å; F72-F74 PolarHBondContact O-N 3.15Å; F72-I75 HydrophobicContact CD1-CD1 4.11Å; F72-I75 PolarHBondContact O-N 3.39Å
73	D	55.1	Low	57	Low	130 Å²	130	121.7 Å²	121.7	70%	0.695	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-76.8	-9.1	175.7	-87.2	-25.6	0	0	0	114.4	P70 M71	P70-D73 PolarHBondContact O-N 3.42Å; M71-D73 VanDerWaalsContact C-N 3.27Å; M71-D73 PolarHBondContact O-N 3.24Å
74	F	55.3	Low	57.8	Low	184 Å²	184	121.2 Å²	121.2	81%	0.807	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-93.5	-0.9	174.2	-66.7	-76	0	0	0	113.5	F72 P76	F72-F74 VanDerWaalsContact C-N 3.28Å; F72-F74 PolarHBondContact O-N 3.15Å; F74-P76 WeakPolarHBondContact O-CD 3.28Å
75	I	55.7	Low	58.6	Low	68 Å²	68	120 Å²	120	35%	0.349	66%	0.659	S	S	.	*	S	Bend	trans	-88.9	107.2	177.4	-54.9	172.3	0	0	0	106.2	F72 A79 L80	F72-I75 HydrophobicContact CD1-CD1 4.11Å; F72-I75 PolarHBondContact O-N 3.39Å; I75-A79 HydrophobicContact CG2-CB 3.71Å; I75-L80 HydrophobicContact CG2-CG 4.34Å
76	P	59.5	Low	58.9	Low	75 Å²	75	125.2 Å²	125.2	49%	0.487	66%	0.656	S	S	.	*			trans	-54.9	145.6	172.8	23.8	-32.6	0	0	0	108.4	F74 S78 A79	F74-P76 WeakPolarHBondContact O-CD 3.28Å; P76-S78 PolarHBondContact O-N 3.32Å; P76-A79 HydrophobicContact CG-CB 4.03Å; P76-A79 PolarHBondContact O-N 3.47Å
77	P	58.3	Low	59.7	Low	117 Å²	117	125.1 Å²	125.1	76%	0.76	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-17.6	-177.6	18.5	-30.2	0	0	0	113.5
78	S	61.6	Low	60.1	Low	114 Å²	114	121.2 Å²	121.2	80%	0.797	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-17.5	175	-41.8	0	0	0	0	115.5	P76	P76-S78 PolarHBondContact O-N 3.32Å
79	A	63.1	Low	60.1	Low	63 Å²	63	118.9 Å²	118.9	52%	0.521	63%	0.63	S	S	.	*	S	Bend	trans	-104.4	0.6	-179.4	0	0	0	0	0	113	I75 P76	I75-A79 HydrophobicContact CG2-CB 3.71Å; P76-A79 HydrophobicContact CG-CB 4.03Å; P76-A79 PolarHBondContact O-N 3.47Å
80	L	59.1	Low	60.5	Low	99 Å²	99	116 Å²	116	52%	0.518	62%	0.621	S	S	.	*	S	Bend	trans	-70.3	131.5	168.2	-92.6	145.8	0	0	0	109.4	I75 K82	I75-L80 HydrophobicContact CG2-CG 4.34Å; L80-K82 PolarHBondContact O-N 3.32Å
81	P	62.2	Low	60.4	Low	108 Å²	108	118.8 Å²	118.8	70%	0.701	63%	0.631	S	S	*	*			trans	-54.1	132.7	171.3	21.3	-30.4	0	0	0	109.1	L83	P81-L83 PolarHBondContact O-N 3.17Å
82	K	68.4	Low	60.3	Low	206 Å²	206	117.1 Å²	117.1	90%	0.896	63%	0.628	S	S	*	*			trans	-53	115.6	177.4	-77.3	175.7	178.5	174.7	0	108.3	L80	L80-K82 PolarHBondContact O-N 3.32Å
83	L	65.5	Low	60.1	Low	144 Å²	144	111.9 Å²	111.9	75%	0.754	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-59.4	136.3	171.1	-83.6	80.5	0	0	0	107.7	P81 N85	P81-L83 PolarHBondContact O-N 3.17Å; L83-N85 PolarHBondContact O-N 3.13Å
84	P	65.7	Low	60.3	Low	97 Å²	97	111.5 Å²	111.5	63%	0.63	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-58.6	141.6	173.5	26.9	-33.9	0	0	0	108.8	Y86	P84-Y86 PolarHBondContact O-N 3.45Å
85	N	65.4	Low	60.3	Low	79 Å²	79	107.8 Å²	107.8	42%	0.422	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-64.5	130.6	-173.8	-164.3	-5.7	0	0	0	109.7	L83 E87 E88 C89	L83-N85 PolarHBondContact O-N 3.13Å; N85-E87 HydrophobicContact CB-CG 4.26Å; N85-E87 VanDerWaalsContact ND2-CD 3.3Å; N85-E87 WeakPolarHBondContact ND2-CG 3.38Å; N85-E87 PolarHBondContact ND2-OE1 3.27Å; N85-E87 PolarHBondContact O-N 3.13Å; N85-E87 WeakPolarHBondContact OD1-CG 3.46Å; N85-E87 PolarHBondContact OD1-OE1 2.8Å; N85-E88 HydrophobicContact CB-CB 4.03Å; N85-E88 WeakPolarHBondContact O-CA 3.32Å; N85-E88 WeakPolarHBondContact O-CB 3.49Å; N85-E88 PolarHBondContact O-N 2.86Å; N85-C89 PolarHBondContact O-N 2.81Å; N85-C89 PolarHBondContact O-SG 2.88Å
86	Y	60.3	Low	60.1	Low	189 Å²	189	109.1 Å²	109.1	74%	0.741	64%	0.638	S	S	*	*	H	α-helix	trans	-61.6	-35.1	-176.1	-173.4	-95.2	0	0	0	111.4	P84 E88 C89 V90	P84-Y86 PolarHBondContact O-N 3.45Å; Y86-E88 VanDerWaalsContact C-N 3.29Å; Y86-E88 PolarHBondContact O-N 2.72Å; Y86-C89 PolarHBondContact O-N 3.08Å; Y86-V90 HydrophobicContact CD1-CG2 3.86Å; Y86-V90 HydrophobicContact CE1-CG2 3.48Å; Y86-V90 VanDerWaalsContact CE1-CG2 3.48Å; Y86-V90 HydrophobicContact CE2-CG2 4.25Å; Y86-V90 HydrophobicContact CG-CG2 4.4Å; Y86-V90 WeakPolarHBondContact O-CB 3.27Å; Y86-V90 VanDerWaalsContact O-CG2 3.3Å; Y86-V90 WeakPolarHBondContact O-CG2 2.97Å; Y86-V90 PolarHBondContact O-N 3.23Å
87	E	64	Low	59.6	Low	124 Å²	124	111.9 Å²	111.9	58%	0.579	65%	0.649	S	S	*	*	H	α-helix	trans	-65.7	-29.9	173.1	45.4	178.7	155.7	0	0	112.8	N85 N91	N85-E87 HydrophobicContact CB-CG 4.26Å; N85-E87 VanDerWaalsContact ND2-CD 3.3Å; N85-E87 WeakPolarHBondContact ND2-CG 3.38Å; N85-E87 PolarHBondContact ND2-OE1 3.27Å; N85-E87 PolarHBondContact O-N 3.13Å; N85-E87 WeakPolarHBondContact OD1-CG 3.46Å; N85-E87 PolarHBondContact OD1-OE1 2.8Å; E87-N91 VanDerWaalsContact O-CB 3.28Å; E87-N91 WeakPolarHBondContact O-CB 3.21Å; E87-N91 VanDerWaalsContact O-CG 3.26Å; E87-N91 PolarHBondContact O-N 3.49Å; E87-N91 PolarHBondContact O-ND2 2.92Å
88	E	60.6	Low	59.4	Low	124 Å²	124	114.6 Å²	114.6	58%	0.579	66%	0.657	S	S	*	*	H	α-helix	trans	-77.5	-35.8	174.2	-160.8	171.9	-165.6	0	0	110.6	N85 Y86 T92	N85-E88 HydrophobicContact CB-CB 4.03Å; N85-E88 WeakPolarHBondContact O-CA 3.32Å; N85-E88 WeakPolarHBondContact O-CB 3.49Å; N85-E88 PolarHBondContact O-N 2.86Å; Y86-E88 VanDerWaalsContact C-N 3.29Å; Y86-E88 PolarHBondContact O-N 2.72Å; E88-T92 WeakPolarHBondContact O-CB 3.41Å; E88-T92 PolarHBondContact O-N 3.29Å; E88-T92 PolarHBondContact O-OG1 3.44Å
89	C	55.7	Low	59.1	Low	67 Å²	67	117.4 Å²	117.4	45%	0.453	66%	0.658	S	S	.	*	H	α-helix	trans	-73.2	-29	178.4	-60.2	0	0	0	0	113.9	N85 Y86	N85-C89 PolarHBondContact O-N 2.81Å; N85-C89 PolarHBondContact O-SG 2.88Å; Y86-C89 PolarHBondContact O-N 3.08Å
90	V	61.7	Low	58.6	Low	88 Å²	88	118.4 Å²	118.4	53%	0.533	67%	0.666	S	S	.	*	H	α-helix	trans	-84.8	-29.8	178.2	174.6	0	0	0	0	111.6	Y86	Y86-V90 HydrophobicContact CD1-CG2 3.86Å; Y86-V90 HydrophobicContact CE1-CG2 3.48Å; Y86-V90 VanDerWaalsContact CE1-CG2 3.48Å; Y86-V90 HydrophobicContact CE2-CG2 4.25Å; Y86-V90 HydrophobicContact CG-CG2 4.4Å; Y86-V90 WeakPolarHBondContact O-CB 3.27Å; Y86-V90 VanDerWaalsContact O-CG2 3.3Å; Y86-V90 WeakPolarHBondContact O-CG2 2.97Å; Y86-V90 PolarHBondContact O-N 3.23Å
91	N	56.7	Low	58.7	Low	136 Å²	136	119.2 Å²	119.2	73%	0.727	68%	0.677	S	S	*	*	H	α-helix	trans	-88.6	-22.1	178	-69.1	-41.8	0	0	0	113.3	E87 G93	E87-N91 VanDerWaalsContact O-CB 3.28Å; E87-N91 WeakPolarHBondContact O-CB 3.21Å; E87-N91 VanDerWaalsContact O-CG 3.26Å; E87-N91 PolarHBondContact O-N 3.49Å; E87-N91 PolarHBondContact O-ND2 2.92Å; N91-G93 PolarHBondContact O-N 3.46Å
92	T	56.3	Low	58.9	Low	92 Å²	92	119.5 Å²	119.5	56%	0.564	68%	0.679	S	S	*	*	S	Bend	trans	-95	79.7	170.8	-33.5	0	0	0	0	107.5	E88	E88-T92 WeakPolarHBondContact O-CB 3.41Å; E88-T92 PolarHBondContact O-N 3.29Å; E88-T92 PolarHBondContact O-OG1 3.44Å
93	G	53	Low	58.7	Low	46 Å²	46	114.9 Å²	114.9	47%	0.474	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-49.2	152.9	165.4	0	0	0	0	0	110.1	N91	N91-G93 PolarHBondContact O-N 3.46Å
94	P	58.4	Low	58.4	Low	121 Å²	121	112 Å²	112	79%	0.786	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-48.7	129.9	-175.1	19.8	-30.8	0	0	0	109.2	A96	P94-A96 PolarHBondContact O-N 2.92Å
95	P	56	Low	58.3	Low	107 Å²	107	113 Å²	113	70%	0.695	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-55.2	122.6	-178.4	22.3	-31.6	0	0	0	107.4	N97	P95-N97 PolarHBondContact O-N 3.39Å
96	A	50.7	Low	58	Low	95 Å²	95	112.1 Å²	112.1	79%	0.785	66%	0.663	S	S	*	*			trans	-70.8	39.9	177.1	0	0	0	0	0	111.7	P94	P94-A96 PolarHBondContact O-N 2.92Å
97	N	49.4	Very low	57.8	Low	133 Å²	133	108.5 Å²	108.5	71%	0.711	66%	0.656	S	S	*	*			trans	-94.9	103	174.9	-74.2	-0.9	0	0	0	107.3	P95 E99	P95-N97 PolarHBondContact O-N 3.39Å; N97-E99 PolarHBondContact O-N 3.28Å
98	D	53.8	Low	57.5	Low	175 Å²	175	105.4 Å²	105.4	94%	0.936	65%	0.648	S	S	*	*			trans	-55.9	28.9	166	-76.2	-53.2	0	0	0	114.3
99	E	54.4	Low	57.2	Low	173 Å²	173	104.9 Å²	104.9	81%	0.808	64%	0.644	S	S	*	*			trans	-102.7	95.2	177.9	-157.3	144	103.6	0	0	108.1	N97	N97-E99 PolarHBondContact O-N 3.28Å
100	A	53.5	Low	57.4	Low	84 Å²	84	109.8 Å²	109.8	69%	0.694	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-46.7	132.1	178.2	0	0	0	0	0	110.5
101	P	60.9	Low	57	Low	115 Å²	115	108.8 Å²	108.8	75%	0.747	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-56.8	140.1	178.6	22.5	-31.7	0	0	0	109.7
102	P	66.8	Low	57.1	Low	114 Å²	114	105.3 Å²	105.3	74%	0.74	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-56.6	142.3	178	23.5	-32.7	0	0	0	109.7
103	P	64.9	Low	57.4	Low	110 Å²	110	103.8 Å²	103.8	71%	0.714	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-57.8	138.8	-178.7	23.1	-32.5	0	0	0	110.1	T105	P103-T105 PolarHBondContact O-N 2.94Å; P103-T105 VanDerWaalsContact O-N 3.09Å
104	P	58.9	Low	58.1	Low	83 Å²	83	107.2 Å²	107.2	54%	0.539	65%	0.646	S	S	.	*			trans	-60.8	115.3	-176.7	20.9	-30	0	0	0	110.4	P106 S126	P104-P106 WeakPolarHBondContact O-CD 3.23Å; P104-S126 WeakPolarHBondContact CB-OG 3.33Å; P104-S126 WeakPolarHBondContact CG-OG 3.33Å
105	T	63.9	Low	58.6	Low	119 Å²	119	107.5 Å²	107.5	73%	0.73	64%	0.641	S	S	*	*			trans	-64.2	120.2	178.9	-33.9	0	0	0	0	109.2	P103 L107	P103-T105 PolarHBondContact O-N 2.94Å; P103-T105 VanDerWaalsContact O-N 3.09Å; T105-L107 PolarHBondContact O-N 3.25Å; T105-L107 VanDerWaalsContact O-N 3.1Å
106	P	57.3	Low	58.9	Low	60 Å²	60	105.3 Å²	105.3	39%	0.39	64%	0.638	S	S	.	*			trans	-63.9	115.8	177.7	21.7	-29.1	0	0	0	109.9	P104 S108 T123	P104-P106 WeakPolarHBondContact O-CD 3.23Å; P106-S108 PolarHBondContact O-N 3.31Å; P106-T123 HydrophobicContact CB-CG2 3.51Å
107	L	57.4	Low	59.5	Low	113 Å²	113	106.8 Å²	106.8	59%	0.592	63%	0.629	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.1	114.6	171	-66.6	176.1	0	0	0	108	T105 F109 I124	T105-L107 PolarHBondContact O-N 3.25Å; T105-L107 VanDerWaalsContact O-N 3.1Å; L107-F109 HydrophobicContact CB-CE2 3.84Å; L107-F109 HydrophobicContact CB-CZ 4.15Å; L107-F109 HydrophobicContact CD1-CZ 4.49Å; L107-I124 PolarHBondContact O-N 2.93Å
108	S	56.8	Low	60.1	Low	58 Å²	58	105.3 Å²	105.3	41%	0.406	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.2	118	176.4	-57.1	0	0	0	0	108.9	P106	P106-S108 PolarHBondContact O-N 3.31Å
109	F	55.4	Low	60.3	Low	114 Å²	114	99.5 Å²	99.5	50%	0.5	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.7	124.9	173.4	-62.4	-86.6	0	0	0	109.1	L107 F122 I124	L107-F109 HydrophobicContact CB-CE2 3.84Å; L107-F109 HydrophobicContact CB-CZ 4.15Å; L107-F109 HydrophobicContact CD1-CZ 4.49Å; F109-F122 PolarHBondContact N-O 2.95Å; F109-F122 PolarHBondContact O-N 3.41Å; F109-I124 HydrophobicContact CD2-CD1 3.96Å; F109-I124 HydrophobicContact CD2-CG1 4.13Å; F109-I124 HydrophobicContact CE2-CD1 3.54Å; F109-I124 HydrophobicContact CE2-CG1 3.99Å; F109-I124 HydrophobicContact CZ-CD1 4.49Å
110	Y	58.8	Low	60.5	Low	170 Å²	170	96 Å²	96	67%	0.667	59%	0.589	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.1	122.4	173.6	-72.3	-91	0	0	0	109	H121	Y110-H121 AromaticContact CE1-CD2 3.69Å; Y110-H121 AromaticContact CZ-CD2 3.67Å; Y110-H121 AromaticContact CZ-NE2 3.97Å
111	S	53.5	Low	60.8	Low	66 Å²	66	96.5 Å²	96.5	46%	0.462	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	123.7	164.6	-178.1	0	0	0	0	108.1	P118 A119 L120	S111-P118 CarbonylContact O-C 3.59Å; S111-P118 WeakPolarHBondContact O-CA 3.46Å; S111-A119 PolarHBondContact O-N 3.01Å; S111-L120 PolarHBondContact N-O 3.49Å; S111-L120 VanDerWaalsContact N-O 3.12Å; S111-L120 PolarHBondContact O-N 3.32Å
112	A	59.2	Low	60.4	Low	64 Å²	64	97 Å²	97	53%	0.529	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.1	139.2	172.3	0	0	0	0	0	109.5	Q117	A112-Q117 CarbonylContact C-O 3.53Å; A112-Q117 VanDerWaalsContact CA-O 3.3Å; A112-Q117 WeakPolarHBondContact CA-O 3.41Å
113	N	62.5	Low	59.6	Low	60 Å²	60	94.1 Å²	94.1	32%	0.321	55%	0.548	S	S	.	.			trans	-69.4	174.1	169.5	66.2	18.4	0	0	0	110.7	N115 G116 Q117 A119	N113-N115 PolarHBondContact O-N 3.49Å; N113-N115 WeakPolarHBondContact OD1-CA 3.41Å; N113-N115 WeakPolarHBondContact OD1-CB 3.33Å; N113-N115 PolarHBondContact OD1-N 2.88Å; N113-G116 PolarHBondContact O-N 2.79Å; N113-G116 PolarHBondContact OD1-N 3.42Å; N113-Q117 PolarHBondContact N-O 2.94Å; N113-Q117 PolarHBondContact OD1-N 2.86Å; N113-Q117 PolarHBondContact OD1-O 3.45Å; N113-A119 HydrophobicContact CB-CB 4.18Å
114	S	68	Low	58.9	Low	118 Å²	118	93.9 Å²	93.9	83%	0.825	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.5	176.3	58.5	0	0	0	0	114.3
115	N	69.5	Low	58.6	Low	127 Å²	127	95.6 Å²	95.6	68%	0.679	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	8.7	-179.3	-57.8	-2.9	0	0	0	112.1	N113 Q117	N113-N115 PolarHBondContact O-N 3.49Å; N113-N115 WeakPolarHBondContact OD1-CA 3.41Å; N113-N115 WeakPolarHBondContact OD1-CB 3.33Å; N113-N115 PolarHBondContact OD1-N 2.88Å; N115-Q117 PolarHBondContact O-N 3.29Å
116	G	61.4	Low	58.1	Low	61 Å²	61	94.2 Å²	94.2	63%	0.629	54%	0.535	S	S	*	.	S	Bend	trans	72.6	6.2	-178.8	0	0	0	0	0	114.6	N113	N113-G116 PolarHBondContact O-N 2.79Å; N113-G116 PolarHBondContact OD1-N 3.42Å
117	Q	63.5	Low	57.6	Low	126 Å²	126	98.1 Å²	98.1	59%	0.589	55%	0.548	S	S	*	.			trans	-84.5	138.4	174.4	-68	-168.1	-53.8	0	0	110.5	A112 N113 N115 A119	A112-Q117 CarbonylContact C-O 3.53Å; A112-Q117 VanDerWaalsContact CA-O 3.3Å; A112-Q117 WeakPolarHBondContact CA-O 3.41Å; N113-Q117 PolarHBondContact N-O 2.94Å; N113-Q117 PolarHBondContact OD1-N 2.86Å; N113-Q117 PolarHBondContact OD1-O 3.45Å; N115-Q117 PolarHBondContact O-N 3.29Å; Q117-A119 PolarHBondContact O-N 3.43Å; Q117-A119 VanDerWaalsContact O-N 3.09Å
118	P	61.9	Low	56.8	Low	101 Å²	101	98.4 Å²	98.4	66%	0.656	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-61.4	115.2	175.5	25.7	-32.4	0	0	0	109.5	S111	S111-P118 CarbonylContact O-C 3.59Å; S111-P118 WeakPolarHBondContact O-CA 3.46Å
119	A	58.7	Low	56	Low	53 Å²	53	101.8 Å²	101.8	44%	0.438	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.8	-38.7	-178.5	0	0	0	0	0	111.7	S111 N113 Q117	S111-A119 PolarHBondContact O-N 3.01Å; N113-A119 HydrophobicContact CB-CB 4.18Å; Q117-A119 PolarHBondContact O-N 3.43Å; Q117-A119 VanDerWaalsContact O-N 3.09Å
120	L	57.8	Low	55.4	Low	99 Å²	99	104.2 Å²	104.2	52%	0.518	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-150	134.9	-179.2	-70.7	168.1	0	0	0	110	S111 F122	S111-L120 PolarHBondContact N-O 3.49Å; S111-L120 VanDerWaalsContact N-O 3.12Å; S111-L120 PolarHBondContact O-N 3.32Å; L120-F122 HydrophobicContact CB-CD2 4.12Å; L120-F122 HydrophobicContact CB-CE2 3.74Å; L120-F122 HydrophobicContact CD1-CE2 3.93Å; L120-F122 HydrophobicContact CD2-CE2 4.23Å; L120-F122 HydrophobicContact CD2-CZ 4.42Å; L120-F122 HydrophobicContact CG-CE2 4.16Å
121	H	59	Low	54.6	Low	96 Å²	96	101.5 Å²	101.5	44%	0.444	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115	115.9	172.1	176.9	-104.2	0	0	0	107.8	Y110 T123	Y110-H121 AromaticContact CE1-CD2 3.69Å; Y110-H121 AromaticContact CZ-CD2 3.67Å; Y110-H121 AromaticContact CZ-NE2 3.97Å; H121-T123 PolarHBondContact CE1-OG1 3.29Å
122	F	53.2	Low	54.1	Low	126 Å²	126	102 Å²	102	55%	0.553	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.8	124.7	174	-72.9	-79.9	0	0	0	109.6	F109 L120	F109-F122 PolarHBondContact N-O 2.95Å; F109-F122 PolarHBondContact O-N 3.41Å; L120-F122 HydrophobicContact CB-CD2 4.12Å; L120-F122 HydrophobicContact CB-CE2 3.74Å; L120-F122 HydrophobicContact CD1-CE2 3.93Å; L120-F122 HydrophobicContact CD2-CE2 4.23Å; L120-F122 HydrophobicContact CD2-CZ 4.42Å; L120-F122 HydrophobicContact CG-CE2 4.16Å
123	T	49.7	Very low	53.2	Low	53 Å²	53	106.8 Å²	106.8	33%	0.325	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.3	109.4	172	-51.5	0	0	0	0	107.3	P106 H121 H125	P106-T123 HydrophobicContact CB-CG2 3.51Å; H121-T123 PolarHBondContact CE1-OG1 3.29Å; T123-H125 WeakPolarHBondContact CG2-NE2 3.34Å; T123-H125 PolarHBondContact O-N 3.44Å
124	I	51.7	Low	52.4	Low	104 Å²	104	110.2 Å²	110.2	53%	0.533	63%	0.625	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.6	102.7	175.4	-55.2	-174.9	0	0	0	107	L107 F109	L107-I124 PolarHBondContact O-N 2.93Å; F109-I124 HydrophobicContact CD2-CD1 3.96Å; F109-I124 HydrophobicContact CD2-CG1 4.13Å; F109-I124 HydrophobicContact CE2-CD1 3.54Å; F109-I124 HydrophobicContact CE2-CG1 3.99Å; F109-I124 HydrophobicContact CZ-CD1 4.49Å
125	H	52.3	Low	51.2	Low	120 Å²	120	112 Å²	112	56%	0.556	63%	0.625	S	S	*	*			trans	-79.3	132.9	163.4	-68.1	-73.9	0	0	0	107.9	T123 Q127	T123-H125 WeakPolarHBondContact CG2-NE2 3.34Å; T123-H125 PolarHBondContact O-N 3.44Å; H125-Q127 PolarHBondContact O-N 2.93Å
126	S	52.6	Low	49.9	Very low	89 Å²	89	110.1 Å²	110.1	62%	0.622	62%	0.622	S	S	*	*	S	Bend	trans	-69.1	6.1	177	63.5	0	0	0	0	113.5	P104	P104-S126 WeakPolarHBondContact CB-OG 3.33Å; P104-S126 WeakPolarHBondContact CG-OG 3.33Å
127	Q	46.5	Very low	48.9	Very low	142 Å²	142	113 Å²	113	66%	0.664	63%	0.632	S	S	*	*	S	Bend	trans	-109.1	126.1	171.6	-164.5	167.6	8.1	0	0	106.4	H125 D129	H125-Q127 PolarHBondContact O-N 2.93Å; Q127-D129 PolarHBondContact O-N 3.32Å
128	P	40.6	Very low	47.9	Very low	120 Å²	120	114.8 Å²	114.8	78%	0.779	64%	0.641	S	S	*	*			trans	-75.9	71.4	-177.3	33.2	-33.2	0	0	0	108.4
129	D	41.3	Very low	46.5	Very low	128 Å²	128	115.1 Å²	115.1	68%	0.684	65%	0.652	S	S	*	*			trans	-98.3	105	169.8	-136.5	-9	0	0	0	107.2	Q127 V131	Q127-D129 PolarHBondContact O-N 3.32Å; D129-V131 PolarHBondContact O-N 2.96Å
130	L	41.3	Very low	45.7	Very low	165 Å²	165	120 Å²	120	86%	0.864	67%	0.67	S	S	*	*			trans	-65.1	78	175.7	-91.6	75	0	0	0	109.3
131	V	43	Very low	44.9	Very low	113 Å²	113	120 Å²	120	69%	0.685	68%	0.684	S	S	*	*			trans	-122	68.1	167.2	-171.2	0	0	0	0	107.9	D129 H133	D129-V131 PolarHBondContact O-N 2.96Å; V131-H133 PolarHBondContact O-N 3.34Å; V131-H133 VanDerWaalsContact O-N 3.12Å
132	A	41.8	Very low	44	Very low	77 Å²	77	120.9 Å²	120.9	64%	0.636	70%	0.701	S	S	*	*			trans	-70.3	102.5	160.3	0	0	0	0	0	106.8	I134	A132-I134 HydrophobicContact CB-CD1 4.18Å; A132-I134 HydrophobicContact CB-CG1 3.83Å; A132-I134 WeakPolarHBondContact O-CG1 3.48Å; A132-I134 PolarHBondContact O-N 3.28Å
133	H	41.1	Very low	44	Very low	165 Å²	165	120.9 Å²	120.9	76%	0.764	71%	0.714	S	S	*	*			trans	-72.8	71.6	173.8	-160.5	20.7	0	0	0	108.9	V131 N135	V131-H133 PolarHBondContact O-N 3.34Å; V131-H133 VanDerWaalsContact O-N 3.12Å; H133-N135 PolarHBondContact O-N 3.44Å
134	I	46.8	Very low	43.8	Very low	132 Å²	132	126.1 Å²	126.1	68%	0.677	74%	0.739	S	S	*	*			trans	-87.9	101.3	172.4	-23.2	179	0	0	0	105.9	A132 S136	A132-I134 HydrophobicContact CB-CD1 4.18Å; A132-I134 HydrophobicContact CB-CG1 3.83Å; A132-I134 WeakPolarHBondContact O-CG1 3.48Å; A132-I134 PolarHBondContact O-N 3.28Å; I134-S136 PolarHBondContact O-N 3.03Å
135	N	41.4	Very low	43.5	Very low	154 Å²	154	126.8 Å²	126.8	82%	0.824	75%	0.753	S	S	*	*			trans	-61.2	79.7	161	-89.2	-28.4	0	0	0	108.1	H133	H133-N135 PolarHBondContact O-N 3.44Å
136	S	43.2	Very low	43.5	Very low	89 Å²	89	127 Å²	127	62%	0.622	76%	0.763	S	S	*	*			trans	-146.5	100.7	166.6	-164.3	0	0	0	0	107.2	I134 Q138	I134-S136 PolarHBondContact O-N 3.03Å; S136-Q138 VanDerWaalsContact C-N 3.28Å; S136-Q138 PolarHBondContact O-N 2.91Å
137	S	38.7	Very low	44	Very low	121 Å²	121	128.1 Å²	128.1	85%	0.846	77%	0.768	S	S	*	*			trans	-57.5	86.7	171.6	38.5	0	0	0	0	110.4
138	Q	43.1	Very low	44.9	Very low	163 Å²	163	126.7 Å²	126.7	76%	0.762	77%	0.771	S	S	*	*			trans	-161.4	104.6	159.4	-108.2	170.1	46.3	0	0	108.5	S136 L140	S136-Q138 VanDerWaalsContact C-N 3.28Å; S136-Q138 PolarHBondContact O-N 2.91Å; Q138-L140 PolarHBondContact O-N 3.46Å; Q138-L140 VanDerWaalsContact O-N 3.15Å
139	A	32.3	Very low	45.7	Very low	109 Å²	109	125.2 Å²	125.2	90%	0.901	76%	0.762	S	S	*	*			trans	-64.3	107.7	175.3	0	0	0	0	0	110.1
140	L	41.6	Very low	46.3	Very low	154 Å²	154	125.5 Å²	125.5	81%	0.806	77%	0.768	S	S	*	*			trans	-116.5	126.5	162.8	-98.8	83.7	0	0	0	109.3	Q138	Q138-L140 PolarHBondContact O-N 3.46Å; Q138-L140 VanDerWaalsContact O-N 3.15Å
141	A	41.1	Very low	46.5	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-57.8	142.3	-175.2	0	0	0	0	0	113.1
142	S	40.8	Very low	46.5	Very low	115 Å²	115	126.3 Å²	126.3	80%	0.804	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-50.6	132.2	176.8	-48.3	0	0	0	0	112.2	L144	S142-L144 PolarHBondContact O-N 3.4Å
143	P	54.2	Low	46.5	Very low	126 Å²	126	127.8 Å²	127.8	82%	0.818	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-68.8	126.2	171.1	27.1	-30.5	0	0	0	109.6	S145	P143-S145 PolarHBondContact O-N 3.43Å
144	L	43.6	Very low	46.5	Very low	163 Å²	163	125.3 Å²	125.3	85%	0.853	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-62.8	121.2	176.7	-169.1	69	0	0	0	110	S142 T146	S142-L144 PolarHBondContact O-N 3.4Å; L144-T146 PolarHBondContact O-N 3.09Å; L144-T146 VanDerWaalsContact O-N 3.11Å
145	S	46.4	Very low	46	Very low	118 Å²	118	124.2 Å²	124.2	83%	0.825	77%	0.77	S	S	*	*			trans	-60.2	108.5	176.9	-66.5	0	0	0	0	111.8	P143	P143-S145 PolarHBondContact O-N 3.43Å
146	T	52.7	Low	46	Very low	125 Å²	125	123.3 Å²	123.3	77%	0.767	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-83.3	133.6	163.2	36.2	0	0	0	0	110.4	L144	L144-T146 PolarHBondContact O-N 3.09Å; L144-T146 VanDerWaalsContact O-N 3.11Å
147	P	62.6	Low	45.8	Very low	113 Å²	113	127.1 Å²	127.1	73%	0.734	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-66.1	156	174.6	28.2	-33.6	0	0	0	111.6
148	P	65.4	Low	45.6	Very low	112 Å²	112	131.9 Å²	131.9	73%	0.727	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-65	148.3	-179.2	27.2	-34.1	0	0	0	111.8	T150	P148-T150 PolarHBondContact O-N 3.08Å
149	P	58.4	Low	45.6	Very low	89 Å²	89	129.6 Å²	129.6	58%	0.578	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-66.8	130.8	178.7	26.1	-32	0	0	0	111.4	Y151	P149-Y151 HydrophobicContact CG-CE2 3.94Å; P149-Y151 WeakPolarHBondContact O-CD2 3.31Å; P149-Y151 PolarHBondContact O-N 3.43Å
150	T	53.8	Low	45.6	Very low	133 Å²	133	128.8 Å²	128.8	82%	0.816	76%	0.758	S	S	*	*			trans	-68.6	113.8	173.9	-51.5	0	0	0	0	110.2	P148	P148-T150 PolarHBondContact O-N 3.08Å
151	Y	45.3	Very low	45.8	Very low	192 Å²	192	127.8 Å²	127.8	75%	0.753	76%	0.759	S	S	*	*			trans	-92.4	113.2	167.9	-66.9	-85.5	0	0	0	109.4	P149 S153	P149-Y151 HydrophobicContact CG-CE2 3.94Å; P149-Y151 WeakPolarHBondContact O-CD2 3.31Å; P149-Y151 PolarHBondContact O-N 3.43Å; Y151-S153 PolarHBondContact O-N 3.44Å
152	S	43.1	Very low	45.6	Very low	104 Å²	104	130 Å²	130	73%	0.727	76%	0.762	S	S	*	*			trans	-78.8	109.7	169.2	-61.4	0	0	0	0	109.2	T154	S152-T154 PolarHBondContact O-N 3.34Å
153	S	41.2	Very low	45.6	Very low	108 Å²	108	129.5 Å²	129.5	76%	0.755	76%	0.759	S	S	*	*			trans	-77.6	101	173.1	-170.3	0	0	0	0	109.4	Y151 C155	Y151-S153 PolarHBondContact O-N 3.44Å; S153-C155 PolarHBondContact O-N 3.36Å
154	T	41.4	Very low	45	Very low	112 Å²	112	134.6 Å²	134.6	69%	0.687	76%	0.762	S	S	*	*			trans	-91.9	92.7	171	-45.8	0	0	0	0	108.6	S152 L156	S152-T154 PolarHBondContact O-N 3.34Å; T154-L156 HydrophobicContact CG2-CD1 3.79Å; T154-L156 HydrophobicContact CG2-CG 3.97Å; T154-L156 PolarHBondContact O-N 3.28Å; T154-L156 VanDerWaalsContact O-N 3.17Å
155	C	35.5	Very low	44.6	Very low	109 Å²	109	132.5 Å²	132.5	74%	0.736	76%	0.756	S	S	*	*			trans	-69.2	99	167.4	-23	0	0	0	0	107.8	S153	S153-C155 PolarHBondContact O-N 3.36Å
156	L	42.2	Very low	44.4	Very low	136 Å²	136	132.4 Å²	132.4	71%	0.712	75%	0.75	S	S	*	*			trans	-137.9	105.4	170.4	-78.1	176.9	0	0	0	112.3	T154	T154-L156 HydrophobicContact CG2-CD1 3.79Å; T154-L156 HydrophobicContact CG2-CG 3.97Å; T154-L156 PolarHBondContact O-N 3.28Å; T154-L156 VanDerWaalsContact O-N 3.17Å
157	H	38.3	Very low	43.7	Very low	168 Å²	168	135.4 Å²	135.4	78%	0.778	76%	0.755	S	S	*	*			trans	55.2	100.3	138.5	-82.8	-68.4	0	0	0	119.3	P159	H157-P159 VanDerWaalsContact O-CD 3.28Å; H157-P159 WeakPolarHBondContact O-CD 3.4Å
158	R	33.7	Very low	42.5	Very low	221 Å²	221	133.3 Å²	133.3	83%	0.834	75%	0.754	S	S	*	*			trans	-59.1	123.2	149.9	178.2	-177.8	-173.3	126.6	0.4	110.5
159	P	43.4	Very low	41.3	Very low	115 Å²	115	134.3 Å²	134.3	75%	0.747	76%	0.758	S	S	*	*			trans	-98.6	114.9	160.7	2.7	19.2	0	0	0	108.9	H157	H157-P159 VanDerWaalsContact O-CD 3.28Å; H157-P159 WeakPolarHBondContact O-CD 3.4Å
160	S	33.5	Very low	40.2	Very low	92 Å²	92	134.9 Å²	134.9	64%	0.643	77%	0.765	S	S	*	*			trans	-81.9	115	165	-66.4	0	0	0	0	108.6
161	T	46	Very low	39.6	Very low	134 Å²	134	139.6 Å²	139.6	82%	0.822	77%	0.767	S	S	*	*			trans	-151.4	110.7	155.4	42.7	0	0	0	0	111.5
162	T	35.8	Very low	39.1	Very low	145 Å²	145	136.5 Å²	136.5	89%	0.89	77%	0.769	S	S	*	*			trans	-59.6	124.6	158.4	-74	0	0	0	0	110.1
163	S	42.3	Very low	39.1	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	77%	0.765	S	S	*	*			trans	-172.3	100.6	144	52.8	0	0	0	0	111.8
164	R	39.5	Very low	39	Very low	234 Å²	234	139.4 Å²	139.4	88%	0.883	77%	0.766	S	S	*	*			trans	14.7	123.9	136.2	-115.8	-172.6	-176.7	140.5	-0.3	119.1
165	T	35.3	Very low	38.8	Very low	118 Å²	118	140.5 Å²	140.5	72%	0.724	77%	0.768	S	S	*	*			trans	82.1	136.1	132.6	-0.3	0	0	0	0	121.3
166	V	42.9	Very low	39.1	Very low	117 Å²	117	139.7 Å²	139.7	71%	0.709	76%	0.763	S	S	*	*			trans	92.5	95.9	154.9	-163	0	0	0	0	117.3
167	E	38.3	Very low	39	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	76%	0.761	S	S	*	*				31.4	124.1	127	-58.6	177	154.5	0	0	119.8
168	G	37.8	Very low	39.2	Very low	69 Å²	69	137.7 Å²	137.7	71%	0.711	76%	0.761	S	S	*	*			trans	113.2	118.7	132.9	0	0	0	0	0	117
169	T	38.9	Very low	39.5	Very low	133 Å²	133	132.8 Å²	132.8	82%	0.816	76%	0.755	S	S	*	*			trans	85.7	96	137.6	-46	0	0	0	0	118.4
170	S	36.7	Very low	39.3	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	76%	0.759	S	S	*	*				51	132.8	119.8	-52.4	0	0	0	0	122.4
171	R	40.3	Very low	39.9	Very low	232 Å²	232	135.2 Å²	135.2	88%	0.875	77%	0.769	S	S	*	*			trans	92.3	100.2	153.2	-67.7	170.3	170.9	154.3	-2.7	115.6
172	T	35.6	Very low	39.7	Very low	127 Å²	127	139.9 Å²	139.9	78%	0.779	77%	0.772	S	S	*	*				66.6	135.1	84.8	-38.8	0	0	0	0	112
173	V	43.5	Very low	40.1	Very low	108 Å²	108	142.3 Å²	142.3	66%	0.655	77%	0.773	S	S	*	*			trans	130.4	117.8	139.3	177.2	0	0	0	0	114
174	E	38.7	Very low	40.1	Very low	165 Å²	165	145.7 Å²	145.7	77%	0.771	78%	0.782	S	S	*	*			trans	67.8	120.1	145.2	-74.8	173.2	136.1	0	0	120.5
175	N	37.6	Very low	40.3	Very low	135 Å²	135	140 Å²	140	72%	0.722	78%	0.778	S	S	*	*				102.9	140.9	63.2	-171.8	18.9	0	0	0	108.8
176	S	41.7	Very low	41.2	Very low	91 Å²	91	140.8 Å²	140.8	64%	0.636	78%	0.782	S	S	*	*			trans	123.7	81.6	151.7	-46.7	0	0	0	0	115
177	S	39.6	Very low	41.4	Very low	95 Å²	95	142.5 Å²	142.5	66%	0.664	79%	0.788	S	S	*	*				65.8	131	107.3	69.5	0	0	0	0	123.3
178	H	43.1	Very low	41.6	Very low	168 Å²	168	148.6 Å²	148.6	78%	0.778	80%	0.803	S	S	*	*			trans	96.8	111.7	133.4	-81.7	-59.9	0	0	0	121.4
179	T	39.8	Very low	41.7	Very low	118 Å²	118	152.6 Å²	152.6	72%	0.724	81%	0.807	S	S	*	*			trans	77.2	103.1	131.1	44.5	0	0	0	0	121.8
180	T	38.6	Very low	41.9	Very low	136 Å²	136	153.6 Å²	153.6	83%	0.834	81%	0.807	S	S	*	*				18.4	119.3	126.4	-40.5	0	0	0	0	118.8
181	S	46	Very low	42.2	Very low	121 Å²	121	156.5 Å²	156.5	85%	0.846	81%	0.812	S	S	*	*			trans	-141.3	117.7	146.4	-170	0	0	0	0	110.2
182	R	41.8	Very low	42.3	Very low	232 Å²	232	152.1 Å²	152.1	88%	0.875	81%	0.809	S	S	*	*			trans	-87.3	131.4	169	-109.6	-179.8	161.6	178.2	-4.6	107
183	Q	44.1	Very low	42.7	Very low	197 Å²	197	153.6 Å²	153.6	92%	0.921	81%	0.81	S	S	*	*			trans	-164.3	112.2	135.9	-112.5	169.8	-7.9	0	0	111.4
184	L	42.5	Very low	42.7	Very low	174 Å²	174	156.7 Å²	156.7	91%	0.911	82%	0.821	S	S	*	*			trans	-78.7	132	163.4	-102.9	138.9	0	0	0	108.3
185	S	44.6	Very low	42.9	Very low	116 Å²	116	156.1 Å²	156.1	81%	0.811	82%	0.824	S	S	*	*			trans	-165.1	94.4	159.5	168.4	0	0	0	0	107.9
186	V	52.5	Low	43.4	Very low	133 Å²	133	157.7 Å²	157.7	81%	0.806	83%	0.832	S	S	*	*			trans	-120.8	116.1	163.9	172.4	0	0	0	0	107.2
187	D	47.9	Very low	43.5	Very low	154 Å²	154	163.3 Å²	163.3	82%	0.824	85%	0.849	S	S	*	*			trans	23.7	123.3	156	-79.3	-68.5	0	0	0	121.6
188	R	41.5	Very low	43.8	Very low	315 Å²	315	169.5 Å²	169.5	100%	1.189	87%	0.865	S	S	*	*			trans	-131.9	0	139	-154	-174	-163.7	147	4.1	108.7

Retrieved 188 of 188 residues in 111.6 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).