A0A075B737_HUMAN Loading...

Platelet endothelial cell adhesion molecule

AlphaFold DB , UniProt , Accession A0A075B737, Species HUMAN (Homo sapiens, Human), Gene PECAM1, Length 134 aa.

						>A0A075B737_HUMAN|A0A075B737|PECAM1
MQPRWAQGATMWLGVLLTLLLCSSLEGQENSFTINSVDMKSLPDWTVQNGKNLTLQCFADVSTTSHVKPQHQMLFYKDDVLFYNISSMKSTESYFIPEVRIYDSGTYKCTVIVNNKEKTTAEYQVLVEGVPSPR
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	49.2	Very low	246 Å²	246	138.7 Å²	138.7	100%	1.212	71%	0.707	S	S	*	*				0	90.6	0	-73.4	158.4	168.8	0	0	108
2	Q	41.9	Very low	50.2	Low	191 Å²	191	143.8 Å²	143.8	89%	0.893	71%	0.711	S	S	*	*			trans	-87	129.7	171.3	-82.4	169.8	-54.7	0	0	108.1	R4	Q2-R4 PolarHBondContact O-N 3.06Å; Q2-R4 VanDerWaalsContact O-N 3.07Å
3	P	42.6	Very low	51.4	Low	102 Å²	102	141.2 Å²	141.2	66%	0.662	70%	0.7	S	S	*	*			trans	-72.8	110.7	-178.2	29.1	-29.9	0	0	0	108.1	W5	P3-W5 PolarHBondContact O-N 3.38Å
4	R	47.7	Very low	52.9	Low	235 Å²	235	133.7 Å²	133.7	89%	0.887	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	9.1	173.9	-139	178	172.6	-169.9	-3.5	113.5	Q2	Q2-R4 PolarHBondContact O-N 3.06Å; Q2-R4 VanDerWaalsContact O-N 3.07Å
5	W	46.2	Very low	54.1	Low	227 Å²	227	130 Å²	130	86%	0.86	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-19.2	-177.3	-107.9	-53.1	0	0	0	114.1	P3 Q7	P3-W5 PolarHBondContact O-N 3.38Å; W5-Q7 PolarHBondContact O-N 2.92Å
6	A	47.7	Very low	55	Low	64 Å²	64	128.7 Å²	128.7	53%	0.529	66%	0.658	S	S	.	*	H	α-helix	trans	-77.9	-17	-174.4	0	0	0	0	0	114.4	T10	A6-T10 PolarHBondContact O-OG1 3.06Å
7	Q	50.6	Low	55.7	Low	144 Å²	144	127.1 Å²	127.1	67%	0.673	65%	0.651	S	S	*	*	H	α-helix	trans	-90.3	-25.6	-174.2	-70.6	-179.5	-29.6	0	0	114.1	W5 T10	W5-Q7 PolarHBondContact O-N 2.92Å; Q7-T10 PolarHBondContact O-OG1 3.24Å
8	G	51.9	Low	56.4	Low	38 Å²	38	124.7 Å²	124.7	39%	0.392	64%	0.643	S	S	.	*	H	α-helix	trans	-77.5	-37.4	177.2	0	0	0	0	0	112.7	M11 W12	G8-M11 PolarHBondContact O-N 3.14Å; G8-W12 PolarHBondContact O-N 3.21Å; G8-W12 VanDerWaalsContact O-N 3.17Å
9	A	55	Low	56.8	Low	54 Å²	54	124.1 Å²	124.1	45%	0.446	64%	0.64	S	S	.	*	H	α-helix	trans	-67.4	-41.9	-178.6	0	0	0	0	0	112.6	M11 W12 L13	A9-M11 VanDerWaalsContact C-N 3.34Å; A9-M11 PolarHBondContact O-N 2.62Å; A9-W12 PolarHBondContact O-N 2.86Å; A9-L13 WeakPolarHBondContact O-CB 3.45Å; A9-L13 WeakPolarHBondContact O-CD1 3.11Å; A9-L13 PolarHBondContact O-N 3.13Å
10	T	57.2	Low	57.2	Low	93 Å²	93	123.7 Å²	123.7	57%	0.571	64%	0.638	S	S	*	*	H	α-helix	trans	-65.8	-36.2	177.2	43.2	0	0	0	0	112.5	A6 Q7 G14	A6-T10 PolarHBondContact O-OG1 3.06Å; Q7-T10 PolarHBondContact O-OG1 3.24Å; T10-G14 PolarHBondContact O-N 2.62Å
11	M	60.2	Low	57.4	Low	132 Å²	132	123.9 Å²	123.9	65%	0.65	64%	0.64	S	S	*	*	H	α-helix	trans	-67.1	-40.1	176.9	-161.8	-175.2	-60.5	0	0	111.7	G8 A9 V15	G8-M11 PolarHBondContact O-N 3.14Å; A9-M11 VanDerWaalsContact C-N 3.34Å; A9-M11 PolarHBondContact O-N 2.62Å; M11-V15 WeakPolarHBondContact O-CG2 3.32Å; M11-V15 PolarHBondContact O-N 3.36Å
12	W	61.6	Low	58.4	Low	200 Å²	200	116.8 Å²	116.8	76%	0.758	61%	0.613	S	S	*	*	H	α-helix	trans	-74.4	-38.3	178.2	-71.2	19.7	0	0	0	112.3	G8 A9 G14 V15 L16	G8-W12 PolarHBondContact O-N 3.21Å; G8-W12 VanDerWaalsContact O-N 3.17Å; A9-W12 PolarHBondContact O-N 2.86Å; W12-G14 VanDerWaalsContact C-N 3.34Å; W12-G14 PolarHBondContact O-N 2.92Å; W12-V15 PolarHBondContact O-N 2.98Å; W12-L16 WeakPolarHBondContact O-CB 3.45Å; W12-L16 PolarHBondContact O-N 2.82Å
13	L	66.4	Low	59.3	Low	109 Å²	109	112.6 Å²	112.6	57%	0.571	61%	0.605	S	S	*	*	H	α-helix	trans	-61	-41	172.6	-92.7	148.7	0	0	0	112.1	A9 L16 L17	A9-L13 WeakPolarHBondContact O-CB 3.45Å; A9-L13 WeakPolarHBondContact O-CD1 3.11Å; A9-L13 PolarHBondContact O-N 3.13Å; L13-L16 PolarHBondContact O-N 3.26Å; L13-L17 WeakPolarHBondContact O-CB 3.24Å; L13-L17 PolarHBondContact O-N 2.94Å
14	G	72.4	Confident	60.1	Low	37 Å²	37	112.2 Å²	112.2	38%	0.381	61%	0.605	S	S	.	*	H	α-helix	trans	-62.5	-45.6	175.8	0	0	0	0	0	112.6	T10 W12 L17 T18	T10-G14 PolarHBondContact O-N 2.62Å; W12-G14 VanDerWaalsContact C-N 3.34Å; W12-G14 PolarHBondContact O-N 2.92Å; G14-L17 PolarHBondContact O-N 2.83Å; G14-T18 WeakPolarHBondContact O-CG2 3.43Å; G14-T18 PolarHBondContact O-N 3.11Å; G14-T18 PolarHBondContact O-OG1 2.84Å
15	V	70.4	Confident	60.5	Low	78 Å²	78	108.9 Å²	108.9	47%	0.473	60%	0.604	S	S	.	*	H	α-helix	trans	-65.2	-42.4	177.4	173.7	0	0	0	0	111.5	M11 W12 L17 T18 L19	M11-V15 WeakPolarHBondContact O-CG2 3.32Å; M11-V15 PolarHBondContact O-N 3.36Å; W12-V15 PolarHBondContact O-N 2.98Å; V15-L17 VanDerWaalsContact C-N 3.33Å; V15-L17 PolarHBondContact O-N 2.91Å; V15-T18 WeakPolarHBondContact CA-OG1 3.32Å; V15-T18 PolarHBondContact O-N 2.91Å; V15-T18 PolarHBondContact O-OG1 2.9Å; V15-L19 HydrophobicContact CG1-CD1 3.87Å; V15-L19 WeakPolarHBondContact O-CG 3.05Å; V15-L19 PolarHBondContact O-N 2.9Å
16	L	68.2	Low	61.2	Low	109 Å²	109	106.9 Å²	106.9	57%	0.571	60%	0.604	S	S	*	*	H	α-helix	trans	-62.1	-41.3	176.5	-144	85.9	0	0	0	111.3	W12 L13 L19 L20	W12-L16 WeakPolarHBondContact O-CB 3.45Å; W12-L16 PolarHBondContact O-N 2.82Å; L13-L16 PolarHBondContact O-N 3.26Å; L16-L19 PolarHBondContact O-N 2.87Å; L16-L20 WeakPolarHBondContact O-CB 3.31Å; L16-L20 WeakPolarHBondContact O-CD1 3.35Å; L16-L20 WeakPolarHBondContact O-CG 3.36Å; L16-L20 PolarHBondContact O-N 3.43Å
17	L	67.8	Low	61.8	Low	102 Å²	102	107 Å²	107	53%	0.534	61%	0.611	S	S	.	*	H	α-helix	trans	-61.5	-46.5	173.2	-118.2	80.4	0	0	0	111.1	L13 G14 V15 L19 L20 L21	L13-L17 WeakPolarHBondContact O-CB 3.24Å; L13-L17 PolarHBondContact O-N 2.94Å; G14-L17 PolarHBondContact O-N 2.83Å; V15-L17 VanDerWaalsContact C-N 3.33Å; V15-L17 PolarHBondContact O-N 2.91Å; L17-L19 VanDerWaalsContact C-N 3.32Å; L17-L19 PolarHBondContact O-N 3.18Å; L17-L20 PolarHBondContact O-N 2.62Å; L17-L21 HydrophobicContact CG-CD1 4.44Å; L17-L21 WeakPolarHBondContact O-CD1 3.25Å; L17-L21 PolarHBondContact O-N 2.78Å
18	T	67	Low	62.4	Low	83 Å²	83	107.8 Å²	107.8	51%	0.509	62%	0.615	S	S	.	*	H	α-helix	trans	-64	-35.6	179.2	53.4	0	0	0	0	113	G14 V15 L21 C22	G14-T18 WeakPolarHBondContact O-CG2 3.43Å; G14-T18 PolarHBondContact O-N 3.11Å; G14-T18 PolarHBondContact O-OG1 2.84Å; V15-T18 WeakPolarHBondContact CA-OG1 3.32Å; V15-T18 PolarHBondContact O-N 2.91Å; V15-T18 PolarHBondContact O-OG1 2.9Å; T18-L21 PolarHBondContact O-N 2.75Å; T18-C22 WeakPolarHBondContact O-CB 3.48Å; T18-C22 PolarHBondContact O-N 2.97Å
19	L	65.4	Low	63.3	Low	114 Å²	114	114.6 Å²	114.6	60%	0.597	64%	0.637	S	S	*	*	H	α-helix	trans	-69.6	-37.4	175.1	-75.2	161.6	0	0	0	112	V15 L16 L17 L21 C22 S23	V15-L19 HydrophobicContact CG1-CD1 3.87Å; V15-L19 WeakPolarHBondContact O-CG 3.05Å; V15-L19 PolarHBondContact O-N 2.9Å; L16-L19 PolarHBondContact O-N 2.87Å; L17-L19 VanDerWaalsContact C-N 3.32Å; L17-L19 PolarHBondContact O-N 3.18Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-C22 PolarHBondContact O-N 3.24Å; L19-S23 PolarHBondContact O-N 3.01Å
20	L	63.7	Low	64.6	Low	115 Å²	115	115.4 Å²	115.4	60%	0.602	63%	0.634	S	S	*	*	H	α-helix	trans	-66.8	-30.6	172.7	-77.9	160.3	0	0	0	112.8	L16 L17 S23	L16-L20 WeakPolarHBondContact O-CB 3.31Å; L16-L20 WeakPolarHBondContact O-CD1 3.35Å; L16-L20 WeakPolarHBondContact O-CG 3.36Å; L16-L20 PolarHBondContact O-N 3.43Å; L17-L20 PolarHBondContact O-N 2.62Å; L20-S23 PolarHBondContact O-OG 3.06Å
21	L	61.4	Low	66.1	Low	129 Å²	129	113.8 Å²	113.8	68%	0.675	63%	0.626	S	S	*	*	H	α-helix	trans	-81.4	-19.8	173.9	-84.7	92.9	0	0	0	113.3	L17 T18 L19	L17-L21 HydrophobicContact CG-CD1 4.44Å; L17-L21 WeakPolarHBondContact O-CD1 3.25Å; L17-L21 PolarHBondContact O-N 2.78Å; T18-L21 PolarHBondContact O-N 2.75Å; L19-L21 VanDerWaalsContact C-N 3.33Å
22	C	61.6	Low	67.5	Low	96 Å²	96	108.5 Å²	108.5	65%	0.649	60%	0.6	S	S	*	*	S	Bend	trans	-90.2	-3.5	178.9	-83.5	0	0	0	0	114.5	T18 L19 S24	T18-C22 WeakPolarHBondContact O-CB 3.48Å; T18-C22 PolarHBondContact O-N 2.97Å; L19-C22 PolarHBondContact O-N 3.24Å; C22-S24 PolarHBondContact O-N 3.46Å; C22-S24 VanDerWaalsContact O-N 3.13Å
23	S	60.6	Low	69.1	Low	103 Å²	103	102.2 Å²	102.2	72%	0.72	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-2.1	-178.5	48.2	0	0	0	0	114.9	L19 L20	L19-S23 PolarHBondContact O-N 3.01Å; L20-S23 PolarHBondContact O-OG 3.06Å
24	S	60	Low	70.5	Confident	95 Å²	95	98 Å²	98	66%	0.664	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	18.6	-178.2	69.5	0	0	0	0	114.6	C22 E26	C22-S24 PolarHBondContact O-N 3.46Å; C22-S24 VanDerWaalsContact O-N 3.13Å; S24-E26 PolarHBondContact O-N 3.42Å
25	L	55.5	Low	71.7	Confident	165 Å²	165	99.2 Å²	99.2	86%	0.864	56%	0.559	S	S	*	*			trans	-79	74.1	169.4	-158.5	74.9	0	0	0	109.2	G27	L25-G27 PolarHBondContact O-N 2.79Å; L25-G27 VanDerWaalsContact O-N 3.16Å
26	E	60.9	Low	73	Confident	184 Å²	184	97.3 Å²	97.3	86%	0.86	55%	0.549	S	S	*	.			trans	-67.4	108.4	167.6	-67.6	-179	133.7	0	0	107.3	S24 Q28	S24-E26 PolarHBondContact O-N 3.42Å; E26-Q28 PolarHBondContact O-N 3.44Å; E26-Q28 VanDerWaalsContact O-N 3.15Å
27	G	59.3	Low	74.4	Confident	66 Å²	66	92.6 Å²	92.6	68%	0.68	53%	0.525	S	S	*	.			trans	-61.4	117.5	171.1	0	0	0	0	0	108.5	L25 E29	L25-G27 PolarHBondContact O-N 2.79Å; L25-G27 VanDerWaalsContact O-N 3.16Å; G27-E29 PolarHBondContact O-N 2.81Å
28	Q	63.3	Low	75.9	Confident	162 Å²	162	91.5 Å²	91.5	76%	0.757	52%	0.52	S	S	*	.			trans	-67	98.6	173.4	-175.4	169.8	-15.1	0	0	108.5	E26 N30	E26-Q28 PolarHBondContact O-N 3.44Å; E26-Q28 VanDerWaalsContact O-N 3.15Å; Q28-N30 PolarHBondContact O-N 3.19Å
29	E	71.6	Confident	77.4	Confident	181 Å²	181	88 Å²	88	85%	0.846	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-69.5	122.2	174.6	-74.3	-166.7	162.4	0	0	109.7	G27 S31	G27-E29 PolarHBondContact O-N 2.81Å; E29-S31 PolarHBondContact O-N 2.91Å
30	N	82.5	Confident	78.9	Confident	70 Å²	70	88 Å²	88	37%	0.374	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-71.5	121.1	173.5	-71.9	-40.1	0	0	0	109.5	Q28 F32 S65	Q28-N30 PolarHBondContact O-N 3.19Å; N30-F32 HydrophobicContact CB-CE2 3.81Å; N30-F32 HydrophobicContact CB-CZ 4.15Å; N30-F32 WeakPolarHBondContact O-CD2 3.4Å; N30-F32 WeakPolarHBondContact O-CE2 3.26Å; N30-S65 VanDerWaalsContact CG-CB 3.47Å; N30-S65 PolarHBondContact ND2-OG 2.91Å; N30-S65 WeakPolarHBondContact OD1-CA 3.36Å
31	S	87.9	Confident	80.6	Confident	60 Å²	60	82.7 Å²	82.7	42%	0.42	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-85.8	146.9	173.2	70.4	0	0	0	0	110.7	E29 T63 T64	E29-S31 PolarHBondContact O-N 2.91Å; S31-T63 VanDerWaalsContact O-CA 3.27Å; S31-T63 WeakPolarHBondContact O-CA 3.2Å; S31-T63 PolarHBondContact O-OG1 2.9Å; S31-T64 PolarHBondContact N-OG1 2.84Å; S31-T64 PolarHBondContact O-N 2.8Å; S31-T64 VanDerWaalsContact O-N 3.12Å; S31-T64 WeakPolarHBondContact OG-CG2 3.39Å; S31-T64 PolarHBondContact OG-OG1 2.86Å; S31-T64 VanDerWaalsContact OG-OG1 3.13Å
32	F	90.8	Very high	82.3	Confident	21 Å²	21	79.4 Å²	79.4	9%	0.092	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.9	174.9	-61.5	-93	0	0	0	108.8	N30 S62 T63 P69 V113 N114 K116	N30-F32 HydrophobicContact CB-CE2 3.81Å; N30-F32 HydrophobicContact CB-CZ 4.15Å; N30-F32 WeakPolarHBondContact O-CD2 3.4Å; N30-F32 WeakPolarHBondContact O-CE2 3.26Å; F32-S62 WeakPolarHBondContact CA-O 3.31Å; F32-T63 HydrophobicContact CD1-CG2 4.5Å; F32-T63 VanDerWaalsContact CD1-OG1 3.23Å; F32-T63 WeakPolarHBondContact CD1-OG1 3.49Å; F32-T63 HydrophobicContact CE1-CG2 4.3Å; F32-T63 WeakPolarHBondContact CE1-OG1 3.35Å; F32-P69 HydrophobicContact CD1-CB 3.95Å; F32-P69 HydrophobicContact CD1-CG 4.03Å; F32-P69 HydrophobicContact CE1-CB 3.64Å; F32-P69 HydrophobicContact CE1-CG 3.93Å; F32-V113 HydrophobicContact CB-CG1 4.39Å; F32-V113 HydrophobicContact CD1-CG1 4.08Å; F32-V113 HydrophobicContact CG-CG1 4.39Å; F32-N114 HydrophobicContact CD2-CB 3.84Å; F32-N114 WeakPolarHBondContact CD2-ND2 3.17Å; F32-N114 HydrophobicContact CE2-CB 4.25Å; F32-N114 HydrophobicContact CG-CB 4.17Å; F32-K116 WeakPolarHBondContact O-CD 3.4Å; F32-K116 WeakPolarHBondContact O-CE 3.41Å; F32-K116 PolarHBondContact O-NZ 3.05Å; F32-K116 VanDerWaalsContact O-NZ 3.07Å
33	T	94	Very high	84	Confident	68 Å²	68	79.6 Å²	79.6	42%	0.417	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	128.5	177.7	-59.4	0	0	0	0	109.1	V61 S62	T33-V61 CarbonylContact O-C 3.57Å; T33-V61 WeakPolarHBondContact O-CA 3.3Å; T33-S62 PolarHBondContact N-O 2.81Å; T33-S62 PolarHBondContact O-N 2.96Å
34	I	96.8	Very high	85.8	Confident	19 Å²	19	79 Å²	79	10%	0.097	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	100.6	172.3	-50.7	174.4	0	0	0	107.4	V37 D60 V61 V113 K116 K118	I34-V37 HydrophobicContact CG2-CG2 3.55Å; I34-D60 CarbonylContact C-O 3.6Å; I34-V61 HydrophobicContact CG1-CG2 4.38Å; I34-V61 HydrophobicContact CG2-CG2 4.41Å; I34-V113 HydrophobicContact CD1-CB 4.38Å; I34-V113 HydrophobicContact CG1-CB 4.49Å; I34-K116 HydrophobicContact CD1-CB 4.28Å; I34-K116 WeakPolarHBondContact CD1-O 3.27Å; I34-K118 HydrophobicContact CB-CB 4.23Å; I34-K118 HydrophobicContact CB-CD 4.44Å; I34-K118 HydrophobicContact CD1-CB 4.27Å; I34-K118 HydrophobicContact CG2-CB 3.85Å; I34-K118 HydrophobicContact CG2-CD 4.01Å
35	N	97.1	Very high	87.6	Confident	63 Å²	63	77.2 Å²	77.2	34%	0.337	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	-51.7	-176.4	-63.1	-24.3	0	0	0	110.7	D60 S62 K118	N35-D60 HydrophobicContact CB-CB 4.1Å; N35-D60 VanDerWaalsContact CB-OD2 3.23Å; N35-D60 WeakPolarHBondContact CB-OD2 3.45Å; N35-D60 PolarHBondContact N-O 2.87Å; N35-D60 PolarHBondContact ND2-OD2 3.09Å; N35-S62 PolarHBondContact ND2-OG 2.03Å; N35-K118 PolarHBondContact O-NZ 2.76Å
36	S	97.7	Very high	89.7	Confident	39 Å²	39	72.3 Å²	72.3	27%	0.273	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	158.1	175.4	76.9	0	0	0	0	111.5	D38 D60	S36-D38 PolarHBondContact OG-OD2 2.78Å; S36-D38 VanDerWaalsContact OG-OD2 3.1Å; S36-D60 PolarHBondContact N-O 2.83Å; S36-D60 PolarHBondContact O-N 2.85Å
37	V	98.3	Very high	91.4	Very high	10 Å²	10	63.8 Å²	63.8	6%	0.061	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.5	166.9	-172.6	0	0	0	0	106.3	I34 F58 V111 K118 T120	I34-V37 HydrophobicContact CG2-CG2 3.55Å; V37-F58 CarbonylContact C-O 3.57Å; V37-F58 VanDerWaalsContact CA-O 3.29Å; V37-F58 WeakPolarHBondContact CA-O 3.35Å; V37-F58 WeakPolarHBondContact CG1-O 3.41Å; V37-V111 HydrophobicContact CB-CG2 4.48Å; V37-V111 HydrophobicContact CG1-CB 4.3Å; V37-V111 HydrophobicContact CG1-CG2 3.48Å; V37-V111 VanDerWaalsContact CG1-CG2 3.48Å; V37-V111 HydrophobicContact CG2-CB 4.03Å; V37-V111 HydrophobicContact CG2-CG2 4.07Å; V37-K118 HydrophobicContact CG2-CB 3.73Å; V37-K118 HydrophobicContact CG2-CD 4.15Å; V37-K118 HydrophobicContact CG2-CG 3.89Å; V37-T120 HydrophobicContact CB-CG2 4.06Å; V37-T120 HydrophobicContact CG1-CG2 3.45Å; V37-T120 VanDerWaalsContact CG1-CG2 3.45Å
38	D	98.1	Very high	93.2	Very high	79 Å²	79	65.2 Å²	65.2	42%	0.422	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.8	-174.8	-65.4	-74.9	0	0	0	109.9	S36 F58	S36-D38 PolarHBondContact OG-OD2 2.78Å; S36-D38 VanDerWaalsContact OG-OD2 3.1Å; D38-F58 PolarHBondContact N-O 2.81Å; D38-F58 PolarHBondContact O-N 2.82Å
39	M	98.2	Very high	94.7	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.049	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.5	174.6	-154.3	170.4	-178.6	0	0	110.1	W45 L55 Q56 F75 C109 T120 Y123	M39-W45 HydrophobicContact CB-CH2 4.21Å; M39-W45 HydrophobicContact CG-CH2 4.07Å; M39-W45 HydrophobicContact SD-CH2 4.46Å; M39-L55 HydrophobicContact CE-CB 3.78Å; M39-L55 HydrophobicContact CE-CD1 3.99Å; M39-L55 HydrophobicContact CE-CD2 4.25Å; M39-L55 HydrophobicContact CE-CG 4.23Å; M39-Q56 CarbonylContact C-O 3.52Å; M39-Q56 VanDerWaalsContact CA-O 3.28Å; M39-Q56 WeakPolarHBondContact CA-O 3.3Å; M39-Q56 WeakPolarHBondContact CG-O 3.47Å; M39-F75 HydrophobicContact CE-CD1 3.72Å; M39-F75 HydrophobicContact CE-CE1 4.06Å; M39-C109 HydrophobicContact SD-CB 4.27Å; M39-T120 HydrophobicContact CB-CG2 4.18Å; M39-Y123 HydrophobicContact CB-CD2 3.72Å; M39-Y123 HydrophobicContact CB-CE2 3.42Å; M39-Y123 VanDerWaalsContact CB-CE2 3.42Å; M39-Y123 HydrophobicContact SD-CD2 4.3Å
40	K	98.3	Very high	95.8	Very high	112 Å²	112	51.6 Å²	51.6	49%	0.487	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.3	174.4	-168	174.8	-178.9	178.7	0	110.2	L42 Q56 F58	K40-L42 HydrophobicContact CD-CD2 4.21Å; K40-L42 HydrophobicContact CG-CD2 4.44Å; K40-Q56 HydrophobicContact CB-CB 4.5Å; K40-Q56 PolarHBondContact N-O 3.15Å; K40-Q56 PolarHBondContact O-N 2.87Å; K40-F58 HydrophobicContact CB-CE2 3.8Å
41	S	98.4	Very high	96.5	Very high	4 Å²	4	54.5 Å²	54.5	3%	0.028	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	140.5	166.2	-178.5	0	0	0	0	110.6	D44 L53 T54	S41-D44 WeakPolarHBondContact CB-O 3.26Å; S41-D44 VanDerWaalsContact OG-C 3.3Å; S41-D44 PolarHBondContact OG-O 3Å; S41-L53 WeakPolarHBondContact OG-CD1 3.47Å; S41-T54 CarbonylContact C-O 3.54Å
42	L	98.3	Very high	97	Very high	60 Å²	60	55.6 Å²	55.6	31%	0.314	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.7	168.9	-59.3	175.5	0	0	0	109.2	K40 T54 Q56	K40-L42 HydrophobicContact CD-CD2 4.21Å; K40-L42 HydrophobicContact CG-CD2 4.44Å; L42-T54 PolarHBondContact N-O 3.03Å; L42-T54 PolarHBondContact O-N 3.37Å; L42-Q56 HydrophobicContact CD1-CG 4.35Å
43	P	97.3	Very high	97.3	Very high	100 Å²	100	54.6 Å²	54.6	65%	0.649	29%	0.294	S	S	*	.	S	Bend	cis	-77.9	-31.6	5.6	30.6	-34.8	0	0	0	114.5
44	D	97.9	Very high	97.5	Very high	92 Å²	92	53 Å²	53	49%	0.492	28%	0.284	S	S	.	.			trans	-156.6	172.7	-177.3	-158.6	-5.9	0	0	0	110.2	S41 T46 V47	S41-D44 WeakPolarHBondContact CB-O 3.26Å; S41-D44 VanDerWaalsContact OG-C 3.3Å; S41-D44 PolarHBondContact OG-O 3Å; D44-T46 VanDerWaalsContact C-N 3.3Å; D44-V47 WeakPolarHBondContact O-CG2 3.4Å
45	W	98.1	Very high	97.6	Very high	56 Å²	56	52 Å²	52	21%	0.212	28%	0.279	C	S	.	.	S	Bend	trans	-73.2	-22.5	175.5	-64.8	106.6	0	0	0	113.1	M39 L55 Y123 V125 L126	M39-W45 HydrophobicContact CB-CH2 4.21Å; M39-W45 HydrophobicContact CG-CH2 4.07Å; M39-W45 HydrophobicContact SD-CH2 4.46Å; W45-L55 HydrophobicContact CZ3-CD2 4.13Å; W45-Y123 HydrophobicContact CD2-CD1 4.33Å; W45-Y123 AromaticContact CE2-CD1 3.6Å; W45-Y123 HydrophobicContact CE3-CG 4.48Å; W45-Y123 AromaticContact CH2-CD1 3.62Å; W45-Y123 HydrophobicContact CH2-CD1 3.62Å; W45-Y123 AromaticContact CH2-CD2 3.98Å; W45-Y123 HydrophobicContact CH2-CD2 3.98Å; W45-Y123 HydrophobicContact CH2-CE1 4.38Å; W45-Y123 AromaticContact CH2-CG 3.37Å; W45-Y123 HydrophobicContact CH2-CG 3.37Å; W45-Y123 AromaticContact CZ2-CD1 3.2Å; W45-Y123 HydrophobicContact CZ2-CD1 3.2Å; W45-Y123 HydrophobicContact CZ2-CD2 4.3Å; W45-Y123 AromaticContact CZ2-CE1 3.75Å; W45-Y123 HydrophobicContact CZ2-CE1 3.75Å; W45-Y123 AromaticContact CZ2-CG 3.52Å; W45-Y123 HydrophobicContact CZ2-CG 3.52Å; W45-Y123 HydrophobicContact CZ3-CD1 4.32Å; W45-Y123 AromaticContact CZ3-CG 3.9Å; W45-Y123 HydrophobicContact CZ3-CG 3.9Å; W45-V125 HydrophobicContact CE3-CG2 3.76Å; W45-V125 HydrophobicContact CZ3-CG2 3.99Å; W45-V125 WeakPolarHBondContact O-CA 3.45Å; W45-L126 PolarHBondContact O-N 3.23Å
46	T	98.3	Very high	97.7	Very high	62 Å²	62	50.9 Å²	50.9	38%	0.38	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.6	169.8	-56.6	0	0	0	0	109.9	D44 L126 E128	D44-T46 VanDerWaalsContact C-N 3.3Å; T46-L126 CarbonylContact C-O 3.56Å; T46-L126 VanDerWaalsContact CA-O 3.3Å; T46-L126 WeakPolarHBondContact CA-O 3.35Å; T46-L126 HydrophobicContact CG2-CB 4.37Å; T46-L126 HydrophobicContact CG2-CD2 4.22Å; T46-L126 HydrophobicContact CG2-CG 4.39Å; T46-E128 VanDerWaalsContact CG2-CD 3.5Å; T46-E128 HydrophobicContact CG2-CG 3.86Å
47	V	97.3	Very high	97.7	Very high	5 Å²	5	49 Å²	49	3%	0.03	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.7	-172	-170.7	0	0	0	0	110.8	D44 K51 L53 V99 L126 V127 E128	D44-V47 WeakPolarHBondContact O-CG2 3.4Å; V47-K51 HydrophobicContact CG1-CB 3.9Å; V47-L53 HydrophobicContact CG2-CD1 4.07Å; V47-V99 HydrophobicContact CB-CG1 4.2Å; V47-V99 HydrophobicContact CG1-CG1 3.73Å; V47-L126 PolarHBondContact N-O 3.36Å; V47-V127 CarbonylContact O-C 3.52Å; V47-V127 VanDerWaalsContact O-CA 3.26Å; V47-V127 WeakPolarHBondContact O-CA 3.46Å; V47-E128 PolarHBondContact O-N 3Å
48	Q	96.5	Very high	97.7	Very high	96 Å²	96	51.7 Å²	51.7	45%	0.449	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	140.7	175.9	-64	-63.5	-46.8	0	0	111.4	G50 K51 E128	Q48-G50 PolarHBondContact O-N 2.81Å; Q48-K51 HydrophobicContact CB-CG 4.02Å; Q48-K51 VanDerWaalsContact O-CB 3.26Å; Q48-K51 WeakPolarHBondContact O-CB 3.5Å; Q48-K51 WeakPolarHBondContact O-CG 3.42Å; Q48-K51 PolarHBondContact O-N 2.87Å; Q48-E128 CarbonylContact C-O 3.53Å; Q48-E128 PolarHBondContact NE2-OE2 3.07Å
49	N	96	Very high	97.7	Very high	27 Å²	27	48.4 Å²	48.4	14%	0.144	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	134.7	178	-168.4	-42.6	0	0	0	111.1	K51 V99 R100 V127 E128	N49-K51 VanDerWaalsContact C-N 3.28Å; N49-K51 PolarHBondContact O-N 2.91Å; N49-V99 WeakPolarHBondContact CA-O 3.44Å; N49-R100 VanDerWaalsContact OD1-CD 3.25Å; N49-R100 WeakPolarHBondContact OD1-CD 3.43Å; N49-R100 PolarHBondContact OD1-NH1 3.33Å; N49-V127 HydrophobicContact CB-CG1 4.24Å; N49-E128 WeakPolarHBondContact CB-O 3.43Å; N49-E128 PolarHBondContact N-O 2.97Å
50	G	94.9	Very high	97.6	Very high	30 Å²	30	51.8 Å²	51.8	31%	0.309	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-1.1	-177.8	0	0	0	0	0	114.6	Q48 V99	Q48-G50 PolarHBondContact O-N 2.81Å; G50-V99 PolarHBondContact N-O 3.35Å
51	K	96	Very high	97.5	Very high	131 Å²	131	47.9 Å²	47.9	57%	0.57	26%	0.257	S	S	*	.	S	Bend	trans	-84.6	163	169.8	-61.6	-61	-176.4	-177.9	0	111.5	V47 Q48 N49 E98 V99	V47-K51 HydrophobicContact CG1-CB 3.9Å; Q48-K51 HydrophobicContact CB-CG 4.02Å; Q48-K51 VanDerWaalsContact O-CB 3.26Å; Q48-K51 WeakPolarHBondContact O-CB 3.5Å; Q48-K51 WeakPolarHBondContact O-CG 3.42Å; Q48-K51 PolarHBondContact O-N 2.87Å; N49-K51 VanDerWaalsContact C-N 3.28Å; N49-K51 PolarHBondContact O-N 2.91Å; K51-E98 CarbonylContact O-C 3.58Å; K51-E98 WeakPolarHBondContact O-CA 3.44Å; K51-V99 WeakPolarHBondContact O-CB 3.49Å; K51-V99 VanDerWaalsContact O-CG1 3.3Å; K51-V99 WeakPolarHBondContact O-CG1 3.02Å; K51-V99 PolarHBondContact O-N 3.16Å
52	N	97.8	Very high	97.2	Very high	84 Å²	84	50.5 Å²	50.5	45%	0.449	28%	0.275	S	S	.	.			trans	-84.9	142.7	176.8	-62	-16.2	0	0	0	110.2	F95 E98	N52-F95 HydrophobicContact CB-CE2 3.69Å; N52-F95 HydrophobicContact CB-CZ 3.83Å; N52-E98 PolarHBondContact OD1-N 2.91Å
53	L	98.3	Very high	96.9	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.3	177.6	169.6	57.7	0	0	0	109.1	S41 V47 L55 I96 V99 V125	S41-L53 WeakPolarHBondContact OG-CD1 3.47Å; V47-L53 HydrophobicContact CG2-CD1 4.07Å; L53-L55 HydrophobicContact CD1-CD2 4.2Å; L53-L55 HydrophobicContact CG-CD2 4.42Å; L53-L55 HydrophobicContact CG-CG 4.49Å; L53-I96 HydrophobicContact CB-CB 4.26Å; L53-I96 HydrophobicContact CD2-CD1 4.12Å; L53-I96 HydrophobicContact CG-CD1 4.49Å; L53-I96 PolarHBondContact N-O 2.88Å; L53-I96 PolarHBondContact O-N 3.13Å; L53-V99 HydrophobicContact CB-CB 4.3Å; L53-V99 HydrophobicContact CB-CG2 4.39Å; L53-V99 HydrophobicContact CD2-CG2 4.01Å; L53-V125 HydrophobicContact CD2-CG1 3.77Å
54	T	98.8	Very high	96.6	Very high	33 Å²	33	48.7 Å²	48.7	20%	0.202	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.7	170.8	-52	0	0	0	0	109.8	S41 L42 Q56 Y94 F95	S41-T54 CarbonylContact C-O 3.54Å; L42-T54 PolarHBondContact N-O 3.03Å; L42-T54 PolarHBondContact O-N 3.37Å; T54-Q56 HydrophobicContact CG2-CG 4.02Å; T54-Y94 WeakPolarHBondContact CA-O 3.27Å; T54-F95 WeakPolarHBondContact OG1-CD2 3.49Å
55	L	98.7	Very high	96	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.5	172.3	-62.9	177	0	0	0	108.7	M39 W45 L53 F82 S93 Y94 I96 Y107 V125	M39-L55 HydrophobicContact CE-CB 3.78Å; M39-L55 HydrophobicContact CE-CD1 3.99Å; M39-L55 HydrophobicContact CE-CD2 4.25Å; M39-L55 HydrophobicContact CE-CG 4.23Å; W45-L55 HydrophobicContact CZ3-CD2 4.13Å; L53-L55 HydrophobicContact CD1-CD2 4.2Å; L53-L55 HydrophobicContact CG-CD2 4.42Å; L53-L55 HydrophobicContact CG-CG 4.49Å; L55-F82 HydrophobicContact CD1-CZ 4.31Å; L55-S93 CarbonylContact O-C 3.59Å; L55-S93 VanDerWaalsContact O-CA 3.24Å; L55-S93 WeakPolarHBondContact O-CA 3.44Å; L55-Y94 PolarHBondContact N-O 3.26Å; L55-Y94 PolarHBondContact O-N 3.1Å; L55-I96 HydrophobicContact CD1-CD1 4.29Å; L55-Y107 HydrophobicContact CD1-CD1 3.39Å; L55-Y107 HydrophobicContact CD1-CE1 3.46Å; L55-Y107 VanDerWaalsContact CD1-CE1 3.46Å; L55-Y107 HydrophobicContact CD1-CG 4.12Å; L55-V125 HydrophobicContact CD2-CG2 4.23Å
56	Q	98.6	Very high	95.4	Very high	39 Å²	39	51.6 Å²	51.6	18%	0.182	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.2	-179.9	-53.6	-165.4	-67.8	0	0	109.8	M39 K40 L42 T54 F58 E92 S93	M39-Q56 CarbonylContact C-O 3.52Å; M39-Q56 VanDerWaalsContact CA-O 3.28Å; M39-Q56 WeakPolarHBondContact CA-O 3.3Å; M39-Q56 WeakPolarHBondContact CG-O 3.47Å; K40-Q56 HydrophobicContact CB-CB 4.5Å; K40-Q56 PolarHBondContact N-O 3.15Å; K40-Q56 PolarHBondContact O-N 2.87Å; L42-Q56 HydrophobicContact CD1-CG 4.35Å; T54-Q56 HydrophobicContact CG2-CG 4.02Å; Q56-F58 HydrophobicContact CB-CD2 4.29Å; Q56-F58 HydrophobicContact CB-CE2 3.36Å; Q56-F58 HydrophobicContact CB-CZ 3.56Å; Q56-F58 HydrophobicContact CG-CE2 4.47Å; Q56-F58 HydrophobicContact CG-CZ 4.32Å; Q56-E92 WeakPolarHBondContact CA-O 3.32Å; Q56-S93 WeakPolarHBondContact CG-OG 3.38Å; Q56-S93 PolarHBondContact NE2-OG 2.93Å
57	C	98.6	Very high	94.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.9	174.3	-178.8	0	0	0	0	109.3	F75 T91 E92 C109	C57-F75 HydrophobicContact CB-CE1 3.74Å; C57-F75 HydrophobicContact CB-CE2 4.25Å; C57-F75 HydrophobicContact CB-CZ 3.47Å; C57-F75 VanDerWaalsContact CB-CZ 3.47Å; C57-T91 VanDerWaalsContact O-CA 3.27Å; C57-T91 WeakPolarHBondContact O-CA 3.34Å; C57-E92 PolarHBondContact N-O 2.82Å; C57-E92 PolarHBondContact O-N 3.45Å; C57-C109 HydrophobicContact CB-CB 3.69Å; C57-C109 WeakPolarHBondContact CB-SG 3.01Å; C57-C109 WeakPolarHBondContact SG-CB 3.47Å; C57-C109 CovalentContact SG-SG 2.03Å; C57-C109 PolarHBondContact SG-SG 3.46Å
58	F	97.5	Very high	94.3	Very high	65 Å²	65	60.9 Å²	60.9	29%	0.285	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.3	-177.2	-54	-99.5	0	0	0	109.3	V37 D38 K40 Q56 T91	V37-F58 CarbonylContact C-O 3.57Å; V37-F58 VanDerWaalsContact CA-O 3.29Å; V37-F58 WeakPolarHBondContact CA-O 3.35Å; V37-F58 WeakPolarHBondContact CG1-O 3.41Å; D38-F58 PolarHBondContact N-O 2.81Å; D38-F58 PolarHBondContact O-N 2.82Å; K40-F58 HydrophobicContact CB-CE2 3.8Å; Q56-F58 HydrophobicContact CB-CD2 4.29Å; Q56-F58 HydrophobicContact CB-CE2 3.36Å; Q56-F58 HydrophobicContact CB-CZ 3.56Å; Q56-F58 HydrophobicContact CG-CE2 4.47Å; Q56-F58 HydrophobicContact CG-CZ 4.32Å; F58-T91 HydrophobicContact CD1-CG2 3.33Å; F58-T91 WeakPolarHBondContact CD1-OG1 3.21Å; F58-T91 HydrophobicContact CE1-CG2 3.26Å; F58-T91 HydrophobicContact CG-CG2 4.04Å; F58-T91 HydrophobicContact CZ-CG2 3.94Å
59	A	97.4	Very high	94	Very high	11 Å²	11	57.3 Å²	57.3	9%	0.091	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.2	173.6	0	0	0	0	0	110	V61 S90 V111	A59-V61 HydrophobicContact CB-CG2 3.96Å; A59-S90 PolarHBondContact N-O 2.79Å; A59-S90 WeakPolarHBondContact O-CB 2.98Å; A59-V111 HydrophobicContact CB-CB 4.37Å; A59-V111 HydrophobicContact CB-CG1 3.85Å; A59-V111 HydrophobicContact CB-CG2 4.11Å
60	D	96.6	Very high	93.9	Very high	81 Å²	81	61.7 Å²	61.7	43%	0.433	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	114.9	163	-179.8	25.6	0	0	0	108.8	I34 N35 S36	I34-D60 CarbonylContact C-O 3.6Å; N35-D60 HydrophobicContact CB-CB 4.1Å; N35-D60 VanDerWaalsContact CB-OD2 3.23Å; N35-D60 WeakPolarHBondContact CB-OD2 3.45Å; N35-D60 PolarHBondContact N-O 2.87Å; N35-D60 PolarHBondContact ND2-OD2 3.09Å; S36-D60 PolarHBondContact N-O 2.83Å; S36-D60 PolarHBondContact O-N 2.85Å
61	V	95.3	Very high	94	Very high	30 Å²	30	60.7 Å²	60.7	18%	0.182	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.8	-174.5	-177.9	0	0	0	0	109.8	T33 I34 A59 P69 V113	T33-V61 CarbonylContact O-C 3.57Å; T33-V61 WeakPolarHBondContact O-CA 3.3Å; I34-V61 HydrophobicContact CG1-CG2 4.38Å; I34-V61 HydrophobicContact CG2-CG2 4.41Å; A59-V61 HydrophobicContact CB-CG2 3.96Å; V61-P69 HydrophobicContact CG1-CG 4.22Å; V61-V113 HydrophobicContact CG1-CG1 4.36Å; V61-V113 HydrophobicContact CG2-CG2 4.26Å
62	S	93.4	Very high	94.1	Very high	58 Å²	58	57.6 Å²	57.6	41%	0.406	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.8	172.1	-67.4	0	0	0	0	110.5	F32 T33 N35	F32-S62 WeakPolarHBondContact CA-O 3.31Å; T33-S62 PolarHBondContact N-O 2.81Å; T33-S62 PolarHBondContact O-N 2.96Å; N35-S62 PolarHBondContact ND2-OG 2.03Å
63	T	91.7	Very high	94.1	Very high	50 Å²	50	53.6 Å²	53.6	31%	0.307	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.1	176.3	-176.2	0	0	0	0	111.5	S31 F32 S65	S31-T63 VanDerWaalsContact O-CA 3.27Å; S31-T63 WeakPolarHBondContact O-CA 3.2Å; S31-T63 PolarHBondContact O-OG1 2.9Å; F32-T63 HydrophobicContact CD1-CG2 4.5Å; F32-T63 VanDerWaalsContact CD1-OG1 3.23Å; F32-T63 WeakPolarHBondContact CD1-OG1 3.49Å; F32-T63 HydrophobicContact CE1-CG2 4.3Å; F32-T63 WeakPolarHBondContact CE1-OG1 3.35Å; T63-S65 VanDerWaalsContact OG1-CB 3.27Å; T63-S65 WeakPolarHBondContact OG1-CB 3.47Å; T63-S65 PolarHBondContact OG1-N 2.63Å
64	T	90.4	Very high	94.1	Very high	72 Å²	72	54.2 Å²	54.2	44%	0.442	28%	0.284	S	S	.	.	S	Bend	trans	-83.9	-3.2	167.5	57.5	0	0	0	0	112.4	S31	S31-T64 PolarHBondContact N-OG1 2.84Å; S31-T64 PolarHBondContact O-N 2.8Å; S31-T64 VanDerWaalsContact O-N 3.12Å; S31-T64 WeakPolarHBondContact OG-CG2 3.39Å; S31-T64 PolarHBondContact OG-OG1 2.86Å; S31-T64 VanDerWaalsContact OG-OG1 3.13Å
65	S	86.6	Confident	94.1	Very high	17 Å²	17	52.7 Å²	52.7	12%	0.119	27%	0.274	C	S	.	.	S	Bend	trans	-78.2	144.6	177.2	-161.6	0	0	0	0	112	N30 T63 V67	N30-S65 VanDerWaalsContact CG-CB 3.47Å; N30-S65 PolarHBondContact ND2-OG 2.91Å; N30-S65 WeakPolarHBondContact OD1-CA 3.36Å; T63-S65 VanDerWaalsContact OG1-CB 3.27Å; T63-S65 WeakPolarHBondContact OG1-CB 3.47Å; T63-S65 PolarHBondContact OG1-N 2.63Å; S65-V67 PolarHBondContact O-N 2.84Å; S65-V67 PolarHBondContact OG-N 2.78Å
66	H	84.9	Confident	94.1	Very high	192 Å²	192	55 Å²	55	89%	0.889	28%	0.284	S	S	*	.	S	Bend	trans	-75.4	-10.9	166.4	-61	-64.7	0	0	0	112.9
67	V	85.6	Confident	94.1	Very high	102 Å²	102	55.4 Å²	55.4	62%	0.618	29%	0.285	S	S	*	.	S	Bend	trans	-98	129.7	179.6	-175.3	0	0	0	0	109	S65	S65-V67 PolarHBondContact O-N 2.84Å; S65-V67 PolarHBondContact OG-N 2.78Å
68	K	86	Confident	94.1	Very high	161 Å²	161	59.1 Å²	59.1	70%	0.7	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-62.3	129.1	173	-70.1	-174.4	177.9	-177.1	0	109.2	M88	K68-M88 HydrophobicContact CB-CE 3.94Å; K68-M88 WeakPolarHBondContact O-CE 3.45Å
69	P	90.4	Very high	94.2	Very high	20 Å²	20	61.4 Å²	61.4	13%	0.13	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-68.5	150.9	175.7	24.1	-29.1	0	0	0	111.2	F32 V61 H71 V113	F32-P69 HydrophobicContact CD1-CB 3.95Å; F32-P69 HydrophobicContact CD1-CG 4.03Å; F32-P69 HydrophobicContact CE1-CB 3.64Å; F32-P69 HydrophobicContact CE1-CG 3.93Å; V61-P69 HydrophobicContact CG1-CG 4.22Å; P69-H71 PolarHBondContact O-CE1 2.85Å; P69-H71 VanDerWaalsContact O-CE1 3.26Å; P69-H71 PolarHBondContact O-ND1 3.23Å; P69-V113 HydrophobicContact CB-CG1 3.59Å; P69-V113 HydrophobicContact CG-CG1 4.1Å
70	Q	94.7	Very high	94.2	Very high	120 Å²	120	65.6 Å²	65.6	56%	0.561	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-77.9	136	160.5	-173.1	176.1	-61.6	0	0	108.6	M88	Q70-M88 HydrophobicContact CB-SD 3.88Å; Q70-M88 HydrophobicContact CG-SD 4.32Å
71	H	96.6	Very high	94.3	Very high	9 Å²	9	65.5 Å²	65.5	4%	0.042	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134	176.5	-51.4	80.7	0	0	0	108.1	P69 M73 S86 S87 K89 V111 V113	P69-H71 PolarHBondContact O-CE1 2.85Å; P69-H71 VanDerWaalsContact O-CE1 3.26Å; P69-H71 PolarHBondContact O-ND1 3.23Å; H71-M73 HydrophobicContact CB-CE 3.28Å; H71-M73 HydrophobicContact CB-SD 3.51Å; H71-M73 VanDerWaalsContact CB-SD 3.51Å; H71-S86 CarbonylContact O-C 3.57Å; H71-S86 VanDerWaalsContact O-CA 3.27Å; H71-S86 WeakPolarHBondContact O-CA 3.25Å; H71-S87 PolarHBondContact N-O 3.11Å; H71-S87 PolarHBondContact ND1-O 3.07Å; H71-S87 PolarHBondContact O-N 2.8Å; H71-K89 PolarHBondContact ND1-O 2.71Å; H71-K89 VanDerWaalsContact ND1-O 3.11Å; H71-V111 HydrophobicContact CB-CG1 4.45Å; H71-V113 HydrophobicContact CB-CG2 4.27Å; H71-V113 WeakPolarHBondContact CD2-CG2 2.99Å
72	Q	98.1	Very high	94.4	Very high	65 Å²	65	67.2 Å²	67.2	30%	0.304	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	120.7	166.7	-178.4	179.3	0.7	0	0	108.4	L74 N84 I85 V111 I112	Q72-L74 HydrophobicContact CG-CD2 4.05Å; Q72-L74 HydrophobicContact CG-CG 4.49Å; Q72-N84 PolarHBondContact NE2-ND2 3.26Å; Q72-N84 PolarHBondContact NE2-OD1 3.11Å; Q72-N84 VanDerWaalsContact NE2-OD1 3.15Å; Q72-I85 CarbonylContact C-O 3.55Å; Q72-I85 WeakPolarHBondContact CA-O 3.28Å; Q72-V111 CarbonylContact O-C 3.49Å; Q72-V111 WeakPolarHBondContact O-CA 3.4Å; Q72-I112 HydrophobicContact CB-CB 4.28Å; Q72-I112 PolarHBondContact N-O 3.36Å; Q72-I112 PolarHBondContact O-N 3.5Å
73	M	98.3	Very high	94.7	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.9	-179.4	-62.4	77.5	159.5	0	0	109.7	H71 F75 N84 I85 K89 E92 T110 V111	H71-M73 HydrophobicContact CB-CE 3.28Å; H71-M73 HydrophobicContact CB-SD 3.51Å; H71-M73 VanDerWaalsContact CB-SD 3.51Å; M73-F75 HydrophobicContact CB-CD2 4.49Å; M73-F75 HydrophobicContact CB-CE2 3.91Å; M73-N84 WeakPolarHBondContact O-CA 3.33Å; M73-I85 HydrophobicContact CB-CG2 4.03Å; M73-I85 PolarHBondContact N-O 2.57Å; M73-I85 PolarHBondContact O-N 3.48Å; M73-K89 WeakPolarHBondContact CE-O 3.48Å; M73-E92 HydrophobicContact CE-CB 4.48Å; M73-E92 HydrophobicContact CE-CG 3.92Å; M73-E92 HydrophobicContact CG-CB 4.38Å; M73-E92 HydrophobicContact CG-CG 4.49Å; M73-E92 HydrophobicContact SD-CB 4.48Å; M73-E92 HydrophobicContact SD-CG 3.97Å; M73-T110 WeakPolarHBondContact CA-O 3.23Å; M73-V111 HydrophobicContact CG-CG2 4.13Å
74	L	98.7	Very high	95	Very high	14 Å²	14	69.3 Å²	69.3	7%	0.073	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.3	-177.6	-56.4	-177.4	0	0	0	108.6	Q72 Y76 L81 N84 C109 T110 I112	Q72-L74 HydrophobicContact CG-CD2 4.05Å; Q72-L74 HydrophobicContact CG-CG 4.49Å; L74-Y76 HydrophobicContact CB-CD2 4.39Å; L74-Y76 HydrophobicContact CB-CE2 3.5Å; L74-Y76 VanDerWaalsContact CB-CE2 3.5Å; L74-Y76 WeakPolarHBondContact CD1-OH 3.27Å; L74-Y76 WeakPolarHBondContact O-CD2 3.49Å; L74-L81 HydrophobicContact CB-CD1 3.83Å; L74-L81 HydrophobicContact CD2-CD1 4.14Å; L74-N84 HydrophobicContact CD2-CB 3.73Å; L74-N84 WeakPolarHBondContact CD2-OD1 3.34Å; L74-C109 CarbonylContact O-C 3.59Å; L74-C109 VanDerWaalsContact O-CA 3.29Å; L74-C109 WeakPolarHBondContact O-CA 3.24Å; L74-T110 PolarHBondContact N-O 2.95Å; L74-T110 PolarHBondContact O-N 2.93Å; L74-I112 HydrophobicContact CD1-CD1 3.72Å; L74-I112 HydrophobicContact CG-CD1 4.5Å
75	F	98.8	Very high	95.4	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.1	178.5	-64.7	-113.5	0	0	0	109.9	M39 C57 M73 F82 Y83 I85	M39-F75 HydrophobicContact CE-CD1 3.72Å; M39-F75 HydrophobicContact CE-CE1 4.06Å; C57-F75 HydrophobicContact CB-CE1 3.74Å; C57-F75 HydrophobicContact CB-CE2 4.25Å; C57-F75 HydrophobicContact CB-CZ 3.47Å; C57-F75 VanDerWaalsContact CB-CZ 3.47Å; M73-F75 HydrophobicContact CB-CD2 4.49Å; M73-F75 HydrophobicContact CB-CE2 3.91Å; F75-F82 HydrophobicContact CB-CD1 4.45Å; F75-F82 HydrophobicContact CB-CE1 3.76Å; F75-F82 HydrophobicContact CB-CE2 3.94Å; F75-F82 HydrophobicContact CB-CZ 3.46Å; F75-F82 VanDerWaalsContact CB-CZ 3.46Å; F75-F82 HydrophobicContact CD1-CZ 4.43Å; F75-F82 HydrophobicContact CG-CZ 4.35Å; F75-F82 WeakPolarHBondContact O-CD1 3.24Å; F75-F82 PolarHBondContact O-N 3.46Å; F75-Y83 AromaticContact CD2-CD1 3.57Å; F75-Y83 HydrophobicContact CD2-CD1 3.57Å; F75-Y83 HydrophobicContact CD2-CE1 4.39Å; F75-Y83 HydrophobicContact CD2-CG 4.44Å; F75-Y83 AromaticContact CE2-CD1 3.82Å; F75-Y83 HydrophobicContact CE2-CD1 3.82Å; F75-Y83 HydrophobicContact CE2-CE1 4.21Å; F75-Y83 HydrophobicContact CG-CD1 4.19Å; F75-Y83 PolarHBondContact N-O 3.09Å; F75-Y83 PolarHBondContact O-N 2.86Å; F75-I85 HydrophobicContact CE2-CG2 4.45Å
76	Y	98.8	Very high	95.9	Very high	50 Å²	50	69.8 Å²	69.8	20%	0.196	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	143	-178.2	-62.1	-96.5	0	0	0	110.1	L74 V80 L81 F82 Y107 K108	L74-Y76 HydrophobicContact CB-CD2 4.39Å; L74-Y76 HydrophobicContact CB-CE2 3.5Å; L74-Y76 VanDerWaalsContact CB-CE2 3.5Å; L74-Y76 WeakPolarHBondContact CD1-OH 3.27Å; L74-Y76 WeakPolarHBondContact O-CD2 3.49Å; Y76-V80 VanDerWaalsContact CA-O 3.31Å; Y76-V80 WeakPolarHBondContact CA-O 3.21Å; Y76-L81 HydrophobicContact CD1-CB 4.02Å; Y76-L81 HydrophobicContact CE1-CB 3.74Å; Y76-L81 HydrophobicContact CE1-CD1 4.15Å; Y76-L81 HydrophobicContact CE2-CD1 4.28Å; Y76-F82 VanDerWaalsContact C-CE1 3.42Å; Y76-Y107 VanDerWaalsContact O-CA 3.32Å; Y76-Y107 WeakPolarHBondContact O-CA 3.48Å; Y76-K108 HydrophobicContact CD2-CG 4.38Å; Y76-K108 HydrophobicContact CG-CG 4.41Å; Y76-K108 PolarHBondContact N-O 3.49Å; Y76-K108 PolarHBondContact O-N 3.38Å; Y76-K108 VanDerWaalsContact O-N 3.09Å
77	K	98.7	Very high	96.4	Very high	46 Å²	46	61.6 Å²	61.6	20%	0.2	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	122.3	169.1	-177.9	-162.5	177.4	-149.4	0	107	D79 V80 F82 Y102 S104 T106 Y107	K77-D79 PolarHBondContact O-N 2.93Å; K77-V80 PolarHBondContact N-O 2.93Å; K77-V80 WeakPolarHBondContact O-CB 3.48Å; K77-V80 PolarHBondContact O-N 3.05Å; K77-F82 HydrophobicContact CB-CD1 3.59Å; K77-F82 HydrophobicContact CB-CE1 3.78Å; K77-Y102 PolarHBondContact NZ-O 3.46Å; K77-S104 WeakPolarHBondContact CE-O 3.12Å; K77-S104 PolarHBondContact NZ-O 2.97Å; K77-T106 CarbonylContact C-O 3.55Å; K77-T106 WeakPolarHBondContact CA-O 2.99Å; K77-Y107 HydrophobicContact CB-CD1 4.08Å; K77-Y107 HydrophobicContact CB-CE1 3.75Å; K77-Y107 HydrophobicContact CD-CE1 4.2Å; K77-Y107 HydrophobicContact CD-CE2 4.33Å; K77-Y107 WeakPolarHBondContact CD-OH 3.36Å; K77-Y107 HydrophobicContact CG-CD1 4.33Å; K77-Y107 HydrophobicContact CG-CD2 4.43Å; K77-Y107 HydrophobicContact CG-CE1 3.81Å; K77-Y107 HydrophobicContact CG-CE2 3.9Å
78	D	98.4	Very high	96.8	Very high	79 Å²	79	61.5 Å²	61.5	42%	0.422	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	46.7	-178.5	-49.6	-44.3	0	0	0	111	V80 G105 T106	D78-V80 PolarHBondContact O-N 3.29Å; D78-G105 WeakPolarHBondContact OD1-CA 3.46Å; D78-T106 PolarHBondContact N-O 3.13Å; D78-T106 PolarHBondContact OD1-N 2.94Å
79	D	98.1	Very high	97.3	Very high	112 Å²	112	60.4 Å²	60.4	60%	0.599	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	2.3	-175	-64.6	-50.7	0	0	0	116.9	K77 K108	K77-D79 PolarHBondContact O-N 2.93Å; D79-K108 WeakPolarHBondContact OD1-CE 3.34Å; D79-K108 IonicContact OD1-NZ 2.91Å; D79-K108 PolarHBondContact OD1-NZ 2.87Å
80	V	98.5	Very high	97.5	Very high	99 Å²	99	62.2 Å²	62.2	60%	0.6	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	123.3	176.3	-176.2	0	0	0	0	110.2	Y76 K77 D78 F82	Y76-V80 VanDerWaalsContact CA-O 3.31Å; Y76-V80 WeakPolarHBondContact CA-O 3.21Å; K77-V80 PolarHBondContact N-O 2.93Å; K77-V80 WeakPolarHBondContact O-CB 3.48Å; K77-V80 PolarHBondContact O-N 3.05Å; D78-V80 PolarHBondContact O-N 3.29Å; V80-F82 PolarHBondContact O-N 2.81Å
81	L	98.6	Very high	97.7	Very high	79 Å²	79	58.3 Å²	58.3	41%	0.414	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	116.9	172.7	178.7	67.3	0	0	0	109.4	L74 Y76 Y83 N84	L74-L81 HydrophobicContact CB-CD1 3.83Å; L74-L81 HydrophobicContact CD2-CD1 4.14Å; Y76-L81 HydrophobicContact CD1-CB 4.02Å; Y76-L81 HydrophobicContact CE1-CB 3.74Å; Y76-L81 HydrophobicContact CE1-CD1 4.15Å; Y76-L81 HydrophobicContact CE2-CD1 4.28Å; L81-Y83 WeakPolarHBondContact CD1-O 3.29Å; L81-N84 HydrophobicContact CD1-CB 4.49Å; L81-N84 HydrophobicContact CD2-CB 4.48Å
82	F	98.1	Very high	97.7	Very high	67 Å²	67	59 Å²	59	29%	0.294	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-17.8	178.2	71.8	-95.8	0	0	0	113.3	L55 F75 Y76 K77 V80 Y94 Y107	L55-F82 HydrophobicContact CD1-CZ 4.31Å; F75-F82 HydrophobicContact CB-CD1 4.45Å; F75-F82 HydrophobicContact CB-CE1 3.76Å; F75-F82 HydrophobicContact CB-CE2 3.94Å; F75-F82 HydrophobicContact CB-CZ 3.46Å; F75-F82 VanDerWaalsContact CB-CZ 3.46Å; F75-F82 HydrophobicContact CD1-CZ 4.43Å; F75-F82 HydrophobicContact CG-CZ 4.35Å; F75-F82 WeakPolarHBondContact O-CD1 3.24Å; F75-F82 PolarHBondContact O-N 3.46Å; Y76-F82 VanDerWaalsContact C-CE1 3.42Å; K77-F82 HydrophobicContact CB-CD1 3.59Å; K77-F82 HydrophobicContact CB-CE1 3.78Å; V80-F82 PolarHBondContact O-N 2.81Å; F82-Y94 HydrophobicContact CD2-CD1 4.36Å; F82-Y94 AromaticContact CD2-CE1 3.94Å; F82-Y94 HydrophobicContact CD2-CE1 3.94Å; F82-Y94 HydrophobicContact CD2-CE2 4.31Å; F82-Y94 AromaticContact CD2-CZ 3.93Å; F82-Y94 AromaticContact CE2-CD1 3.47Å; F82-Y94 HydrophobicContact CE2-CD1 3.47Å; F82-Y94 VanDerWaalsContact CE2-CD1 3.47Å; F82-Y94 HydrophobicContact CE2-CD2 4.15Å; F82-Y94 AromaticContact CE2-CE1 3.46Å; F82-Y94 HydrophobicContact CE2-CE1 3.46Å; F82-Y94 VanDerWaalsContact CE2-CE1 3.46Å; F82-Y94 HydrophobicContact CE2-CE2 4.18Å; F82-Y94 AromaticContact CE2-CG 3.79Å; F82-Y94 HydrophobicContact CE2-CG 3.79Å; F82-Y94 AromaticContact CE2-CZ 3.85Å; F82-Y94 HydrophobicContact CZ-CD1 4.22Å; F82-Y94 HydrophobicContact CZ-CE1 4.45Å; F82-Y107 AromaticContact CE1-CD1 3.75Å; F82-Y107 HydrophobicContact CE1-CD1 3.75Å; F82-Y107 AromaticContact CE1-CE1 3.7Å; F82-Y107 HydrophobicContact CE1-CE1 3.7Å; F82-Y107 AromaticContact CZ-CD1 4Å; F82-Y107 HydrophobicContact CZ-CD1 4Å; F82-Y107 AromaticContact CZ-CE1 3.84Å; F82-Y107 HydrophobicContact CZ-CE1 3.84Å
83	Y	98.4	Very high	97.7	Very high	67 Å²	67	58 Å²	58	26%	0.263	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	130.9	177.9	-174.3	-120	0	0	0	111.6	F75 L81 I85 Y94	F75-Y83 AromaticContact CD2-CD1 3.57Å; F75-Y83 HydrophobicContact CD2-CD1 3.57Å; F75-Y83 HydrophobicContact CD2-CE1 4.39Å; F75-Y83 HydrophobicContact CD2-CG 4.44Å; F75-Y83 AromaticContact CE2-CD1 3.82Å; F75-Y83 HydrophobicContact CE2-CD1 3.82Å; F75-Y83 HydrophobicContact CE2-CE1 4.21Å; F75-Y83 HydrophobicContact CG-CD1 4.19Å; F75-Y83 PolarHBondContact N-O 3.09Å; F75-Y83 PolarHBondContact O-N 2.86Å; L81-Y83 WeakPolarHBondContact CD1-O 3.29Å; Y83-I85 HydrophobicContact CD1-CG2 4.36Å; Y83-I85 HydrophobicContact CE1-CB 4.05Å; Y83-I85 HydrophobicContact CE1-CG2 3.73Å; Y83-I85 VanDerWaalsContact OH-CD1 3.25Å; Y83-I85 WeakPolarHBondContact OH-CD1 2.99Å; Y83-Y94 AromaticContact CD1-CD2 3.68Å; Y83-Y94 HydrophobicContact CD1-CD2 3.68Å; Y83-Y94 HydrophobicContact CD1-CG 4.26Å; Y83-Y94 AromaticContact CD2-CD2 3.78Å; Y83-Y94 HydrophobicContact CD2-CD2 3.78Å; Y83-Y94 AromaticContact CD2-CE2 3.93Å; Y83-Y94 HydrophobicContact CD2-CE2 3.93Å; Y83-Y94 HydrophobicContact CE1-CD2 4.07Å; Y83-Y94 HydrophobicContact CE2-CD2 4.15Å; Y83-Y94 HydrophobicContact CE2-CE2 4.48Å; Y83-Y94 AromaticContact CG-CD2 3.52Å; Y83-Y94 HydrophobicContact CG-CD2 3.52Å; Y83-Y94 AromaticContact CG-CE2 3.98Å; Y83-Y94 HydrophobicContact CG-CE2 3.98Å; Y83-Y94 HydrophobicContact CG-CG 4.39Å
84	N	98.3	Very high	97.7	Very high	84 Å²	84	61.4 Å²	61.4	45%	0.449	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	120.9	179.9	174.6	3.7	0	0	0	108.2	Q72 M73 L74 L81	Q72-N84 PolarHBondContact NE2-ND2 3.26Å; Q72-N84 PolarHBondContact NE2-OD1 3.11Å; Q72-N84 VanDerWaalsContact NE2-OD1 3.15Å; M73-N84 WeakPolarHBondContact O-CA 3.33Å; L74-N84 HydrophobicContact CD2-CB 3.73Å; L74-N84 WeakPolarHBondContact CD2-OD1 3.34Å; L81-N84 HydrophobicContact CD1-CB 4.49Å; L81-N84 HydrophobicContact CD2-CB 4.48Å
85	I	98.1	Very high	97.7	Very high	39 Å²	39	66 Å²	66	20%	0.2	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142.5	179.9	-174.7	155.7	0	0	0	110.8	Q72 M73 F75 Y83 E92	Q72-I85 CarbonylContact C-O 3.55Å; Q72-I85 WeakPolarHBondContact CA-O 3.28Å; M73-I85 HydrophobicContact CB-CG2 4.03Å; M73-I85 PolarHBondContact N-O 2.57Å; M73-I85 PolarHBondContact O-N 3.48Å; F75-I85 HydrophobicContact CE2-CG2 4.45Å; Y83-I85 HydrophobicContact CD1-CG2 4.36Å; Y83-I85 HydrophobicContact CE1-CB 4.05Å; Y83-I85 HydrophobicContact CE1-CG2 3.73Å; Y83-I85 VanDerWaalsContact OH-CD1 3.25Å; Y83-I85 WeakPolarHBondContact OH-CD1 2.99Å; I85-E92 HydrophobicContact CG2-CB 3.97Å; I85-E92 HydrophobicContact CG2-CG 3.94Å
86	S	97.5	Very high	97.7	Very high	60 Å²	60	66.7 Å²	66.7	42%	0.42	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.9	169.2	-71.9	0	0	0	0	110.1	H71	H71-S86 CarbonylContact O-C 3.57Å; H71-S86 VanDerWaalsContact O-CA 3.27Å; H71-S86 WeakPolarHBondContact O-CA 3.25Å
87	S	95.6	Very high	97.6	Very high	20 Å²	20	68.2 Å²	68.2	14%	0.14	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	152.5	-175.2	-175.3	0	0	0	0	112.8	H71 K89 E92	H71-S87 PolarHBondContact N-O 3.11Å; H71-S87 PolarHBondContact ND1-O 3.07Å; H71-S87 PolarHBondContact O-N 2.8Å; S87-K89 WeakPolarHBondContact OG-CB 3.38Å; S87-K89 PolarHBondContact OG-N 2.87Å; S87-K89 VanDerWaalsContact OG-N 3.11Å; S87-E92 WeakPolarHBondContact CB-OE1 3.46Å; S87-E92 PolarHBondContact OG-OE1 3.49Å
88	M	94.8	Very high	97.5	Very high	101 Å²	101	70.4 Å²	70.4	50%	0.498	37%	0.369	S	S	.	.	S	Bend	trans	-79.4	-9.9	170.4	-59.4	-58.4	-65.8	0	0	112.4	K68 Q70	K68-M88 HydrophobicContact CB-CE 3.94Å; K68-M88 WeakPolarHBondContact O-CE 3.45Å; Q70-M88 HydrophobicContact CB-SD 3.88Å; Q70-M88 HydrophobicContact CG-SD 4.32Å
89	K	95.6	Very high	97.3	Very high	137 Å²	137	66.7 Å²	66.7	60%	0.596	35%	0.349	S	S	*	.	S	Bend	trans	-78.6	150.4	175.8	-59.5	178.5	-171.9	167.8	0	109.5	H71 M73 S87 T91	H71-K89 PolarHBondContact ND1-O 2.71Å; H71-K89 VanDerWaalsContact ND1-O 3.11Å; M73-K89 WeakPolarHBondContact CE-O 3.48Å; S87-K89 WeakPolarHBondContact OG-CB 3.38Å; S87-K89 PolarHBondContact OG-N 2.87Å; S87-K89 VanDerWaalsContact OG-N 3.11Å; K89-T91 WeakPolarHBondContact CB-O 3Å; K89-T91 PolarHBondContact O-N 2.88Å
90	S	95.4	Very high	97.2	Very high	59 Å²	59	62.5 Å²	62.5	41%	0.413	33%	0.325	S	S	.	.	S	Bend	trans	-83	1.8	170.7	55.2	0	0	0	0	112.8	A59	A59-S90 PolarHBondContact N-O 2.79Å; A59-S90 WeakPolarHBondContact O-CB 2.98Å
91	T	97.4	Very high	97	Very high	38 Å²	38	61.9 Å²	61.9	23%	0.233	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	130.6	-177	-55.2	0	0	0	0	109.8	C57 F58 K89	C57-T91 VanDerWaalsContact O-CA 3.27Å; C57-T91 WeakPolarHBondContact O-CA 3.34Å; F58-T91 HydrophobicContact CD1-CG2 3.33Å; F58-T91 WeakPolarHBondContact CD1-OG1 3.21Å; F58-T91 HydrophobicContact CE1-CG2 3.26Å; F58-T91 HydrophobicContact CG-CG2 4.04Å; F58-T91 HydrophobicContact CZ-CG2 3.94Å; K89-T91 WeakPolarHBondContact CB-O 3Å; K89-T91 PolarHBondContact O-N 2.88Å
92	E	98.3	Very high	96.9	Very high	23 Å²	23	65.5 Å²	65.5	11%	0.107	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	155.8	172.1	-74.1	-58.4	153.1	0	0	110.8	Q56 C57 M73 I85 S87	Q56-E92 WeakPolarHBondContact CA-O 3.32Å; C57-E92 PolarHBondContact N-O 2.82Å; C57-E92 PolarHBondContact O-N 3.45Å; M73-E92 HydrophobicContact CE-CB 4.48Å; M73-E92 HydrophobicContact CE-CG 3.92Å; M73-E92 HydrophobicContact CG-CB 4.38Å; M73-E92 HydrophobicContact CG-CG 4.49Å; M73-E92 HydrophobicContact SD-CB 4.48Å; M73-E92 HydrophobicContact SD-CG 3.97Å; I85-E92 HydrophobicContact CG2-CB 3.97Å; I85-E92 HydrophobicContact CG2-CG 3.94Å; S87-E92 WeakPolarHBondContact CB-OE1 3.46Å; S87-E92 PolarHBondContact OG-OE1 3.49Å
93	S	98.3	Very high	96.8	Very high	43 Å²	43	63.5 Å²	63.5	30%	0.301	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.1	-175.3	-57.7	0	0	0	0	111.5	L55 Q56	L55-S93 CarbonylContact O-C 3.59Å; L55-S93 VanDerWaalsContact O-CA 3.24Å; L55-S93 WeakPolarHBondContact O-CA 3.44Å; Q56-S93 WeakPolarHBondContact CG-OG 3.38Å; Q56-S93 PolarHBondContact NE2-OG 2.93Å
94	Y	98.4	Very high	96.8	Very high	73 Å²	73	61.7 Å²	61.7	29%	0.286	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.4	171.4	-175.3	-102.3	0	0	0	109.6	T54 L55 F82 Y83 I96	T54-Y94 WeakPolarHBondContact CA-O 3.27Å; L55-Y94 PolarHBondContact N-O 3.26Å; L55-Y94 PolarHBondContact O-N 3.1Å; F82-Y94 HydrophobicContact CD2-CD1 4.36Å; F82-Y94 AromaticContact CD2-CE1 3.94Å; F82-Y94 HydrophobicContact CD2-CE1 3.94Å; F82-Y94 HydrophobicContact CD2-CE2 4.31Å; F82-Y94 AromaticContact CD2-CZ 3.93Å; F82-Y94 AromaticContact CE2-CD1 3.47Å; F82-Y94 HydrophobicContact CE2-CD1 3.47Å; F82-Y94 VanDerWaalsContact CE2-CD1 3.47Å; F82-Y94 HydrophobicContact CE2-CD2 4.15Å; F82-Y94 AromaticContact CE2-CE1 3.46Å; F82-Y94 HydrophobicContact CE2-CE1 3.46Å; F82-Y94 VanDerWaalsContact CE2-CE1 3.46Å; F82-Y94 HydrophobicContact CE2-CE2 4.18Å; F82-Y94 AromaticContact CE2-CG 3.79Å; F82-Y94 HydrophobicContact CE2-CG 3.79Å; F82-Y94 AromaticContact CE2-CZ 3.85Å; F82-Y94 HydrophobicContact CZ-CD1 4.22Å; F82-Y94 HydrophobicContact CZ-CE1 4.45Å; Y83-Y94 AromaticContact CD1-CD2 3.68Å; Y83-Y94 HydrophobicContact CD1-CD2 3.68Å; Y83-Y94 HydrophobicContact CD1-CG 4.26Å; Y83-Y94 AromaticContact CD2-CD2 3.78Å; Y83-Y94 HydrophobicContact CD2-CD2 3.78Å; Y83-Y94 AromaticContact CD2-CE2 3.93Å; Y83-Y94 HydrophobicContact CD2-CE2 3.93Å; Y83-Y94 HydrophobicContact CE1-CD2 4.07Å; Y83-Y94 HydrophobicContact CE2-CD2 4.15Å; Y83-Y94 HydrophobicContact CE2-CE2 4.48Å; Y83-Y94 AromaticContact CG-CD2 3.52Å; Y83-Y94 HydrophobicContact CG-CD2 3.52Å; Y83-Y94 AromaticContact CG-CE2 3.98Å; Y83-Y94 HydrophobicContact CG-CE2 3.98Å; Y83-Y94 HydrophobicContact CG-CG 4.39Å; Y94-I96 HydrophobicContact CD1-CD1 4.15Å; Y94-I96 HydrophobicContact CD1-CG1 3.67Å; Y94-I96 HydrophobicContact CE1-CD1 4Å; Y94-I96 HydrophobicContact CE1-CG1 3.46Å; Y94-I96 VanDerWaalsContact CE1-CG1 3.46Å
95	F	98.4	Very high	96.8	Very high	109 Å²	109	57.9 Å²	57.9	48%	0.478	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.5	-175.8	-179.8	-111.2	0	0	0	110.6	N52 T54 P97	N52-F95 HydrophobicContact CB-CE2 3.69Å; N52-F95 HydrophobicContact CB-CZ 3.83Å; T54-F95 WeakPolarHBondContact OG1-CD2 3.49Å; F95-P97 HydrophobicContact CD1-CB 4.45Å; F95-P97 HydrophobicContact CE1-CB 3.79Å; F95-P97 HydrophobicContact CE1-CG 4.36Å; F95-P97 HydrophobicContact CZ-CB 4.37Å; F95-P97 WeakPolarHBondContact O-CD 3.24Å
96	I	98	Very high	96.8	Very high	15 Å²	15	57.9 Å²	57.9	8%	0.077	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	101.4	175.1	-55	174.7	0	0	0	107.4	L53 L55 Y94 V99	L53-I96 HydrophobicContact CB-CB 4.26Å; L53-I96 HydrophobicContact CD2-CD1 4.12Å; L53-I96 HydrophobicContact CG-CD1 4.49Å; L53-I96 PolarHBondContact N-O 2.88Å; L53-I96 PolarHBondContact O-N 3.13Å; L55-I96 HydrophobicContact CD1-CD1 4.29Å; Y94-I96 HydrophobicContact CD1-CD1 4.15Å; Y94-I96 HydrophobicContact CD1-CG1 3.67Å; Y94-I96 HydrophobicContact CE1-CD1 4Å; Y94-I96 HydrophobicContact CE1-CG1 3.46Å; Y94-I96 VanDerWaalsContact CE1-CG1 3.46Å; I96-V99 HydrophobicContact CG2-CB 4.35Å; I96-V99 HydrophobicContact CG2-CG2 4.24Å
97	P	96.9	Very high	96.9	Very high	82 Å²	82	55.2 Å²	55.2	53%	0.532	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	141.3	173	28.8	-32.1	0	0	0	110.1	F95 V99	F95-P97 HydrophobicContact CD1-CB 4.45Å; F95-P97 HydrophobicContact CE1-CB 3.79Å; F95-P97 HydrophobicContact CE1-CG 4.36Å; F95-P97 HydrophobicContact CZ-CB 4.37Å; F95-P97 WeakPolarHBondContact O-CD 3.24Å; P97-V99 PolarHBondContact O-N 2.92Å
98	E	95.5	Very high	97.1	Very high	93 Å²	93	56 Å²	56	44%	0.435	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	61.2	175.2	-60.8	-175.6	-164	0	0	115.1	K51 N52 R100	K51-E98 CarbonylContact O-C 3.58Å; K51-E98 WeakPolarHBondContact O-CA 3.44Å; N52-E98 PolarHBondContact OD1-N 2.91Å; E98-R100 WeakPolarHBondContact O-CD 3.29Å; E98-R100 WeakPolarHBondContact O-CG 3.42Å; E98-R100 PolarHBondContact O-NE 2.91Å; E98-R100 VanDerWaalsContact O-NE 3.13Å; E98-R100 IonicContact OE2-CZ 4Å; E98-R100 IonicContact OE2-NH2 2.92Å; E98-R100 PolarHBondContact OE2-NH2 2.97Å
99	V	96.2	Very high	97.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.			trans	-53.4	139.5	-177.2	77.4	0	0	0	0	112.6	V47 N49 G50 K51 L53 I96 P97 D103 V127	V47-V99 HydrophobicContact CB-CG1 4.2Å; V47-V99 HydrophobicContact CG1-CG1 3.73Å; N49-V99 WeakPolarHBondContact CA-O 3.44Å; G50-V99 PolarHBondContact N-O 3.35Å; K51-V99 WeakPolarHBondContact O-CB 3.49Å; K51-V99 VanDerWaalsContact O-CG1 3.3Å; K51-V99 WeakPolarHBondContact O-CG1 3.02Å; K51-V99 PolarHBondContact O-N 3.16Å; L53-V99 HydrophobicContact CB-CB 4.3Å; L53-V99 HydrophobicContact CB-CG2 4.39Å; L53-V99 HydrophobicContact CD2-CG2 4.01Å; I96-V99 HydrophobicContact CG2-CB 4.35Å; I96-V99 HydrophobicContact CG2-CG2 4.24Å; P97-V99 PolarHBondContact O-N 2.92Å; V99-D103 HydrophobicContact CG2-CB 3.5Å; V99-D103 VanDerWaalsContact CG2-CB 3.5Å; V99-V127 HydrophobicContact CG1-CG1 3.95Å; V99-V127 HydrophobicContact CG1-CG2 4.21Å; V99-V127 HydrophobicContact CG2-CG1 4.48Å; V99-V127 HydrophobicContact CG2-CG2 3.54Å
100	R	95.4	Very high	97.4	Very high	25 Å²	25	45.2 Å²	45.2	9%	0.094	23%	0.232	C	C	.	.			trans	-121.3	168.4	-177.9	-56.5	-57.3	174	159.5	5	111.4	N49 E98 Y102 D103 V127	N49-R100 VanDerWaalsContact OD1-CD 3.25Å; N49-R100 WeakPolarHBondContact OD1-CD 3.43Å; N49-R100 PolarHBondContact OD1-NH1 3.33Å; E98-R100 WeakPolarHBondContact O-CD 3.29Å; E98-R100 WeakPolarHBondContact O-CG 3.42Å; E98-R100 PolarHBondContact O-NE 2.91Å; E98-R100 VanDerWaalsContact O-NE 3.13Å; E98-R100 IonicContact OE2-CZ 4Å; E98-R100 IonicContact OE2-NH2 2.92Å; E98-R100 PolarHBondContact OE2-NH2 2.97Å; R100-Y102 HydrophobicContact CB-CD1 3.75Å; R100-Y102 HydrophobicContact CB-CD2 4.49Å; R100-Y102 HydrophobicContact CB-CE1 3.39Å; R100-Y102 HydrophobicContact CB-CE2 4.17Å; R100-Y102 HydrophobicContact CB-CG 4.28Å; R100-Y102 HydrophobicContact CG-CE1 3.72Å; R100-Y102 PolarHBondContact O-N 3.19Å; R100-Y102 VanDerWaalsContact O-N 3.14Å; R100-D103 PolarHBondContact N-OD2 3.15Å; R100-D103 WeakPolarHBondContact O-CB 3.28Å; R100-D103 PolarHBondContact O-N 3.22Å; R100-V127 WeakPolarHBondContact O-CG2 3.47Å
101	I	94.9	Very high	97.5	Very high	85 Å²	85	42.4 Å²	42.4	44%	0.436	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-53.9	-39.2	-179.1	-60.1	-176.3	0	0	0	111.4	D103 S104 P131	I101-D103 PolarHBondContact O-N 3.12Å; I101-S104 VanDerWaalsContact O-CB 3.24Å; I101-S104 WeakPolarHBondContact O-CB 3.37Å; I101-S104 PolarHBondContact O-N 3Å; I101-S104 PolarHBondContact O-OG 3.02Å; I101-P131 HydrophobicContact CD1-CG 3.74Å
102	Y	94.8	Very high	97.6	Very high	155 Å²	155	42.4 Å²	42.4	61%	0.608	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-68.2	-14.2	178.8	63.2	-109.5	0	0	0	113.8	K77 R100 S104	K77-Y102 PolarHBondContact NZ-O 3.46Å; R100-Y102 HydrophobicContact CB-CD1 3.75Å; R100-Y102 HydrophobicContact CB-CD2 4.49Å; R100-Y102 HydrophobicContact CB-CE1 3.39Å; R100-Y102 HydrophobicContact CB-CE2 4.17Å; R100-Y102 HydrophobicContact CB-CG 4.28Å; R100-Y102 HydrophobicContact CG-CE1 3.72Å; R100-Y102 PolarHBondContact O-N 3.19Å; R100-Y102 VanDerWaalsContact O-N 3.14Å; Y102-S104 VanDerWaalsContact C-N 3.3Å
103	D	97.4	Very high	97.4	Very high	25 Å²	25	41.3 Å²	41.3	13%	0.134	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-81.8	-12	173.5	-62.1	-49.5	0	0	0	111.8	V99 R100 I101 Y107	V99-D103 HydrophobicContact CG2-CB 3.5Å; V99-D103 VanDerWaalsContact CG2-CB 3.5Å; R100-D103 PolarHBondContact N-OD2 3.15Å; R100-D103 WeakPolarHBondContact O-CB 3.28Å; R100-D103 PolarHBondContact O-N 3.22Å; I101-D103 PolarHBondContact O-N 3.12Å; D103-Y107 WeakPolarHBondContact O-CE2 3.44Å; D103-Y107 PolarHBondContact O-OH 2.94Å
104	S	98.1	Very high	97.1	Very high	29 Å²	29	43.9 Å²	43.9	20%	0.203	22%	0.216	C	C	.	.			trans	-59.5	147.8	168.5	-50.6	0	0	0	0	110.1	K77 I101 Y102 V125 V127	K77-S104 WeakPolarHBondContact CE-O 3.12Å; K77-S104 PolarHBondContact NZ-O 2.97Å; I101-S104 VanDerWaalsContact O-CB 3.24Å; I101-S104 WeakPolarHBondContact O-CB 3.37Å; I101-S104 PolarHBondContact O-N 3Å; I101-S104 PolarHBondContact O-OG 3.02Å; Y102-S104 VanDerWaalsContact C-N 3.3Å; S104-V125 VanDerWaalsContact CA-O 3.31Å; S104-V125 WeakPolarHBondContact CA-O 2.98Å; S104-V125 WeakPolarHBondContact CB-O 3.38Å; S104-V127 WeakPolarHBondContact OG-CB 3.27Å; S104-V127 WeakPolarHBondContact OG-CG2 3.21Å; S104-V127 PolarHBondContact OG-N 3.3Å
105	G	98.3	Very high	96.7	Very high	5 Å²	5	47.9 Å²	47.9	5%	0.052	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.7	-177.4	-178.9	0	0	0	0	0	112.3	D78 Y107 Q124 V125	D78-G105 WeakPolarHBondContact OD1-CA 3.46Å; G105-Y107 WeakPolarHBondContact O-CD2 3.01Å; G105-Q124 PolarHBondContact O-NE2 3.17Å; G105-V125 PolarHBondContact N-O 3.43Å; G105-V125 VanDerWaalsContact N-O 3.11Å; G105-V125 PolarHBondContact O-N 2.97Å
106	T	98.7	Very high	96.5	Very high	38 Å²	38	47.6 Å²	47.6	23%	0.233	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.4	176.7	-54.7	0	0	0	0	109.4	K77 D78 E122 Q124	K77-T106 CarbonylContact C-O 3.55Å; K77-T106 WeakPolarHBondContact CA-O 2.99Å; D78-T106 PolarHBondContact N-O 3.13Å; D78-T106 PolarHBondContact OD1-N 2.94Å; T106-E122 HydrophobicContact CG2-CB 3.63Å; T106-E122 HydrophobicContact CG2-CG 3.89Å; T106-Q124 PolarHBondContact OG1-OE1 3.44Å
107	Y	98.8	Very high	96.5	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.4	-176.9	-72.8	-97.4	0	0	0	111.4	L55 Y76 K77 F82 D103 G105 Y123 V125	L55-Y107 HydrophobicContact CD1-CD1 3.39Å; L55-Y107 HydrophobicContact CD1-CE1 3.46Å; L55-Y107 VanDerWaalsContact CD1-CE1 3.46Å; L55-Y107 HydrophobicContact CD1-CG 4.12Å; Y76-Y107 VanDerWaalsContact O-CA 3.32Å; Y76-Y107 WeakPolarHBondContact O-CA 3.48Å; K77-Y107 HydrophobicContact CB-CD1 4.08Å; K77-Y107 HydrophobicContact CB-CE1 3.75Å; K77-Y107 HydrophobicContact CD-CE1 4.2Å; K77-Y107 HydrophobicContact CD-CE2 4.33Å; K77-Y107 WeakPolarHBondContact CD-OH 3.36Å; K77-Y107 HydrophobicContact CG-CD1 4.33Å; K77-Y107 HydrophobicContact CG-CD2 4.43Å; K77-Y107 HydrophobicContact CG-CE1 3.81Å; K77-Y107 HydrophobicContact CG-CE2 3.9Å; F82-Y107 AromaticContact CE1-CD1 3.75Å; F82-Y107 HydrophobicContact CE1-CD1 3.75Å; F82-Y107 AromaticContact CE1-CE1 3.7Å; F82-Y107 HydrophobicContact CE1-CE1 3.7Å; F82-Y107 AromaticContact CZ-CD1 4Å; F82-Y107 HydrophobicContact CZ-CD1 4Å; F82-Y107 AromaticContact CZ-CE1 3.84Å; F82-Y107 HydrophobicContact CZ-CE1 3.84Å; D103-Y107 WeakPolarHBondContact O-CE2 3.44Å; D103-Y107 PolarHBondContact O-OH 2.94Å; G105-Y107 WeakPolarHBondContact O-CD2 3.01Å; Y107-Y123 PolarHBondContact N-O 3.22Å; Y107-Y123 PolarHBondContact O-N 2.9Å; Y107-V125 HydrophobicContact CD2-CB 3.74Å; Y107-V125 HydrophobicContact CD2-CG2 3.38Å; Y107-V125 HydrophobicContact CE2-CB 3.63Å; Y107-V125 HydrophobicContact CE2-CG1 4.35Å; Y107-V125 HydrophobicContact CE2-CG2 3.64Å; Y107-V125 HydrophobicContact CG-CG2 4.14Å
108	K	98.8	Very high	96.6	Very high	37 Å²	37	53.6 Å²	53.6	16%	0.161	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	159	169.2	60.7	-173.6	166.4	-156.5	0	111.4	Y76 D79 T119 T120 E122	Y76-K108 HydrophobicContact CD2-CG 4.38Å; Y76-K108 HydrophobicContact CG-CG 4.41Å; Y76-K108 PolarHBondContact N-O 3.49Å; Y76-K108 PolarHBondContact O-N 3.38Å; Y76-K108 VanDerWaalsContact O-N 3.09Å; D79-K108 WeakPolarHBondContact OD1-CE 3.34Å; D79-K108 IonicContact OD1-NZ 2.91Å; D79-K108 PolarHBondContact OD1-NZ 2.87Å; K108-T119 HydrophobicContact CB-CG2 4.34Å; K108-T119 HydrophobicContact CD-CG2 3.96Å; K108-T119 HydrophobicContact CG-CG2 4.34Å; K108-T120 WeakPolarHBondContact CA-OG1 3.23Å; K108-E122 HydrophobicContact CB-CG 4.5Å; K108-E122 HydrophobicContact CD-CG 4.11Å; K108-E122 IonicContact NZ-OE1 2.62Å; K108-E122 PolarHBondContact NZ-OE1 2.94Å
109	C	98.7	Very high	96.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.1	175.7	-179.9	0	0	0	0	110.2	M39 C57 L74 T119 T120	M39-C109 HydrophobicContact SD-CB 4.27Å; C57-C109 HydrophobicContact CB-CB 3.69Å; C57-C109 WeakPolarHBondContact CB-SG 3.01Å; C57-C109 WeakPolarHBondContact SG-CB 3.47Å; C57-C109 CovalentContact SG-SG 2.03Å; C57-C109 PolarHBondContact SG-SG 3.46Å; L74-C109 CarbonylContact O-C 3.59Å; L74-C109 VanDerWaalsContact O-CA 3.29Å; L74-C109 WeakPolarHBondContact O-CA 3.24Å; C109-T119 CarbonylContact O-C 3.53Å; C109-T119 WeakPolarHBondContact O-CA 3.42Å; C109-T120 HydrophobicContact CB-CG2 3.94Å; C109-T120 PolarHBondContact N-OG1 3.34Å; C109-T120 WeakPolarHBondContact O-CG2 3.44Å; C109-T120 PolarHBondContact O-N 3.46Å; C109-T120 PolarHBondContact O-OG1 3.46Å
110	T	98.7	Very high	96.8	Very high	11 Å²	11	52.8 Å²	52.8	7%	0.067	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131	169.4	-59.2	0	0	0	0	109	M73 L74 I112 E117 K118 T119	M73-T110 WeakPolarHBondContact CA-O 3.23Å; L74-T110 PolarHBondContact N-O 2.95Å; L74-T110 PolarHBondContact O-N 2.93Å; T110-I112 HydrophobicContact CG2-CG1 4.27Å; T110-E117 HydrophobicContact CG2-CB 4.23Å; T110-K118 WeakPolarHBondContact CA-O 3.42Å; T110-T119 WeakPolarHBondContact OG1-CG2 3.35Å; T110-T119 PolarHBondContact OG1-OG1 3.37Å
111	V	98.4	Very high	97	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.2	176.3	179.8	0	0	0	0	108.8	V37 A59 H71 Q72 M73 V113 E117 K118	V37-V111 HydrophobicContact CB-CG2 4.48Å; V37-V111 HydrophobicContact CG1-CB 4.3Å; V37-V111 HydrophobicContact CG1-CG2 3.48Å; V37-V111 VanDerWaalsContact CG1-CG2 3.48Å; V37-V111 HydrophobicContact CG2-CB 4.03Å; V37-V111 HydrophobicContact CG2-CG2 4.07Å; A59-V111 HydrophobicContact CB-CB 4.37Å; A59-V111 HydrophobicContact CB-CG1 3.85Å; A59-V111 HydrophobicContact CB-CG2 4.11Å; H71-V111 HydrophobicContact CB-CG1 4.45Å; Q72-V111 CarbonylContact O-C 3.49Å; Q72-V111 WeakPolarHBondContact O-CA 3.4Å; M73-V111 HydrophobicContact CG-CG2 4.13Å; V111-V113 HydrophobicContact CG1-CG2 4.15Å; V111-E117 VanDerWaalsContact O-CA 3.27Å; V111-E117 WeakPolarHBondContact O-CA 3.32Å; V111-K118 PolarHBondContact N-O 2.95Å; V111-K118 PolarHBondContact O-N 3.21Å
112	I	97.9	Very high	97.1	Very high	38 Å²	38	56.4 Å²	56.4	20%	0.195	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126	177.7	-51.6	174.4	0	0	0	108.6	Q72 L74 T110 K116 E117	Q72-I112 HydrophobicContact CB-CB 4.28Å; Q72-I112 PolarHBondContact N-O 3.36Å; Q72-I112 PolarHBondContact O-N 3.5Å; L74-I112 HydrophobicContact CD1-CD1 3.72Å; L74-I112 HydrophobicContact CG-CD1 4.5Å; T110-I112 HydrophobicContact CG2-CG1 4.27Å; I112-K116 CarbonylContact C-O 3.54Å; I112-K116 VanDerWaalsContact CA-O 3.28Å; I112-K116 WeakPolarHBondContact CA-O 3.46Å; I112-E117 HydrophobicContact CG1-CB 3.95Å
113	V	95.8	Very high	97.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	119.8	174.9	178.7	0	0	0	0	108.7	F32 I34 V61 P69 H71 V111 N115 K116	F32-V113 HydrophobicContact CB-CG1 4.39Å; F32-V113 HydrophobicContact CD1-CG1 4.08Å; F32-V113 HydrophobicContact CG-CG1 4.39Å; I34-V113 HydrophobicContact CD1-CB 4.38Å; I34-V113 HydrophobicContact CG1-CB 4.49Å; V61-V113 HydrophobicContact CG1-CG1 4.36Å; V61-V113 HydrophobicContact CG2-CG2 4.26Å; P69-V113 HydrophobicContact CB-CG1 3.59Å; P69-V113 HydrophobicContact CG-CG1 4.1Å; H71-V113 HydrophobicContact CB-CG2 4.27Å; H71-V113 WeakPolarHBondContact CD2-CG2 2.99Å; V111-V113 HydrophobicContact CG1-CG2 4.15Å; V113-N115 VanDerWaalsContact C-N 3.34Å; V113-N115 PolarHBondContact O-N 2.93Å; V113-K116 PolarHBondContact N-O 2.95Å; V113-K116 WeakPolarHBondContact O-CB 3.27Å; V113-K116 PolarHBondContact O-N 3.39Å
114	N	91.4	Very high	97.4	Very high	96 Å²	96	55.5 Å²	55.5	51%	0.513	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	53.1	176.9	-163	37.2	0	0	0	113.3	F32 K116	F32-N114 HydrophobicContact CD2-CB 3.84Å; F32-N114 WeakPolarHBondContact CD2-ND2 3.17Å; F32-N114 HydrophobicContact CE2-CB 4.25Å; F32-N114 HydrophobicContact CG-CB 4.17Å; N114-K116 PolarHBondContact O-N 3.42Å; N114-K116 VanDerWaalsContact O-N 3.09Å
115	N	90.5	Very high	97.4	Very high	158 Å²	158	54.1 Å²	54.1	85%	0.845	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	6.6	-177.7	-53.8	-34.9	0	0	0	116.3	V113	V113-N115 VanDerWaalsContact C-N 3.34Å; V113-N115 PolarHBondContact O-N 2.93Å
116	K	94.3	Very high	97.4	Very high	103 Å²	103	57.7 Å²	57.7	45%	0.448	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	140	167.9	-64.2	171.8	-179.4	-118.5	0	108.5	F32 I34 I112 V113 N114	F32-K116 WeakPolarHBondContact O-CD 3.4Å; F32-K116 WeakPolarHBondContact O-CE 3.41Å; F32-K116 PolarHBondContact O-NZ 3.05Å; F32-K116 VanDerWaalsContact O-NZ 3.07Å; I34-K116 HydrophobicContact CD1-CB 4.28Å; I34-K116 WeakPolarHBondContact CD1-O 3.27Å; I112-K116 CarbonylContact C-O 3.54Å; I112-K116 VanDerWaalsContact CA-O 3.28Å; I112-K116 WeakPolarHBondContact CA-O 3.46Å; V113-K116 PolarHBondContact N-O 2.95Å; V113-K116 WeakPolarHBondContact O-CB 3.27Å; V113-K116 PolarHBondContact O-N 3.39Å; N114-K116 PolarHBondContact O-N 3.42Å; N114-K116 VanDerWaalsContact O-N 3.09Å
117	E	97.3	Very high	97.3	Very high	139 Å²	139	56.3 Å²	56.3	65%	0.65	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.7	177.9	68.8	-177.8	-168.8	0	0	111.6	T110 V111 I112	T110-E117 HydrophobicContact CG2-CB 4.23Å; V111-E117 VanDerWaalsContact O-CA 3.27Å; V111-E117 WeakPolarHBondContact O-CA 3.32Å; I112-E117 HydrophobicContact CG1-CB 3.95Å
118	K	98.5	Very high	97.2	Very high	84 Å²	84	60.2 Å²	60.2	37%	0.365	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	135.6	170	-171.9	167.8	-173.9	167	0	108.9	I34 N35 V37 T110 V111	I34-K118 HydrophobicContact CB-CB 4.23Å; I34-K118 HydrophobicContact CB-CD 4.44Å; I34-K118 HydrophobicContact CD1-CB 4.27Å; I34-K118 HydrophobicContact CG2-CB 3.85Å; I34-K118 HydrophobicContact CG2-CD 4.01Å; N35-K118 PolarHBondContact O-NZ 2.76Å; V37-K118 HydrophobicContact CG2-CB 3.73Å; V37-K118 HydrophobicContact CG2-CD 4.15Å; V37-K118 HydrophobicContact CG2-CG 3.89Å; T110-K118 WeakPolarHBondContact CA-O 3.42Å; V111-K118 PolarHBondContact N-O 2.95Å; V111-K118 PolarHBondContact O-N 3.21Å
119	T	98.5	Very high	96.8	Very high	63 Å²	63	60.3 Å²	60.3	39%	0.387	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	144	179.8	-52.6	0	0	0	0	109.6	K108 C109 T110	K108-T119 HydrophobicContact CB-CG2 4.34Å; K108-T119 HydrophobicContact CD-CG2 3.96Å; K108-T119 HydrophobicContact CG-CG2 4.34Å; C109-T119 CarbonylContact O-C 3.53Å; C109-T119 WeakPolarHBondContact O-CA 3.42Å; T110-T119 WeakPolarHBondContact OG1-CG2 3.35Å; T110-T119 PolarHBondContact OG1-OG1 3.37Å
120	T	98.7	Very high	96.2	Very high	13 Å²	13	66.7 Å²	66.7	8%	0.08	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-66	170	173.5	61.6	0	0	0	0	111.6	V37 M39 K108 C109	V37-T120 HydrophobicContact CB-CG2 4.06Å; V37-T120 HydrophobicContact CG1-CG2 3.45Å; V37-T120 VanDerWaalsContact CG1-CG2 3.45Å; M39-T120 HydrophobicContact CB-CG2 4.18Å; K108-T120 WeakPolarHBondContact CA-OG1 3.23Å; C109-T120 HydrophobicContact CB-CG2 3.94Å; C109-T120 PolarHBondContact N-OG1 3.34Å; C109-T120 WeakPolarHBondContact O-CG2 3.44Å; C109-T120 PolarHBondContact O-N 3.46Å; C109-T120 PolarHBondContact O-OG1 3.46Å
121	A	97.9	Very high	95.1	Very high	66 Å²	66	69.9 Å²	69.9	55%	0.545	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-59.7	166.4	156.2	0	0	0	0	0	111	Y123	A121-Y123 HydrophobicContact CB-CE2 4.34Å; A121-Y123 WeakPolarHBondContact O-CD2 3.41Å; A121-Y123 VanDerWaalsContact O-CE2 3.24Å; A121-Y123 WeakPolarHBondContact O-CE2 3.46Å
122	E	98.2	Very high	93.8	Very high	119 Å²	119	73.4 Å²	73.4	56%	0.556	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-84.8	133.8	173.1	-74.1	-178.8	173.5	0	0	110.3	T106 K108	T106-E122 HydrophobicContact CG2-CB 3.63Å; T106-E122 HydrophobicContact CG2-CG 3.89Å; K108-E122 HydrophobicContact CB-CG 4.5Å; K108-E122 HydrophobicContact CD-CG 4.11Å; K108-E122 IonicContact NZ-OE1 2.62Å; K108-E122 PolarHBondContact NZ-OE1 2.94Å
123	Y	98.5	Very high	92.4	Very high	51 Å²	51	77.7 Å²	77.7	20%	0.2	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.1	-179.7	-62.2	-92.1	0	0	0	110.4	M39 W45 Y107 A121	M39-Y123 HydrophobicContact CB-CD2 3.72Å; M39-Y123 HydrophobicContact CB-CE2 3.42Å; M39-Y123 VanDerWaalsContact CB-CE2 3.42Å; M39-Y123 HydrophobicContact SD-CD2 4.3Å; W45-Y123 HydrophobicContact CD2-CD1 4.33Å; W45-Y123 AromaticContact CE2-CD1 3.6Å; W45-Y123 HydrophobicContact CE3-CG 4.48Å; W45-Y123 AromaticContact CH2-CD1 3.62Å; W45-Y123 HydrophobicContact CH2-CD1 3.62Å; W45-Y123 AromaticContact CH2-CD2 3.98Å; W45-Y123 HydrophobicContact CH2-CD2 3.98Å; W45-Y123 HydrophobicContact CH2-CE1 4.38Å; W45-Y123 AromaticContact CH2-CG 3.37Å; W45-Y123 HydrophobicContact CH2-CG 3.37Å; W45-Y123 AromaticContact CZ2-CD1 3.2Å; W45-Y123 HydrophobicContact CZ2-CD1 3.2Å; W45-Y123 HydrophobicContact CZ2-CD2 4.3Å; W45-Y123 AromaticContact CZ2-CE1 3.75Å; W45-Y123 HydrophobicContact CZ2-CE1 3.75Å; W45-Y123 AromaticContact CZ2-CG 3.52Å; W45-Y123 HydrophobicContact CZ2-CG 3.52Å; W45-Y123 HydrophobicContact CZ3-CD1 4.32Å; W45-Y123 AromaticContact CZ3-CG 3.9Å; W45-Y123 HydrophobicContact CZ3-CG 3.9Å; Y107-Y123 PolarHBondContact N-O 3.22Å; Y107-Y123 PolarHBondContact O-N 2.9Å; A121-Y123 HydrophobicContact CB-CE2 4.34Å; A121-Y123 WeakPolarHBondContact O-CD2 3.41Å; A121-Y123 VanDerWaalsContact O-CE2 3.24Å; A121-Y123 WeakPolarHBondContact O-CE2 3.46Å
124	Q	98.5	Very high	90.8	Very high	111 Å²	111	90.1 Å²	90.1	52%	0.519	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.5	178.5	-164	65.9	27.3	0	0	110.1	G105 T106	G105-Q124 PolarHBondContact O-NE2 3.17Å; T106-Q124 PolarHBondContact OG1-OE1 3.44Å
125	V	98.6	Very high	90.8	Very high	0 Å²	0	89.8 Å²	89.8	0%	0	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	125	166	174.3	0	0	0	0	108.3	W45 L53 L55 S104 G105 Y107 V127	W45-V125 HydrophobicContact CE3-CG2 3.76Å; W45-V125 HydrophobicContact CZ3-CG2 3.99Å; W45-V125 WeakPolarHBondContact O-CA 3.45Å; L53-V125 HydrophobicContact CD2-CG1 3.77Å; L55-V125 HydrophobicContact CD2-CG2 4.23Å; S104-V125 VanDerWaalsContact CA-O 3.31Å; S104-V125 WeakPolarHBondContact CA-O 2.98Å; S104-V125 WeakPolarHBondContact CB-O 3.38Å; G105-V125 PolarHBondContact N-O 3.43Å; G105-V125 VanDerWaalsContact N-O 3.11Å; G105-V125 PolarHBondContact O-N 2.97Å; Y107-V125 HydrophobicContact CD2-CB 3.74Å; Y107-V125 HydrophobicContact CD2-CG2 3.38Å; Y107-V125 HydrophobicContact CE2-CB 3.63Å; Y107-V125 HydrophobicContact CE2-CG1 4.35Å; Y107-V125 HydrophobicContact CE2-CG2 3.64Å; Y107-V125 HydrophobicContact CG-CG2 4.14Å; V125-V127 HydrophobicContact CG1-CG2 4.25Å
126	L	98.3	Very high	90.8	Very high	80 Å²	80	86.2 Å²	86.2	42%	0.419	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.5	175.5	-179.7	63	0	0	0	110.1	W45 T46 V47 E128	W45-L126 PolarHBondContact O-N 3.23Å; T46-L126 CarbonylContact C-O 3.56Å; T46-L126 VanDerWaalsContact CA-O 3.3Å; T46-L126 WeakPolarHBondContact CA-O 3.35Å; T46-L126 HydrophobicContact CG2-CB 4.37Å; T46-L126 HydrophobicContact CG2-CD2 4.22Å; T46-L126 HydrophobicContact CG2-CG 4.39Å; V47-L126 PolarHBondContact N-O 3.36Å; L126-E128 HydrophobicContact CD2-CG 4.14Å; L126-E128 HydrophobicContact CG-CG 4.06Å
127	V	97.7	Very high	90.6	Very high	9 Å²	9	85.3 Å²	85.3	6%	0.055	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	115.9	175.9	-175.4	0	0	0	0	109.8	V47 N49 V99 R100 S104 V125	V47-V127 CarbonylContact O-C 3.52Å; V47-V127 VanDerWaalsContact O-CA 3.26Å; V47-V127 WeakPolarHBondContact O-CA 3.46Å; N49-V127 HydrophobicContact CB-CG1 4.24Å; V99-V127 HydrophobicContact CG1-CG1 3.95Å; V99-V127 HydrophobicContact CG1-CG2 4.21Å; V99-V127 HydrophobicContact CG2-CG1 4.48Å; V99-V127 HydrophobicContact CG2-CG2 3.54Å; R100-V127 WeakPolarHBondContact O-CG2 3.47Å; S104-V127 WeakPolarHBondContact OG-CB 3.27Å; S104-V127 WeakPolarHBondContact OG-CG2 3.21Å; S104-V127 PolarHBondContact OG-N 3.3Å; V125-V127 HydrophobicContact CG1-CG2 4.25Å
128	E	95.9	Very high	90.2	Very high	86 Å²	86	82.1 Å²	82.1	40%	0.402	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	162.5	-176.4	-64.5	-175.1	157.6	0	0	112.5	T46 V47 Q48 N49 L126	T46-E128 VanDerWaalsContact CG2-CD 3.5Å; T46-E128 HydrophobicContact CG2-CG 3.86Å; V47-E128 PolarHBondContact O-N 3Å; Q48-E128 CarbonylContact C-O 3.53Å; Q48-E128 PolarHBondContact NE2-OE2 3.07Å; N49-E128 WeakPolarHBondContact CB-O 3.43Å; N49-E128 PolarHBondContact N-O 2.97Å; L126-E128 HydrophobicContact CD2-CG 4.14Å; L126-E128 HydrophobicContact CG-CG 4.06Å
129	G	91.2	Very high	89.7	Confident	38 Å²	38	82 Å²	82	39%	0.392	45%	0.451	S	S	.	.	S	Bend	trans	100.3	159.6	175	0	0	0	0	0	113.9
130	V	85.2	Confident	89.1	Confident	135 Å²	135	83.3 Å²	83.3	82%	0.818	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-71.8	130.6	-175.9	-177.6	0	0	0	0	109.4	S132	V130-S132 PolarHBondContact O-N 3.22Å
131	P	76.6	Confident	88.4	Confident	78 Å²	78	88.3 Å²	88.3	51%	0.506	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-61.3	122.6	173.4	-0.7	7.2	0	0	0	110	I101	I101-P131 HydrophobicContact CD1-CG 3.74Å
132	S	71.4	Confident	87.7	Confident	74 Å²	74	90 Å²	90	52%	0.517	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-78.4	129.9	165.6	59.5	0	0	0	0	109.5	V130	V130-S132 PolarHBondContact O-N 3.22Å
133	P	67.7	Low	86.8	Confident	128 Å²	128	87.6 Å²	87.6	83%	0.831	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-60.9	146.9	168.4	-17	29.6	0	0	0	110.3
134	R	62.6	Low	85.8	Confident	261 Å²	261	90.9 Å²	90.9	99%	0.985	50%	0.495	S	S	*	.			trans	-86.9	0	170.2	-73.1	-175.2	177.8	167.7	-0.4	110.8

Retrieved 134 of 134 residues in 53.5 ms (Link to these results)

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