X5J4H9_MOUSE Loading...

IgG1 heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4H9, Species MOUSE (Mus musculus, Mouse), Gene Ighv7-3, Length 93 aa.

						>X5J4H9_MOUSE|X5J4H9|Ighv7-3
GGLVQPGGSLRLSCATSGFTFTDYYMSWVRQPPGKALEWLGFIRNKANGYTTEYSASVKGRFTISRDNSQSILYLQMNTLRAEGSATYYCARG
					

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(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	G	45.6	Very low	69.1	Low	138 Å²	138	94.9 Å²	94.9	100%	1.423	63%	0.629	S	S	*	*				0	126.2	0	0	0	0	0	0	108.1
2	G	54.6	Low	71.1	Confident	62 Å²	62	90.1 Å²	90.1	64%	0.639	59%	0.593	S	S	*	*			trans	-87.5	129.9	-180	0	0	0	0	0	111.1
3	L	57.4	Low	73.1	Confident	187 Å²	187	89.5 Å²	89.5	98%	0.979	59%	0.592	S	S	*	*			trans	-71.4	122.4	166	-80.8	147.3	0	0	0	108.1
4	V	60.4	Low	74.8	Confident	61 Å²	61	84.2 Å²	84.2	37%	0.37	56%	0.557	S	S	.	*			trans	-117.9	135	177.6	-174	0	0	0	0	109	L10 L80	V4-L10 HydrophobicContact CG2-CB 4.16Å; V4-L10 HydrophobicContact CG2-CD1 3.96Å; V4-L10 HydrophobicContact CG2-CD2 4.09Å; V4-L10 HydrophobicContact CG2-CG 4.3Å; V4-L80 HydrophobicContact CB-CD1 3.74Å; V4-L80 HydrophobicContact CG1-CD1 3.48Å; V4-L80 VanDerWaalsContact CG1-CD1 3.48Å
5	Q	64.7	Low	76.3	Confident	162 Å²	162	83.9 Å²	83.9	76%	0.757	56%	0.563	S	S	*	*			trans	-68.2	148.7	179.3	-66.9	-176.7	1.6	0	0	111.4	G8	Q5-G8 PolarHBondContact O-N 3.27Å; Q5-G8 VanDerWaalsContact O-N 3.13Å
6	P	66.4	Low	77.4	Confident	91 Å²	91	80.3 Å²	80.3	59%	0.591	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	143	170.8	-24.1	33.8	0	0	0	111.7	G8 L80 A82	P6-G8 PolarHBondContact O-N 3.28Å; P6-L80 WeakPolarHBondContact CA-O 3.4Å; P6-A82 HydrophobicContact CG-CB 4.33Å
7	G	69.1	Low	78.3	Confident	61 Å²	61	81.9 Å²	81.9	63%	0.629	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.1	-14.7	-174.7	0	0	0	0	0	114.6	L80	G7-L80 PolarHBondContact N-O 3.01Å
8	G	78.1	Confident	79.2	Confident	26 Å²	26	82.1 Å²	82.1	27%	0.268	57%	0.569	S	S	.	*			trans	-74	174.3	172.8	0	0	0	0	0	113.8	Q5 P6 T79 L80	Q5-G8 PolarHBondContact O-N 3.27Å; Q5-G8 VanDerWaalsContact O-N 3.13Å; P6-G8 PolarHBondContact O-N 3.28Å; G8-T79 PolarHBondContact O-N 3.34Å; G8-L80 WeakPolarHBondContact O-CG 3.21Å; G8-L80 PolarHBondContact O-N 3.38Å
9	S	82.9	Confident	80	Confident	72 Å²	72	80.3 Å²	80.3	50%	0.503	55%	0.55	S	S	.	.			trans	-113.6	141.8	171.4	-64.5	0	0	0	0	110	M77	S9-M77 VanDerWaalsContact CA-O 3.24Å; S9-M77 WeakPolarHBondContact CA-O 3.37Å
10	L	88.3	Confident	80.7	Confident	47 Å²	47	80.2 Å²	80.2	25%	0.246	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137	176.4	173.3	60.7	0	0	0	109.2	V4 L12 M77 L80	V4-L10 HydrophobicContact CG2-CB 4.16Å; V4-L10 HydrophobicContact CG2-CD1 3.96Å; V4-L10 HydrophobicContact CG2-CD2 4.09Å; V4-L10 HydrophobicContact CG2-CG 4.3Å; L10-L12 HydrophobicContact CD1-CD2 4.45Å; L10-L12 HydrophobicContact CD2-CD2 3.87Å; L10-L12 HydrophobicContact CG-CD2 4.03Å; L10-M77 HydrophobicContact CB-CE 3.84Å; L10-M77 HydrophobicContact CD2-CE 3.55Å; L10-M77 HydrophobicContact CG-CE 3.68Å; L10-M77 PolarHBondContact N-O 3.04Å; L10-M77 PolarHBondContact O-N 3.3Å; L10-L80 HydrophobicContact CB-CD1 3.82Å
11	R	92.2	Very high	81.4	Confident	137 Å²	137	76.6 Å²	76.6	52%	0.517	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	118.2	171.1	-166.5	173.5	175.9	-178.8	-2.8	109.5	Y74 L75	R11-Y74 HydrophobicContact CG-CD1 4.47Å; R11-Y74 VanDerWaalsContact NH2-CD2 3.32Å; R11-Y74 VanDerWaalsContact NH2-CG 3.28Å; R11-L75 WeakPolarHBondContact CA-O 3.22Å
12	L	93.9	Very high	83.8	Confident	37 Å²	37	72.7 Å²	72.7	19%	0.194	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	148.3	168.7	-55.9	179.9	0	0	0	109.7	L10 W28 Y74 L75 M77 Y88	L10-L12 HydrophobicContact CD1-CD2 4.45Å; L10-L12 HydrophobicContact CD2-CD2 3.87Å; L10-L12 HydrophobicContact CG-CD2 4.03Å; L12-W28 HydrophobicContact CB-CH2 3.79Å; L12-W28 HydrophobicContact CB-CZ2 4.28Å; L12-W28 HydrophobicContact CB-CZ3 4.34Å; L12-W28 HydrophobicContact CD1-CH2 4.48Å; L12-W28 HydrophobicContact CD1-CZ3 4.2Å; L12-Y74 VanDerWaalsContact O-CA 3.24Å; L12-Y74 WeakPolarHBondContact O-CA 3.23Å; L12-L75 HydrophobicContact CB-CB 4.28Å; L12-L75 HydrophobicContact CD1-CD2 4.33Å; L12-L75 PolarHBondContact N-O 2.83Å; L12-L75 PolarHBondContact O-N 2.83Å; L12-M77 HydrophobicContact CD1-CE 3.76Å; L12-M77 HydrophobicContact CD1-SD 4.32Å; L12-M77 HydrophobicContact CD2-CE 4.17Å; L12-M77 HydrophobicContact CG-CE 3.65Å; L12-Y88 HydrophobicContact CD1-CD1 3.75Å; L12-Y88 HydrophobicContact CD1-CD2 3.91Å; L12-Y88 HydrophobicContact CD1-CE1 4.38Å; L12-Y88 HydrophobicContact CD1-CG 3.48Å; L12-Y88 VanDerWaalsContact CD1-CG 3.48Å
13	S	96.8	Very high	85.8	Confident	83 Å²	83	74.2 Å²	74.2	58%	0.58	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.8	168.5	55.1	0	0	0	0	109.5	L73	S13-L73 CarbonylContact C-O 3.59Å; S13-L73 WeakPolarHBondContact CA-O 3.36Å
14	C	96.9	Very high	87.6	Confident	15 Å²	15	69.5 Å²	69.5	10%	0.101	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	110.2	170.1	160	0	0	0	0	108.4	T16 W28 I72 L73 C90	C14-T16 VanDerWaalsContact SG-CG2 3.59Å; C14-W28 HydrophobicContact CB-CH2 3.86Å; C14-W28 HydrophobicContact CB-CZ2 4.16Å; C14-I72 CarbonylContact O-C 3.56Å; C14-I72 VanDerWaalsContact O-CA 3.3Å; C14-I72 WeakPolarHBondContact O-CA 3.41Å; C14-L73 HydrophobicContact CB-CB 4.47Å; C14-L73 PolarHBondContact N-O 2.97Å; C14-L73 PolarHBondContact O-N 3.03Å; C14-C90 HydrophobicContact CB-CB 3.49Å; C14-C90 VanDerWaalsContact CB-CB 3.49Å; C14-C90 WeakPolarHBondContact CB-SG 3.41Å; C14-C90 WeakPolarHBondContact SG-CB 3.45Å; C14-C90 CovalentContact SG-SG 2Å; C14-C90 PolarHBondContact SG-SG 3.24Å
15	A	96.6	Very high	89.3	Confident	79 Å²	79	71.1 Å²	71.1	65%	0.653	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	136.9	168.7	0	0	0	0	0	109.4	I72	A15-I72 HydrophobicContact CB-CG1 4.17Å
16	T	93.8	Very high	90.9	Very high	27 Å²	27	63.5 Å²	63.5	17%	0.166	40%	0.398	C	S	.	.			trans	-122.9	152.4	-177.7	60.9	0	0	0	0	111	C14 F19 F21 M26 S71	C14-T16 VanDerWaalsContact SG-CG2 3.59Å; T16-F19 HydrophobicContact CG2-CE1 4.37Å; T16-F19 HydrophobicContact CG2-CZ 4.07Å; T16-F21 HydrophobicContact CG2-CE2 4.49Å; T16-F21 WeakPolarHBondContact OG1-CD2 3.36Å; T16-M26 HydrophobicContact CG2-CE 4.1Å; T16-S71 PolarHBondContact N-O 2.81Å; T16-S71 PolarHBondContact OG1-O 2.77Å
17	S	94.2	Very high	92.4	Very high	108 Å²	108	59.7 Å²	59.7	76%	0.755	37%	0.374	S	S	*	.			trans	-148.9	166.5	177.5	62.7	0	0	0	0	110.1	F19	S17-F19 WeakPolarHBondContact O-CD1 3.5Å
18	G	94.2	Very high	93.7	Very high	84 Å²	84	57 Å²	57	87%	0.866	35%	0.345	S	S	*	.	S	Bend	trans	84.1	7.6	177.6	0	0	0	0	0	115.4
19	F	93.5	Very high	94.6	Very high	48 Å²	48	57 Å²	57	21%	0.211	34%	0.339	C	S	.	.	S	Bend	trans	-157.3	162.4	171.6	63.8	-83.6	0	0	0	111.4	T16 S17 F21 Y24 M26 R92	T16-F19 HydrophobicContact CG2-CE1 4.37Å; T16-F19 HydrophobicContact CG2-CZ 4.07Å; S17-F19 WeakPolarHBondContact O-CD1 3.5Å; F19-F21 HydrophobicContact CE2-CB 4.34Å; F19-F21 HydrophobicContact CE2-CD2 4.17Å; F19-F21 HydrophobicContact CZ-CD2 4.32Å; F19-F21 PolarHBondContact O-N 3.12Å; F19-Y24 HydrophobicContact CB-CE2 4.31Å; F19-Y24 AromaticContact CD2-CD2 3.61Å; F19-Y24 HydrophobicContact CD2-CD2 3.61Å; F19-Y24 HydrophobicContact CD2-CE2 4.01Å; F19-Y24 HydrophobicContact CD2-CG 4.49Å; F19-Y24 HydrophobicContact CE2-CD2 4.18Å; F19-M26 HydrophobicContact CE2-SD 4Å; F19-M26 HydrophobicContact CZ-CE 4.04Å; F19-M26 HydrophobicContact CZ-SD 4.14Å; F19-R92 VanDerWaalsContact CB-NH1 3.29Å; F19-R92 HydrophobicContact CE2-CB 4.04Å; F19-R92 HydrophobicContact CZ-CB 4.04Å
20	T	95.2	Very high	95.1	Very high	79 Å²	79	54.8 Å²	54.8	49%	0.485	32%	0.32	S	S	.	.			trans	-74.1	92.7	174.9	-48.8	0	0	0	0	110	T22 D23 Y24	T20-T22 WeakPolarHBondContact CG2-OG1 3.43Å; T20-T22 PolarHBondContact O-N 2.74Å; T20-T22 VanDerWaalsContact O-N 3.08Å; T20-D23 VanDerWaalsContact CB-OD2 3.25Å; T20-D23 WeakPolarHBondContact CB-OD2 3.43Å; T20-D23 WeakPolarHBondContact CG2-OD2 3.48Å; T20-D23 PolarHBondContact O-N 2.66Å; T20-Y24 WeakPolarHBondContact O-CD2 3.19Å
21	F	95.6	Very high	95.4	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.018	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-51.2	-36.7	-174.7	179.3	-103.1	0	0	0	113.7	T16 F19 D23 M26 R66 N68 L73	T16-F21 HydrophobicContact CG2-CE2 4.49Å; T16-F21 WeakPolarHBondContact OG1-CD2 3.36Å; F19-F21 HydrophobicContact CE2-CB 4.34Å; F19-F21 HydrophobicContact CE2-CD2 4.17Å; F19-F21 HydrophobicContact CZ-CD2 4.32Å; F19-F21 PolarHBondContact O-N 3.12Å; F21-D23 PolarHBondContact O-N 2.79Å; F21-M26 HydrophobicContact CD2-CE 4.29Å; F21-M26 HydrophobicContact CD2-CG 4.12Å; F21-M26 HydrophobicContact CD2-SD 3.98Å; F21-M26 HydrophobicContact CE2-CE 3.94Å; F21-M26 HydrophobicContact CE2-CG 3.55Å; F21-M26 HydrophobicContact CE2-SD 3.89Å; F21-M26 HydrophobicContact CZ-CG 3.99Å; F21-R66 VanDerWaalsContact CD1-NH2 3.3Å; F21-R66 HydrophobicContact CE1-CB 4.06Å; F21-R66 VanDerWaalsContact CE1-NH2 3.32Å; F21-R66 HydrophobicContact CZ-CB 4.02Å; F21-R66 PolarHBondContact O-NH2 2.79Å; F21-N68 WeakPolarHBondContact CD1-OD1 3.24Å; F21-N68 VanDerWaalsContact CE1-OD1 3.3Å; F21-N68 WeakPolarHBondContact CE1-OD1 3.15Å; F21-L73 HydrophobicContact CE2-CB 4.49Å; F21-L73 HydrophobicContact CZ-CB 4.42Å
22	T	95.7	Very high	95.4	Very high	57 Å²	57	50.7 Å²	50.7	35%	0.35	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-64.1	-21.4	-178.6	51.5	0	0	0	0	114.5	T20 N45 N68	T20-T22 WeakPolarHBondContact CG2-OG1 3.43Å; T20-T22 PolarHBondContact O-N 2.74Å; T20-T22 VanDerWaalsContact O-N 3.08Å; T22-N45 WeakPolarHBondContact O-CB 3.22Å; T22-N68 HydrophobicContact CG2-CB 3.8Å
23	D	95.1	Very high	95.2	Very high	94 Å²	94	53.8 Å²	53.8	50%	0.503	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-87.4	-22.7	-170.9	-60.9	-8.7	0	0	0	111.6	T20 F21 N45	T20-D23 VanDerWaalsContact CB-OD2 3.25Å; T20-D23 WeakPolarHBondContact CB-OD2 3.43Å; T20-D23 WeakPolarHBondContact CG2-OD2 3.48Å; T20-D23 PolarHBondContact O-N 2.66Å; F21-D23 PolarHBondContact O-N 2.79Å; D23-N45 PolarHBondContact O-ND2 3.39Å
24	Y	95.9	Very high	95	Very high	87 Å²	87	54.2 Å²	54.2	34%	0.341	35%	0.347	S	S	.	.	S	Bend	trans	-104.4	150.5	-173.9	-60.3	-82.4	0	0	0	112.4	F19 T20 R66 G93	F19-Y24 HydrophobicContact CB-CE2 4.31Å; F19-Y24 AromaticContact CD2-CD2 3.61Å; F19-Y24 HydrophobicContact CD2-CD2 3.61Å; F19-Y24 HydrophobicContact CD2-CE2 4.01Å; F19-Y24 HydrophobicContact CD2-CG 4.49Å; F19-Y24 HydrophobicContact CE2-CD2 4.18Å; T20-Y24 WeakPolarHBondContact O-CD2 3.19Å; Y24-R66 PolarHBondContact O-NH1 3.23Å; Y24-G93 WeakPolarHBondContact CD1-O 3.48Å
25	Y	96.7	Very high	94.8	Very high	95 Å²	95	60.4 Å²	60.4	37%	0.373	37%	0.372	S	S	.	.			trans	-74.7	151.7	159.5	68.6	-90.7	0	0	0	109.1	F42 I43 G93	Y25-F42 HydrophobicContact CD2-CB 4.23Å; Y25-F42 HydrophobicContact CD2-CG 4.29Å; Y25-I43 WeakPolarHBondContact CA-O 3.21Å; Y25-I43 WeakPolarHBondContact CB-O 3.37Å; Y25-G93 VanDerWaalsContact CE1-CA 3.48Å; Y25-G93 WeakPolarHBondContact CE1-OXT 3.42Å; Y25-G93 VanDerWaalsContact CE2-CA 3.41Å; Y25-G93 PolarHBondContact O-N 2.64Å; Y25-G93 PolarHBondContact OH-OXT 2.83Å
26	M	98	Very high	94.7	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.01	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.2	-174	-62.9	-58.2	-56.1	0	0	109.4	T16 F19 F21 F42 I43 L73 R92	T16-M26 HydrophobicContact CG2-CE 4.1Å; F19-M26 HydrophobicContact CE2-SD 4Å; F19-M26 HydrophobicContact CZ-CE 4.04Å; F19-M26 HydrophobicContact CZ-SD 4.14Å; F21-M26 HydrophobicContact CD2-CE 4.29Å; F21-M26 HydrophobicContact CD2-CG 4.12Å; F21-M26 HydrophobicContact CD2-SD 3.98Å; F21-M26 HydrophobicContact CE2-CE 3.94Å; F21-M26 HydrophobicContact CE2-CG 3.55Å; F21-M26 HydrophobicContact CE2-SD 3.89Å; F21-M26 HydrophobicContact CZ-CG 3.99Å; M26-F42 CarbonylContact O-C 3.49Å; M26-F42 WeakPolarHBondContact O-CA 3.35Å; M26-F42 WeakPolarHBondContact O-CB 3.2Å; M26-I43 HydrophobicContact CB-CG2 4.24Å; M26-I43 PolarHBondContact N-O 2.86Å; M26-I43 PolarHBondContact O-N 2.86Å; M26-L73 HydrophobicContact CB-CD1 3.62Å; M26-L73 HydrophobicContact CB-CD2 3.85Å; M26-L73 HydrophobicContact CB-CG 4.26Å; M26-L73 HydrophobicContact CG-CD1 4.47Å; M26-R92 HydrophobicContact CE-CB 4.17Å; M26-R92 HydrophobicContact SD-CB 3.83Å
27	S	97.7	Very high	94.7	Very high	11 Å²	11	64.4 Å²	64.4	8%	0.077	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	150.9	-174	-58.1	0	0	0	0	111.6	G41 F42 C90 A91	S27-G41 CarbonylContact C-O 3.58Å; S27-G41 VanDerWaalsContact CA-O 3.31Å; S27-G41 WeakPolarHBondContact CA-O 3.36Å; S27-F42 WeakPolarHBondContact OG-CB 3Å; S27-C90 CarbonylContact O-C 3.46Å; S27-C90 VanDerWaalsContact O-CA 3.3Å; S27-C90 WeakPolarHBondContact O-CA 3.43Å; S27-A91 PolarHBondContact N-O 3.23Å; S27-A91 PolarHBondContact O-N 3.02Å
28	W	97.5	Very high	94.8	Very high	6 Å²	6	62 Å²	62	2%	0.023	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.2	164.5	-78.6	98.6	0	0	0	110.3	L12 C14 L40 G41 L73 Y74 L75 Y89	L12-W28 HydrophobicContact CB-CH2 3.79Å; L12-W28 HydrophobicContact CB-CZ2 4.28Å; L12-W28 HydrophobicContact CB-CZ3 4.34Å; L12-W28 HydrophobicContact CD1-CH2 4.48Å; L12-W28 HydrophobicContact CD1-CZ3 4.2Å; C14-W28 HydrophobicContact CB-CH2 3.86Å; C14-W28 HydrophobicContact CB-CZ2 4.16Å; W28-L40 HydrophobicContact CB-CB 4.2Å; W28-L40 HydrophobicContact CB-CD1 4.39Å; W28-L40 WeakPolarHBondContact O-CB 3.45Å; W28-L40 PolarHBondContact O-N 3.04Å; W28-G41 PolarHBondContact N-O 3.38Å; W28-L73 HydrophobicContact CD2-CD2 4.25Å; W28-L73 HydrophobicContact CG-CD2 4.22Å; W28-L73 HydrophobicContact CZ2-CD2 4.25Å; W28-L73 HydrophobicContact CZ2-CG 4.28Å; W28-L73 VanDerWaalsContact NE1-CG 3.34Å; W28-Y74 PolarHBondContact NE1-O 2.91Å; W28-L75 HydrophobicContact CB-CD2 4.43Å; W28-L75 HydrophobicContact CD2-CB 3.87Å; W28-L75 HydrophobicContact CD2-CD2 4.12Å; W28-L75 HydrophobicContact CD2-CG 4.46Å; W28-L75 HydrophobicContact CE3-CD2 4.36Å; W28-L75 HydrophobicContact CG-CB 4.14Å; W28-L75 HydrophobicContact CG-CD1 4.16Å; W28-L75 HydrophobicContact CG-CD2 4.15Å; W28-L75 HydrophobicContact CG-CG 4.4Å; W28-L75 HydrophobicContact CZ2-CB 3.87Å; W28-Y89 WeakPolarHBondContact CA-O 3.42Å
29	V	96.1	Very high	94.8	Very high	24 Å²	24	62.7 Å²	62.7	15%	0.145	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.5	176.5	-175	0	0	0	0	107.4	L37 E38 Y88 Y89	V29-L37 HydrophobicContact CG1-CB 3.79Å; V29-L37 HydrophobicContact CG1-CD2 3.66Å; V29-L37 HydrophobicContact CG1-CG 4.23Å; V29-E38 CarbonylContact C-O 3.52Å; V29-E38 WeakPolarHBondContact CA-O 3.39Å; V29-E38 WeakPolarHBondContact CG1-O 3.43Å; V29-Y88 WeakPolarHBondContact O-CA 3.3Å; V29-Y89 PolarHBondContact N-O 3.14Å; V29-Y89 PolarHBondContact O-N 3.26Å
30	R	94.1	Very high	94.9	Very high	27 Å²	27	60.4 Å²	60.4	10%	0.102	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	154.4	170.8	69.8	174.5	177.5	-172.4	-3.8	111.6	E38 L40 A86 T87 Y88	R30-E38 HydrophobicContact CG-CB 4.12Å; R30-E38 IonicContact CZ-OE1 3.12Å; R30-E38 IonicContact CZ-OE2 2.74Å; R30-E38 PolarHBondContact N-O 3.05Å; R30-E38 IonicContact NE-OE1 3.91Å; R30-E38 IonicContact NE-OE2 3.17Å; R30-E38 PolarHBondContact NE-OE2 3.39Å; R30-E38 VanDerWaalsContact NH2-CD 3.31Å; R30-E38 IonicContact NH2-OE1 3.43Å; R30-E38 PolarHBondContact NH2-OE1 2.87Å; R30-E38 VanDerWaalsContact NH2-OE1 3.12Å; R30-E38 IonicContact NH2-OE2 3.91Å; R30-E38 PolarHBondContact NH2-OE2 2.97Å; R30-E38 PolarHBondContact O-N 3.06Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CG 4.39Å; R30-L40 HydrophobicContact CG-CD1 4.16Å; R30-L40 HydrophobicContact CG-CD2 3.76Å; R30-L40 HydrophobicContact CG-CG 4.1Å; R30-A86 HydrophobicContact CB-CB 4.12Å; R30-T87 CarbonylContact C-O 3.47Å; R30-T87 VanDerWaalsContact CA-O 3.24Å; R30-T87 WeakPolarHBondContact CA-O 3.22Å; R30-Y88 HydrophobicContact CB-CD1 3.97Å; R30-Y88 HydrophobicContact CB-CE1 4.02Å; R30-Y88 HydrophobicContact CB-CG 4.37Å
31	Q	93.9	Very high	95	Very high	74 Å²	74	56.7 Å²	56.7	35%	0.346	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	104.5	171.9	-167.4	176.8	24.3	0	0	109.6	K35 L37 A86 T87 Y89	Q31-K35 WeakPolarHBondContact CG-O 3.02Å; Q31-L37 HydrophobicContact CB-CD2 3.79Å; Q31-L37 HydrophobicContact CG-CD2 4.27Å; Q31-A86 WeakPolarHBondContact O-CA 3.3Å; Q31-A86 WeakPolarHBondContact O-CB 3.05Å; Q31-T87 PolarHBondContact N-O 3.2Å; Q31-T87 PolarHBondContact O-N 2.85Å; Q31-Y89 HydrophobicContact CB-CE2 3.84Å; Q31-Y89 PolarHBondContact OE1-OH 3.01Å
32	P	91.3	Very high	95.2	Very high	23 Å²	23	57.6 Å²	57.6	15%	0.149	32%	0.317	C	S	.	.			trans	-65.3	150.2	167.6	-17.3	31	0	0	0	110.7	G34 K35 A86	P32-G34 PolarHBondContact O-N 3.34Å; P32-K35 HydrophobicContact CB-CB 4.05Å; P32-K35 HydrophobicContact CB-CD 4Å; P32-K35 HydrophobicContact CB-CG 4.16Å; P32-K35 HydrophobicContact CG-CB 4.25Å; P32-K35 HydrophobicContact CG-CD 4.26Å; P32-K35 PolarHBondContact O-N 2.9Å; P32-A86 HydrophobicContact CG-CB 4.48Å
33	P	91.1	Very high	95.3	Very high	102 Å²	102	55.4 Å²	55.4	66%	0.662	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	127.9	176.1	-26.4	33.9	0	0	0	112.1	K35 S85	P33-K35 PolarHBondContact O-N 3.38Å; P33-S85 WeakPolarHBondContact CD-O 3.3Å
34	G	93	Very high	95.4	Very high	92 Å²	92	54.9 Å²	54.9	95%	0.948	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	10.2	179.7	0	0	0	0	0	115.4	P32	P32-G34 PolarHBondContact O-N 3.34Å
35	K	92.2	Very high	95.4	Very high	145 Å²	145	51.8 Å²	51.8	63%	0.63	28%	0.283	S	S	*	.	S	Bend	trans	-118.6	162.4	179.2	-58.8	-166.8	-177.8	-178.6	0	112.3	Q31 P32 P33	Q31-K35 WeakPolarHBondContact CG-O 3.02Å; P32-K35 HydrophobicContact CB-CB 4.05Å; P32-K35 HydrophobicContact CB-CD 4Å; P32-K35 HydrophobicContact CB-CG 4.16Å; P32-K35 HydrophobicContact CG-CB 4.25Å; P32-K35 HydrophobicContact CG-CD 4.26Å; P32-K35 PolarHBondContact O-N 2.9Å; P33-K35 PolarHBondContact O-N 3.38Å
36	A	93.8	Very high	95.2	Very high	82 Å²	82	54.2 Å²	54.2	68%	0.678	30%	0.296	S	S	*	.			trans	-66.1	164.6	172.2	0	0	0	0	0	111.7
37	L	94.8	Very high	95	Very high	108 Å²	108	58.4 Å²	58.4	57%	0.565	33%	0.331	S	S	*	.			trans	-64.4	135	172.4	-72.3	165.7	0	0	0	110.6	V29 Q31 Y89	V29-L37 HydrophobicContact CG1-CB 3.79Å; V29-L37 HydrophobicContact CG1-CD2 3.66Å; V29-L37 HydrophobicContact CG1-CG 4.23Å; Q31-L37 HydrophobicContact CB-CD2 3.79Å; Q31-L37 HydrophobicContact CG-CD2 4.27Å; L37-Y89 HydrophobicContact CD2-CD2 3.99Å; L37-Y89 HydrophobicContact CD2-CE2 3.97Å
38	E	94.6	Very high	94.9	Very high	58 Å²	58	62 Å²	62	27%	0.271	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.4	175.6	-175.4	-170.3	166.6	0	0	109.3	V29 R30 S57	V29-E38 CarbonylContact C-O 3.52Å; V29-E38 WeakPolarHBondContact CA-O 3.39Å; V29-E38 WeakPolarHBondContact CG1-O 3.43Å; R30-E38 HydrophobicContact CG-CB 4.12Å; R30-E38 IonicContact CZ-OE1 3.12Å; R30-E38 IonicContact CZ-OE2 2.74Å; R30-E38 PolarHBondContact N-O 3.05Å; R30-E38 IonicContact NE-OE1 3.91Å; R30-E38 IonicContact NE-OE2 3.17Å; R30-E38 PolarHBondContact NE-OE2 3.39Å; R30-E38 VanDerWaalsContact NH2-CD 3.31Å; R30-E38 IonicContact NH2-OE1 3.43Å; R30-E38 PolarHBondContact NH2-OE1 2.87Å; R30-E38 VanDerWaalsContact NH2-OE1 3.12Å; R30-E38 IonicContact NH2-OE2 3.91Å; R30-E38 PolarHBondContact NH2-OE2 2.97Å; R30-E38 PolarHBondContact O-N 3.06Å; E38-S57 WeakPolarHBondContact OE1-CB 3.01Å; E38-S57 PolarHBondContact OE1-OG 3.13Å
39	W	96.2	Very high	94.8	Very high	98 Å²	98	64.2 Å²	64.2	37%	0.371	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	132.1	171.7	176.2	83.5	0	0	0	110.6	G41 F42 E53 S55	W39-G41 VanDerWaalsContact CE2-CA 3.46Å; W39-G41 PolarHBondContact NE1-O 3.42Å; W39-F42 HydrophobicContact CH2-CD1 4.39Å; W39-F42 HydrophobicContact CZ2-CB 4.41Å; W39-F42 AromaticContact CZ2-CD1 3.44Å; W39-F42 HydrophobicContact CZ2-CD1 3.44Å; W39-F42 VanDerWaalsContact CZ2-CD1 3.44Å; W39-F42 HydrophobicContact CZ2-CE1 4.04Å; W39-F42 HydrophobicContact CZ2-CG 4.27Å; W39-E53 HydrophobicContact CH2-CB 4.24Å; W39-S55 VanDerWaalsContact O-CB 3.3Å; W39-S55 WeakPolarHBondContact O-CB 3.31Å; W39-S55 PolarHBondContact O-OG 3.12Å
40	L	95.4	Very high	94.8	Very high	1 Å²	1	67.6 Å²	67.6	1%	0.005	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-36.2	-177.7	-62.5	-174	0	0	0	112.9	W28 R30 Y54 S55 V58 F62 L75 Y88	W28-L40 HydrophobicContact CB-CB 4.2Å; W28-L40 HydrophobicContact CB-CD1 4.39Å; W28-L40 WeakPolarHBondContact O-CB 3.45Å; W28-L40 PolarHBondContact O-N 3.04Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CG 4.39Å; R30-L40 HydrophobicContact CG-CD1 4.16Å; R30-L40 HydrophobicContact CG-CD2 3.76Å; R30-L40 HydrophobicContact CG-CG 4.1Å; L40-Y54 WeakPolarHBondContact O-CA 3.42Å; L40-S55 PolarHBondContact O-N 3.16Å; L40-S55 PolarHBondContact O-OG 3.33Å; L40-V58 HydrophobicContact CB-CG2 4.35Å; L40-V58 HydrophobicContact CD2-CG1 3.82Å; L40-V58 WeakPolarHBondContact O-CG2 3.45Å; L40-F62 HydrophobicContact CD1-CD2 4.41Å; L40-F62 HydrophobicContact CD1-CE2 4.18Å; L40-L75 HydrophobicContact CD1-CD2 4.09Å; L40-Y88 HydrophobicContact CD1-CD1 3.87Å; L40-Y88 HydrophobicContact CD1-CE1 3.69Å
41	G	97.3	Very high	95	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.4	168	-172.5	0	0	0	0	0	112	S27 W28 W39 E53	S27-G41 CarbonylContact C-O 3.58Å; S27-G41 VanDerWaalsContact CA-O 3.31Å; S27-G41 WeakPolarHBondContact CA-O 3.36Å; W28-G41 PolarHBondContact N-O 3.38Å; W39-G41 VanDerWaalsContact CE2-CA 3.46Å; W39-G41 PolarHBondContact NE1-O 3.42Å; G41-E53 CarbonylContact C-O 3.5Å; G41-E53 WeakPolarHBondContact CA-O 3.37Å
42	F	98.1	Very high	95.2	Very high	24 Å²	24	68.8 Å²	68.8	11%	0.105	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	163.6	169.5	71	-108.7	0	0	0	112	Y25 M26 S27 W39 R44 T52 E53	Y25-F42 HydrophobicContact CD2-CB 4.23Å; Y25-F42 HydrophobicContact CD2-CG 4.29Å; M26-F42 CarbonylContact O-C 3.49Å; M26-F42 WeakPolarHBondContact O-CA 3.35Å; M26-F42 WeakPolarHBondContact O-CB 3.2Å; S27-F42 WeakPolarHBondContact OG-CB 3Å; W39-F42 HydrophobicContact CH2-CD1 4.39Å; W39-F42 HydrophobicContact CZ2-CB 4.41Å; W39-F42 AromaticContact CZ2-CD1 3.44Å; W39-F42 HydrophobicContact CZ2-CD1 3.44Å; W39-F42 VanDerWaalsContact CZ2-CD1 3.44Å; W39-F42 HydrophobicContact CZ2-CE1 4.04Å; W39-F42 HydrophobicContact CZ2-CG 4.27Å; F42-R44 HydrophobicContact CD2-CG 4Å; F42-R44 HydrophobicContact CE2-CG 3.49Å; F42-R44 VanDerWaalsContact CE2-CG 3.49Å; F42-T52 VanDerWaalsContact O-CA 3.3Å; F42-T52 WeakPolarHBondContact O-CA 3.4Å; F42-E53 HydrophobicContact CD1-CB 4.37Å; F42-E53 HydrophobicContact CE1-CB 3.81Å; F42-E53 HydrophobicContact CE1-CG 4.21Å; F42-E53 HydrophobicContact CE2-CB 4.28Å; F42-E53 HydrophobicContact CE2-CG 4.25Å; F42-E53 HydrophobicContact CZ-CB 3.77Å; F42-E53 HydrophobicContact CZ-CG 3.72Å; F42-E53 VanDerWaalsContact CZ-OE1 3.27Å; F42-E53 WeakPolarHBondContact CZ-OE1 3.48Å; F42-E53 PolarHBondContact N-O 2.72Å; F42-E53 PolarHBondContact O-N 3.43Å; F42-E53 VanDerWaalsContact O-N 3.16Å
43	I	98.4	Very high	95.4	Very high	11 Å²	11	72.1 Å²	72.1	6%	0.056	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.6	166.6	-174.9	161.3	0	0	0	109.4	Y25 M26 T52 I64 R66 L73	Y25-I43 WeakPolarHBondContact CA-O 3.21Å; Y25-I43 WeakPolarHBondContact CB-O 3.37Å; M26-I43 HydrophobicContact CB-CG2 4.24Å; M26-I43 PolarHBondContact N-O 2.86Å; M26-I43 PolarHBondContact O-N 2.86Å; I43-T52 HydrophobicContact CB-CG2 3.85Å; I43-T52 HydrophobicContact CD1-CG2 3.9Å; I43-T52 HydrophobicContact CG1-CG2 3.75Å; I43-I64 HydrophobicContact CB-CG2 3.81Å; I43-I64 HydrophobicContact CG2-CG2 3.61Å; I43-R66 HydrophobicContact CD1-CG 3.92Å; I43-R66 HydrophobicContact CG1-CG 4.48Å; I43-R66 HydrophobicContact CG2-CB 4.36Å; I43-R66 HydrophobicContact CG2-CG 4.45Å; I43-L73 HydrophobicContact CG2-CD1 3.56Å
44	R	97.6	Very high	95.7	Very high	82 Å²	82	70 Å²	70	31%	0.309	39%	0.393	S	S	.	.			trans	-70.7	166.2	177.3	-55.8	-164.3	178.7	-109.9	-3.2	111.7	F42 N48 T51 E53 R66	F42-R44 HydrophobicContact CD2-CG 4Å; F42-R44 HydrophobicContact CE2-CG 3.49Å; F42-R44 VanDerWaalsContact CE2-CG 3.49Å; R44-N48 HydrophobicContact CB-CB 3.73Å; R44-N48 HydrophobicContact CG-CB 4.26Å; R44-T51 VanDerWaalsContact CD-OG1 3.22Å; R44-T51 WeakPolarHBondContact CD-OG1 3.16Å; R44-T51 WeakPolarHBondContact CG-OG1 3.49Å; R44-T51 PolarHBondContact N-O 2Å; R44-E53 IonicContact NH2-OE1 2.77Å; R44-E53 PolarHBondContact NH2-OE1 2.95Å; R44-R66 PolarHBondContact O-NH1 2.86Å
45	N	95.6	Very high	95.8	Very high	22 Å²	22	66.4 Å²	66.4	12%	0.118	35%	0.354	C	S	.	.			trans	-69	176.3	172	67.7	14.3	0	0	0	112.1	T22 D23 A47 N48 Y50	T22-N45 WeakPolarHBondContact O-CB 3.22Å; D23-N45 PolarHBondContact O-ND2 3.39Å; N45-A47 VanDerWaalsContact C-N 3.29Å; N45-A47 PolarHBondContact O-N 2.87Å; N45-A47 PolarHBondContact OD1-N 2.91Å; N45-N48 PolarHBondContact O-N 2.97Å; N45-N48 PolarHBondContact OD1-N 2.89Å; N45-N48 PolarHBondContact OD1-OD1 3.13Å; N45-Y50 PolarHBondContact O-N 2.8Å
46	K	93.6	Very high	95.9	Very high	147 Å²	147	64.3 Å²	64.3	64%	0.639	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-60	-39.2	178.6	-174.7	175.2	175.3	-179.1	0	112.2	N48 G49 Y50	K46-N48 PolarHBondContact O-N 3.23Å; K46-G49 PolarHBondContact O-N 2.94Å; K46-Y50 HydrophobicContact CB-CE1 3.84Å; K46-Y50 HydrophobicContact CB-CE2 4.13Å; K46-Y50 WeakPolarHBondContact CB-OH 3.27Å; K46-Y50 HydrophobicContact CG-CE1 4.48Å; K46-Y50 HydrophobicContact CG-CE2 3.87Å; K46-Y50 WeakPolarHBondContact CG-OH 3.3Å
47	A	93.8	Very high	95.6	Very high	90 Å²	90	62.5 Å²	62.5	74%	0.744	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-62.7	-26.9	-178.3	0	0	0	0	0	112.7	N45	N45-A47 VanDerWaalsContact C-N 3.29Å; N45-A47 PolarHBondContact O-N 2.87Å; N45-A47 PolarHBondContact OD1-N 2.91Å
48	N	95.1	Very high	95.4	Very high	85 Å²	85	57.4 Å²	57.4	46%	0.455	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-102.8	24	175.1	-53.7	127.9	0	0	0	113.2	R44 N45 K46 Y50 T51	R44-N48 HydrophobicContact CB-CB 3.73Å; R44-N48 HydrophobicContact CG-CB 4.26Å; N45-N48 PolarHBondContact O-N 2.97Å; N45-N48 PolarHBondContact OD1-N 2.89Å; N45-N48 PolarHBondContact OD1-OD1 3.13Å; K46-N48 PolarHBondContact O-N 3.23Å; N48-Y50 VanDerWaalsContact C-N 3.34Å; N48-Y50 PolarHBondContact O-N 2.86Å; N48-T51 PolarHBondContact O-OG1 3.39Å
49	G	95	Very high	95.3	Very high	54 Å²	54	62 Å²	62	56%	0.557	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	20.5	169.3	0	0	0	0	0	115.4	K46 T51	K46-G49 PolarHBondContact O-N 2.94Å; G49-T51 PolarHBondContact O-N 3.03Å; G49-T51 VanDerWaalsContact O-N 3.11Å
50	Y	96.5	Very high	95	Very high	95 Å²	95	61.2 Å²	61.2	37%	0.373	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	27.2	-179.5	-57.2	-65.4	0	0	0	114.7	N45 K46 N48 R66 N68	N45-Y50 PolarHBondContact O-N 2.8Å; K46-Y50 HydrophobicContact CB-CE1 3.84Å; K46-Y50 HydrophobicContact CB-CE2 4.13Å; K46-Y50 WeakPolarHBondContact CB-OH 3.27Å; K46-Y50 HydrophobicContact CG-CE1 4.48Å; K46-Y50 HydrophobicContact CG-CE2 3.87Å; K46-Y50 WeakPolarHBondContact CG-OH 3.3Å; N48-Y50 VanDerWaalsContact C-N 3.34Å; N48-Y50 PolarHBondContact O-N 2.86Å; Y50-R66 HydrophobicContact CD1-CG 4.45Å; Y50-R66 HydrophobicContact CE1-CG 4.46Å; Y50-N68 PolarHBondContact OH-ND2 3.27Å; Y50-N68 VanDerWaalsContact OH-ND2 3.13Å
51	T	97.1	Very high	94.8	Very high	70 Å²	70	62.7 Å²	62.7	43%	0.429	37%	0.365	S	S	.	.			trans	-62.4	146	178.3	55	0	0	0	0	110.7	R44 N48 G49	R44-T51 VanDerWaalsContact CD-OG1 3.22Å; R44-T51 WeakPolarHBondContact CD-OG1 3.16Å; R44-T51 WeakPolarHBondContact CG-OG1 3.49Å; R44-T51 PolarHBondContact N-O 2Å; N48-T51 PolarHBondContact O-OG1 3.39Å; G49-T51 PolarHBondContact O-N 3.03Å; G49-T51 VanDerWaalsContact O-N 3.11Å
52	T	97.9	Very high	94.6	Very high	56 Å²	56	63.1 Å²	63.1	34%	0.344	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.7	-178.7	52.4	0	0	0	0	110.4	F42 I43 Y54	F42-T52 VanDerWaalsContact O-CA 3.3Å; F42-T52 WeakPolarHBondContact O-CA 3.4Å; I43-T52 HydrophobicContact CB-CG2 3.85Å; I43-T52 HydrophobicContact CD1-CG2 3.9Å; I43-T52 HydrophobicContact CG1-CG2 3.75Å; T52-Y54 WeakPolarHBondContact OG1-CE2 3.25Å
53	E	97.4	Very high	94.5	Very high	93 Å²	93	65.2 Å²	65.2	44%	0.435	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.2	172	-67.8	-179.9	-141	0	0	108.4	W39 G41 F42 R44	W39-E53 HydrophobicContact CH2-CB 4.24Å; G41-E53 CarbonylContact C-O 3.5Å; G41-E53 WeakPolarHBondContact CA-O 3.37Å; F42-E53 HydrophobicContact CD1-CB 4.37Å; F42-E53 HydrophobicContact CE1-CB 3.81Å; F42-E53 HydrophobicContact CE1-CG 4.21Å; F42-E53 HydrophobicContact CE2-CB 4.28Å; F42-E53 HydrophobicContact CE2-CG 4.25Å; F42-E53 HydrophobicContact CZ-CB 3.77Å; F42-E53 HydrophobicContact CZ-CG 3.72Å; F42-E53 VanDerWaalsContact CZ-OE1 3.27Å; F42-E53 WeakPolarHBondContact CZ-OE1 3.48Å; F42-E53 PolarHBondContact N-O 2.72Å; F42-E53 PolarHBondContact O-N 3.43Å; F42-E53 VanDerWaalsContact O-N 3.16Å; R44-E53 IonicContact NH2-OE1 2.77Å; R44-E53 PolarHBondContact NH2-OE1 2.95Å
54	Y	97	Very high	94.5	Very high	56 Å²	56	65 Å²	65	22%	0.22	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.2	-174.7	-61.8	-88.1	0	0	0	109.8	L40 T52 V58 F62 I64	L40-Y54 WeakPolarHBondContact O-CA 3.42Å; T52-Y54 WeakPolarHBondContact OG1-CE2 3.25Å; Y54-V58 HydrophobicContact CD1-CG2 4.39Å; Y54-F62 VanDerWaalsContact CE1-O 3.26Å; Y54-F62 WeakPolarHBondContact CE1-O 3.35Å; Y54-I64 HydrophobicContact CD1-CD1 4.36Å; Y54-I64 HydrophobicContact CE1-CB 4.35Å; Y54-I64 HydrophobicContact CE1-CD1 4.01Å; Y54-I64 HydrophobicContact CE1-CG1 3.87Å; Y54-I64 PolarHBondContact OH-N 2.87Å
55	S	95.1	Very high	94.4	Very high	18 Å²	18	63.2 Å²	63.2	13%	0.126	38%	0.381	C	S	.	.			trans	-66.4	152.8	168.9	73.9	0	0	0	0	110.4	W39 L40 S57 V58 K59	W39-S55 VanDerWaalsContact O-CB 3.3Å; W39-S55 WeakPolarHBondContact O-CB 3.31Å; W39-S55 PolarHBondContact O-OG 3.12Å; L40-S55 PolarHBondContact O-N 3.16Å; L40-S55 PolarHBondContact O-OG 3.33Å; S55-S57 PolarHBondContact O-N 2.98Å; S55-S57 VanDerWaalsContact O-N 3.12Å; S55-S57 PolarHBondContact OG-OG 3.34Å; S55-V58 PolarHBondContact O-N 3.02Å; S55-V58 VanDerWaalsContact O-N 3.13Å; S55-K59 PolarHBondContact O-N 3.09Å
56	A	93.1	Very high	94.5	Very high	100 Å²	100	63.6 Å²	63.6	83%	0.826	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.6	179.7	0	0	0	0	0	112.5	V58	A56-V58 VanDerWaalsContact C-N 3.3Å; A56-V58 PolarHBondContact O-N 3.04Å
57	S	88.2	Confident	94.7	Very high	45 Å²	45	58.8 Å²	58.8	32%	0.315	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-26.2	-178.8	63.5	0	0	0	0	113.1	E38 S55 R61	E38-S57 WeakPolarHBondContact OE1-CB 3.01Å; E38-S57 PolarHBondContact OE1-OG 3.13Å; S55-S57 PolarHBondContact O-N 2.98Å; S55-S57 VanDerWaalsContact O-N 3.12Å; S55-S57 PolarHBondContact OG-OG 3.34Å; S57-R61 PolarHBondContact O-NH2 2.79Å
58	V	90.6	Very high	94.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-6.7	-174.2	-56.3	0	0	0	0	114.9	L40 Y54 S55 A56 G60 R61 F62	L40-V58 HydrophobicContact CB-CG2 4.35Å; L40-V58 HydrophobicContact CD2-CG1 3.82Å; L40-V58 WeakPolarHBondContact O-CG2 3.45Å; Y54-V58 HydrophobicContact CD1-CG2 4.39Å; S55-V58 PolarHBondContact O-N 3.02Å; S55-V58 VanDerWaalsContact O-N 3.13Å; A56-V58 VanDerWaalsContact C-N 3.3Å; A56-V58 PolarHBondContact O-N 3.04Å; V58-G60 PolarHBondContact O-N 3.08Å; V58-R61 PolarHBondContact O-N 3.03Å; V58-F62 HydrophobicContact CB-CB 4.11Å; V58-F62 HydrophobicContact CB-CD1 4.39Å; V58-F62 HydrophobicContact CB-CD2 3.48Å; V58-F62 VanDerWaalsContact CB-CD2 3.48Å; V58-F62 HydrophobicContact CB-CE2 3.91Å; V58-F62 HydrophobicContact CB-CG 3.75Å; V58-F62 HydrophobicContact CG1-CD2 3.49Å; V58-F62 VanDerWaalsContact CG1-CD2 3.49Å; V58-F62 HydrophobicContact CG1-CE2 3.38Å; V58-F62 HydrophobicContact CG1-CG 4.18Å; V58-F62 HydrophobicContact CG1-CZ 3.97Å; V58-F62 HydrophobicContact CG2-CB 4.35Å; V58-F62 HydrophobicContact CG2-CD2 4.01Å; V58-F62 HydrophobicContact CG2-CG 4.39Å; V58-F62 PolarHBondContact O-N 2.98Å; V58-F62 VanDerWaalsContact O-N 3.09Å
59	K	92	Very high	94.7	Very high	156 Å²	156	57.3 Å²	57.3	68%	0.678	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	130.1	178.2	-167.6	172.6	-174.4	176.7	0	111	S55 R61	S55-K59 PolarHBondContact O-N 3.09Å; K59-R61 PolarHBondContact O-N 2.87Å
60	G	91.1	Very high	94.8	Very high	80 Å²	80	60.1 Å²	60.1	83%	0.825	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	-5.9	-178.8	0	0	0	0	0	115.4	V58	V58-G60 PolarHBondContact O-N 3.08Å
61	R	91.1	Very high	94.8	Very high	32 Å²	32	57.2 Å²	57.2	12%	0.121	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-36.4	177	-60.9	-169.3	-64.7	137	-6.1	112.6	S57 V58 K59 N78	S57-R61 PolarHBondContact O-NH2 2.79Å; V58-R61 PolarHBondContact O-N 3.03Å; K59-R61 PolarHBondContact O-N 2.87Å; R61-N78 VanDerWaalsContact O-CB 3.32Å; R61-N78 WeakPolarHBondContact O-CB 3.26Å; R61-N78 PolarHBondContact O-N 3.45Å
62	F	92.6	Very high	94.9	Very high	10 Å²	10	55.2 Å²	55.2	4%	0.044	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	147.2	-178.2	-65	4	0	0	0	110.8	L40 Y54 V58 L75 Q76 M77	L40-F62 HydrophobicContact CD1-CD2 4.41Å; L40-F62 HydrophobicContact CD1-CE2 4.18Å; Y54-F62 VanDerWaalsContact CE1-O 3.26Å; Y54-F62 WeakPolarHBondContact CE1-O 3.35Å; V58-F62 HydrophobicContact CB-CB 4.11Å; V58-F62 HydrophobicContact CB-CD1 4.39Å; V58-F62 HydrophobicContact CB-CD2 3.48Å; V58-F62 VanDerWaalsContact CB-CD2 3.48Å; V58-F62 HydrophobicContact CB-CE2 3.91Å; V58-F62 HydrophobicContact CB-CG 3.75Å; V58-F62 HydrophobicContact CG1-CD2 3.49Å; V58-F62 VanDerWaalsContact CG1-CD2 3.49Å; V58-F62 HydrophobicContact CG1-CE2 3.38Å; V58-F62 HydrophobicContact CG1-CG 4.18Å; V58-F62 HydrophobicContact CG1-CZ 3.97Å; V58-F62 HydrophobicContact CG2-CB 4.35Å; V58-F62 HydrophobicContact CG2-CD2 4.01Å; V58-F62 HydrophobicContact CG2-CG 4.39Å; V58-F62 PolarHBondContact O-N 2.98Å; V58-F62 VanDerWaalsContact O-N 3.09Å; F62-L75 HydrophobicContact CB-CD1 4.05Å; F62-L75 HydrophobicContact CD2-CD1 4.14Å; F62-L75 HydrophobicContact CD2-CD2 4.19Å; F62-L75 HydrophobicContact CD2-CG 4.42Å; F62-L75 HydrophobicContact CE2-CD2 4.47Å; F62-L75 HydrophobicContact CG-CD1 4.43Å; F62-Q76 CarbonylContact C-O 3.57Å; F62-Q76 VanDerWaalsContact CA-O 3.23Å; F62-Q76 WeakPolarHBondContact CA-O 3.47Å; F62-M77 HydrophobicContact CD1-CB 3.79Å; F62-M77 HydrophobicContact CD1-CG 3.83Å; F62-M77 HydrophobicContact CD2-CG 4.02Å; F62-M77 HydrophobicContact CE1-CB 3.64Å; F62-M77 HydrophobicContact CE1-CG 3.75Å; F62-M77 HydrophobicContact CE1-SD 4.4Å; F62-M77 HydrophobicContact CE2-CG 3.92Å; F62-M77 HydrophobicContact CE2-SD 4Å; F62-M77 HydrophobicContact CG-CB 4.43Å; F62-M77 HydrophobicContact CG-CG 4Å; F62-M77 HydrophobicContact CZ-CB 4.13Å; F62-M77 HydrophobicContact CZ-CG 3.8Å; F62-M77 HydrophobicContact CZ-SD 3.91Å
63	T	96	Very high	94.9	Very high	67 Å²	67	52.5 Å²	52.5	41%	0.411	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	122.8	174.7	-51.9	0	0	0	0	109	Q76	T63-Q76 PolarHBondContact N-O 3.48Å; T63-Q76 PolarHBondContact O-N 2.96Å
64	I	97.3	Very high	94.9	Very high	6 Å²	6	49.9 Å²	49.9	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.5	174.3	-61.8	169.8	0	0	0	108.4	I43 Y54 L73 Y74 L75	I43-I64 HydrophobicContact CB-CG2 3.81Å; I43-I64 HydrophobicContact CG2-CG2 3.61Å; Y54-I64 HydrophobicContact CD1-CD1 4.36Å; Y54-I64 HydrophobicContact CE1-CB 4.35Å; Y54-I64 HydrophobicContact CE1-CD1 4.01Å; Y54-I64 HydrophobicContact CE1-CG1 3.87Å; Y54-I64 PolarHBondContact OH-N 2.87Å; I64-L73 HydrophobicContact CG2-CD1 3.91Å; I64-Y74 WeakPolarHBondContact CA-O 3.24Å; I64-L75 HydrophobicContact CD1-CD1 4.4Å; I64-L75 HydrophobicContact CG1-CD1 3.58Å
65	S	97.4	Very high	94.9	Very high	45 Å²	45	47.2 Å²	47.2	32%	0.315	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.7	172.6	63.2	0	0	0	0	110.6	Y74	S65-Y74 PolarHBondContact N-O 3.05Å; S65-Y74 VanDerWaalsContact N-O 3.14Å; S65-Y74 PolarHBondContact O-N 2.96Å
66	R	97.3	Very high	94.8	Very high	31 Å²	31	48.8 Å²	48.8	12%	0.117	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	142.5	-176.9	63.3	-173	-70.4	163	6.5	111.1	F21 Y24 I43 R44 Y50 N68 I72 L73	F21-R66 VanDerWaalsContact CD1-NH2 3.3Å; F21-R66 HydrophobicContact CE1-CB 4.06Å; F21-R66 VanDerWaalsContact CE1-NH2 3.32Å; F21-R66 HydrophobicContact CZ-CB 4.02Å; F21-R66 PolarHBondContact O-NH2 2.79Å; Y24-R66 PolarHBondContact O-NH1 3.23Å; I43-R66 HydrophobicContact CD1-CG 3.92Å; I43-R66 HydrophobicContact CG1-CG 4.48Å; I43-R66 HydrophobicContact CG2-CB 4.36Å; I43-R66 HydrophobicContact CG2-CG 4.45Å; R44-R66 PolarHBondContact O-NH1 2.86Å; Y50-R66 HydrophobicContact CD1-CG 4.45Å; Y50-R66 HydrophobicContact CE1-CG 4.46Å; R66-N68 PolarHBondContact NE-OD1 2.71Å; R66-N68 PolarHBondContact NH2-OD1 3.19Å; R66-I72 CarbonylContact C-O 3.59Å; R66-I72 WeakPolarHBondContact CA-O 3.35Å; R66-L73 HydrophobicContact CB-CD1 4.16Å
67	D	96.4	Very high	94.7	Very high	45 Å²	45	44.1 Å²	44.1	24%	0.241	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	108.8	167.6	-175.5	-19.9	0	0	0	108.7	S69 Q70 S71 I72 Y74	D67-S69 WeakPolarHBondContact OD1-CA 3.3Å; D67-S69 WeakPolarHBondContact OD1-CB 3.36Å; D67-S69 PolarHBondContact OD1-N 3.14Å; D67-S69 PolarHBondContact OD1-OG 2.77Å; D67-Q70 HydrophobicContact CB-CB 4.4Å; D67-Q70 PolarHBondContact OD1-N 2.88Å; D67-Q70 WeakPolarHBondContact OD2-CG 3.24Å; D67-S71 WeakPolarHBondContact O-CA 3.38Å; D67-S71 PolarHBondContact O-N 2.99Å; D67-I72 PolarHBondContact N-O 3.23Å; D67-I72 PolarHBondContact O-N 2.8Å; D67-Y74 HydrophobicContact CB-CE2 3.93Å
68	N	95.5	Very high	94.7	Very high	40 Å²	40	44.7 Å²	44.7	21%	0.214	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-25.9	-178.8	-71.5	-18.7	0	0	0	113.2	F21 T22 Y50 R66 Q70	F21-N68 WeakPolarHBondContact CD1-OD1 3.24Å; F21-N68 VanDerWaalsContact CE1-OD1 3.3Å; F21-N68 WeakPolarHBondContact CE1-OD1 3.15Å; T22-N68 HydrophobicContact CG2-CB 3.8Å; Y50-N68 PolarHBondContact OH-ND2 3.27Å; Y50-N68 VanDerWaalsContact OH-ND2 3.13Å; R66-N68 PolarHBondContact NE-OD1 2.71Å; R66-N68 PolarHBondContact NH2-OD1 3.19Å; N68-Q70 VanDerWaalsContact C-N 3.31Å
69	S	94.9	Very high	94.1	Very high	105 Å²	105	48.4 Å²	48.4	73%	0.734	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-32.3	178.5	71.5	0	0	0	0	111.5	D67	D67-S69 WeakPolarHBondContact OD1-CA 3.3Å; D67-S69 WeakPolarHBondContact OD1-CB 3.36Å; D67-S69 PolarHBondContact OD1-N 3.14Å; D67-S69 PolarHBondContact OD1-OG 2.77Å
70	Q	96.3	Very high	93.2	Very high	112 Å²	112	41.8 Å²	41.8	52%	0.523	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-6.3	-179.7	-58.7	-173.2	-12.1	0	0	113.3	D67 N68 I72	D67-Q70 HydrophobicContact CB-CB 4.4Å; D67-Q70 PolarHBondContact OD1-N 2.88Å; D67-Q70 WeakPolarHBondContact OD2-CG 3.24Å; N68-Q70 VanDerWaalsContact C-N 3.31Å; Q70-I72 HydrophobicContact CB-CB 4.4Å; Q70-I72 HydrophobicContact CB-CD1 3.8Å; Q70-I72 HydrophobicContact CB-CG1 3.76Å; Q70-I72 WeakPolarHBondContact O-CG1 3.47Å; Q70-I72 PolarHBondContact O-N 3Å
71	S	96.8	Very high	92.3	Very high	35 Å²	35	44.4 Å²	44.4	25%	0.245	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	41.4	-171.4	-57.9	0	0	0	0	112.9	T16 D67	T16-S71 PolarHBondContact N-O 2.81Å; T16-S71 PolarHBondContact OG1-O 2.77Å; D67-S71 WeakPolarHBondContact O-CA 3.38Å; D67-S71 PolarHBondContact O-N 2.99Å
72	I	98.1	Very high	90.8	Very high	27 Å²	27	47.1 Å²	47.1	14%	0.138	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.6	-178.1	-58.4	-178.5	0	0	0	110.9	C14 A15 R66 D67 Q70 Y74	C14-I72 CarbonylContact O-C 3.56Å; C14-I72 VanDerWaalsContact O-CA 3.3Å; C14-I72 WeakPolarHBondContact O-CA 3.41Å; A15-I72 HydrophobicContact CB-CG1 4.17Å; R66-I72 CarbonylContact C-O 3.59Å; R66-I72 WeakPolarHBondContact CA-O 3.35Å; D67-I72 PolarHBondContact N-O 3.23Å; D67-I72 PolarHBondContact O-N 2.8Å; Q70-I72 HydrophobicContact CB-CB 4.4Å; Q70-I72 HydrophobicContact CB-CD1 3.8Å; Q70-I72 HydrophobicContact CB-CG1 3.76Å; Q70-I72 WeakPolarHBondContact O-CG1 3.47Å; Q70-I72 PolarHBondContact O-N 3Å; I72-Y74 HydrophobicContact CB-CE2 4.14Å; I72-Y74 HydrophobicContact CG2-CD1 4.05Å; I72-Y74 HydrophobicContact CG2-CD2 4.26Å; I72-Y74 HydrophobicContact CG2-CE1 3.54Å; I72-Y74 HydrophobicContact CG2-CE2 3.77Å; I72-Y74 HydrophobicContact CG2-CG 4.38Å
73	L	98.3	Very high	89.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	136.7	167.3	-171.1	70.3	0	0	0	109.9	S13 C14 F21 M26 W28 I43 I64 R66 C90	S13-L73 CarbonylContact C-O 3.59Å; S13-L73 WeakPolarHBondContact CA-O 3.36Å; C14-L73 HydrophobicContact CB-CB 4.47Å; C14-L73 PolarHBondContact N-O 2.97Å; C14-L73 PolarHBondContact O-N 3.03Å; F21-L73 HydrophobicContact CE2-CB 4.49Å; F21-L73 HydrophobicContact CZ-CB 4.42Å; M26-L73 HydrophobicContact CB-CD1 3.62Å; M26-L73 HydrophobicContact CB-CD2 3.85Å; M26-L73 HydrophobicContact CB-CG 4.26Å; M26-L73 HydrophobicContact CG-CD1 4.47Å; W28-L73 HydrophobicContact CD2-CD2 4.25Å; W28-L73 HydrophobicContact CG-CD2 4.22Å; W28-L73 HydrophobicContact CZ2-CD2 4.25Å; W28-L73 HydrophobicContact CZ2-CG 4.28Å; W28-L73 VanDerWaalsContact NE1-CG 3.34Å; I43-L73 HydrophobicContact CG2-CD1 3.56Å; I64-L73 HydrophobicContact CG2-CD1 3.91Å; R66-L73 HydrophobicContact CB-CD1 4.16Å; L73-C90 HydrophobicContact CD2-CB 3.99Å
74	Y	97.8	Very high	87.6	Confident	37 Å²	37	51.1 Å²	51.1	15%	0.145	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	146.7	176.8	-59	-79.2	0	0	0	111.7	R11 L12 W28 I64 S65 D67 I72	R11-Y74 HydrophobicContact CG-CD1 4.47Å; R11-Y74 VanDerWaalsContact NH2-CD2 3.32Å; R11-Y74 VanDerWaalsContact NH2-CG 3.28Å; L12-Y74 VanDerWaalsContact O-CA 3.24Å; L12-Y74 WeakPolarHBondContact O-CA 3.23Å; W28-Y74 PolarHBondContact NE1-O 2.91Å; I64-Y74 WeakPolarHBondContact CA-O 3.24Å; S65-Y74 PolarHBondContact N-O 3.05Å; S65-Y74 VanDerWaalsContact N-O 3.14Å; S65-Y74 PolarHBondContact O-N 2.96Å; D67-Y74 HydrophobicContact CB-CE2 3.93Å; I72-Y74 HydrophobicContact CB-CE2 4.14Å; I72-Y74 HydrophobicContact CG2-CD1 4.05Å; I72-Y74 HydrophobicContact CG2-CD2 4.26Å; I72-Y74 HydrophobicContact CG2-CE1 3.54Å; I72-Y74 HydrophobicContact CG2-CE2 3.77Å; I72-Y74 HydrophobicContact CG2-CG 4.38Å
75	L	96.2	Very high	86.6	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	107.5	166.5	-173.9	67.8	0	0	0	108.5	R11 L12 W28 L40 F62 I64 M77 Y88	R11-L75 WeakPolarHBondContact CA-O 3.22Å; L12-L75 HydrophobicContact CB-CB 4.28Å; L12-L75 HydrophobicContact CD1-CD2 4.33Å; L12-L75 PolarHBondContact N-O 2.83Å; L12-L75 PolarHBondContact O-N 2.83Å; W28-L75 HydrophobicContact CB-CD2 4.43Å; W28-L75 HydrophobicContact CD2-CB 3.87Å; W28-L75 HydrophobicContact CD2-CD2 4.12Å; W28-L75 HydrophobicContact CD2-CG 4.46Å; W28-L75 HydrophobicContact CE3-CD2 4.36Å; W28-L75 HydrophobicContact CG-CB 4.14Å; W28-L75 HydrophobicContact CG-CD1 4.16Å; W28-L75 HydrophobicContact CG-CD2 4.15Å; W28-L75 HydrophobicContact CG-CG 4.4Å; W28-L75 HydrophobicContact CZ2-CB 3.87Å; L40-L75 HydrophobicContact CD1-CD2 4.09Å; F62-L75 HydrophobicContact CB-CD1 4.05Å; F62-L75 HydrophobicContact CD2-CD1 4.14Å; F62-L75 HydrophobicContact CD2-CD2 4.19Å; F62-L75 HydrophobicContact CD2-CG 4.42Å; F62-L75 HydrophobicContact CE2-CD2 4.47Å; F62-L75 HydrophobicContact CG-CD1 4.43Å; I64-L75 HydrophobicContact CD1-CD1 4.4Å; I64-L75 HydrophobicContact CG1-CD1 3.58Å; L75-M77 HydrophobicContact CD2-CG 3.82Å; L75-M77 HydrophobicContact CD2-SD 3.8Å; L75-M77 HydrophobicContact CG-CG 3.77Å; L75-M77 HydrophobicContact CG-SD 4.4Å; L75-Y88 HydrophobicContact CD2-CD1 3.94Å; L75-Y88 HydrophobicContact CD2-CE1 4.04Å
76	Q	94.8	Very high	86.1	Confident	51 Å²	51	54.1 Å²	54.1	24%	0.238	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	117.5	168.6	179.9	63.8	32.6	0	0	108.1	F62 T63 N78	F62-Q76 CarbonylContact C-O 3.57Å; F62-Q76 VanDerWaalsContact CA-O 3.23Å; F62-Q76 WeakPolarHBondContact CA-O 3.47Å; T63-Q76 PolarHBondContact N-O 3.48Å; T63-Q76 PolarHBondContact O-N 2.96Å; Q76-N78 WeakPolarHBondContact CG-OD1 3.32Å; Q76-N78 PolarHBondContact NE2-OD1 3.11Å
77	M	90.9	Very high	85.9	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	107.2	177.7	-60.6	-179.9	-66.2	0	0	108.5	S9 L10 L12 F62 L75 L80 Y88	S9-M77 VanDerWaalsContact CA-O 3.24Å; S9-M77 WeakPolarHBondContact CA-O 3.37Å; L10-M77 HydrophobicContact CB-CE 3.84Å; L10-M77 HydrophobicContact CD2-CE 3.55Å; L10-M77 HydrophobicContact CG-CE 3.68Å; L10-M77 PolarHBondContact N-O 3.04Å; L10-M77 PolarHBondContact O-N 3.3Å; L12-M77 HydrophobicContact CD1-CE 3.76Å; L12-M77 HydrophobicContact CD1-SD 4.32Å; L12-M77 HydrophobicContact CD2-CE 4.17Å; L12-M77 HydrophobicContact CG-CE 3.65Å; F62-M77 HydrophobicContact CD1-CB 3.79Å; F62-M77 HydrophobicContact CD1-CG 3.83Å; F62-M77 HydrophobicContact CD2-CG 4.02Å; F62-M77 HydrophobicContact CE1-CB 3.64Å; F62-M77 HydrophobicContact CE1-CG 3.75Å; F62-M77 HydrophobicContact CE1-SD 4.4Å; F62-M77 HydrophobicContact CE2-CG 3.92Å; F62-M77 HydrophobicContact CE2-SD 4Å; F62-M77 HydrophobicContact CG-CB 4.43Å; F62-M77 HydrophobicContact CG-CG 4Å; F62-M77 HydrophobicContact CZ-CB 4.13Å; F62-M77 HydrophobicContact CZ-CG 3.8Å; F62-M77 HydrophobicContact CZ-SD 3.91Å; L75-M77 HydrophobicContact CD2-CG 3.82Å; L75-M77 HydrophobicContact CD2-SD 3.8Å; L75-M77 HydrophobicContact CG-CG 3.77Å; L75-M77 HydrophobicContact CG-SD 4.4Å; M77-L80 HydrophobicContact CB-CD2 3.89Å; M77-L80 HydrophobicContact CE-CD2 4.2Å; M77-L80 HydrophobicContact SD-CD2 4.33Å; M77-Y88 HydrophobicContact SD-CD1 4.42Å; M77-Y88 HydrophobicContact SD-CE1 3.61Å
78	N	86.2	Confident	85.8	Confident	56 Å²	56	56.2 Å²	56.2	30%	0.299	32%	0.323	S	S	.	.			trans	-93.6	148	174.7	-53.2	-43	0	0	0	109.2	R61 Q76	R61-N78 VanDerWaalsContact O-CB 3.32Å; R61-N78 WeakPolarHBondContact O-CB 3.26Å; R61-N78 PolarHBondContact O-N 3.45Å; Q76-N78 WeakPolarHBondContact CG-OD1 3.32Å; Q76-N78 PolarHBondContact NE2-OD1 3.11Å
79	T	78.1	Confident	85.8	Confident	79 Å²	79	59 Å²	59	49%	0.485	33%	0.331	S	S	.	.	S	Bend	trans	55.4	62	178.6	62.7	0	0	0	0	112.8	G8 R81	G8-T79 PolarHBondContact O-N 3.34Å; T79-R81 PolarHBondContact O-N 3Å
80	L	73.9	Confident	85.8	Confident	17 Å²	17	56 Å²	56	9%	0.089	31%	0.31	C	S	.	.			trans	-57.1	125.2	175.9	-71.7	168.5	0	0	0	110.4	V4 P6 G7 G8 L10 M77	V4-L80 HydrophobicContact CB-CD1 3.74Å; V4-L80 HydrophobicContact CG1-CD1 3.48Å; V4-L80 VanDerWaalsContact CG1-CD1 3.48Å; P6-L80 WeakPolarHBondContact CA-O 3.4Å; G7-L80 PolarHBondContact N-O 3.01Å; G8-L80 WeakPolarHBondContact O-CG 3.21Å; G8-L80 PolarHBondContact O-N 3.38Å; L10-L80 HydrophobicContact CB-CD1 3.82Å; M77-L80 HydrophobicContact CB-CD2 3.89Å; M77-L80 HydrophobicContact CE-CD2 4.2Å; M77-L80 HydrophobicContact SD-CD2 4.33Å
81	R	72.8	Confident	85.8	Confident	134 Å²	134	52.6 Å²	52.6	51%	0.506	30%	0.3	S	S	.	.			trans	-86.6	155	171.6	-67.3	-176.5	-176.6	-179.4	-1.3	109.4	T79 E83 G84	T79-R81 PolarHBondContact O-N 3Å; R81-E83 HydrophobicContact CB-CB 4.33Å; R81-E83 HydrophobicContact CB-CG 4.42Å; R81-E83 PolarHBondContact O-N 3.04Å; R81-G84 WeakPolarHBondContact O-CA 3.46Å; R81-G84 PolarHBondContact O-N 2.81Å
82	A	59.8	Low	85.7	Confident	90 Å²	90	57.3 Å²	57.3	74%	0.744	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.2	175.7	0	0	0	0	0	113.2	P6 G84	P6-A82 HydrophobicContact CG-CB 4.33Å; A82-G84 PolarHBondContact O-N 3.13Å
83	E	58.9	Low	85.3	Confident	127 Å²	127	58.6 Å²	58.6	59%	0.593	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-2.6	166.9	-56.8	147.8	-145.2	0	0	113.9	R81 S85	R81-E83 HydrophobicContact CB-CB 4.33Å; R81-E83 HydrophobicContact CB-CG 4.42Å; R81-E83 PolarHBondContact O-N 3.04Å; E83-S85 VanDerWaalsContact C-N 3.27Å; E83-S85 PolarHBondContact O-N 2.82Å; E83-S85 VanDerWaalsContact O-N 3.14Å
84	G	61.8	Low	84.6	Confident	33 Å²	33	61.6 Å²	61.6	34%	0.34	35%	0.35	S	S	.	.			trans	-75.9	8.7	-165.7	0	0	0	0	0	117.1	R81 A82 A86	R81-G84 WeakPolarHBondContact O-CA 3.46Å; R81-G84 PolarHBondContact O-N 2.81Å; A82-G84 PolarHBondContact O-N 3.13Å; G84-A86 PolarHBondContact O-N 3.4Å
85	S	75.6	Confident	83.9	Confident	93 Å²	93	62.8 Å²	62.8	65%	0.65	36%	0.36	S	S	*	.			trans	-88.5	98.2	172.9	-167.3	0	0	0	0	110	P33 E83	P33-S85 WeakPolarHBondContact CD-O 3.3Å; E83-S85 VanDerWaalsContact C-N 3.27Å; E83-S85 PolarHBondContact O-N 2.82Å; E83-S85 VanDerWaalsContact O-N 3.14Å
86	A	88.8	Confident	83.2	Confident	21 Å²	21	66.3 Å²	66.3	17%	0.174	38%	0.38	C	S	.	.			trans	-149.1	155.6	174.3	0	0	0	0	0	109.5	R30 Q31 P32 G84 Y88	R30-A86 HydrophobicContact CB-CB 4.12Å; Q31-A86 WeakPolarHBondContact O-CA 3.3Å; Q31-A86 WeakPolarHBondContact O-CB 3.05Å; P32-A86 HydrophobicContact CG-CB 4.48Å; G84-A86 PolarHBondContact O-N 3.4Å; A86-Y88 HydrophobicContact CB-CE2 4.06Å; A86-Y88 WeakPolarHBondContact O-CD2 3.44Å; A86-Y88 WeakPolarHBondContact O-CE2 3.44Å
87	T	92.1	Very high	82.6	Confident	77 Å²	77	67.2 Å²	67.2	47%	0.472	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132.6	166.5	-55.8	0	0	0	0	108.6	R30 Q31 Y89	R30-T87 CarbonylContact C-O 3.47Å; R30-T87 VanDerWaalsContact CA-O 3.24Å; R30-T87 WeakPolarHBondContact CA-O 3.22Å; Q31-T87 PolarHBondContact N-O 3.2Å; Q31-T87 PolarHBondContact O-N 2.85Å; T87-Y89 HydrophobicContact CG2-CD1 4.46Å; T87-Y89 HydrophobicContact CG2-CE1 3.71Å; T87-Y89 HydrophobicContact CG2-CE2 3.79Å; T87-Y89 WeakPolarHBondContact CG2-OH 3.38Å
88	Y	93.5	Very high	82	Confident	43 Å²	43	71.3 Å²	71.3	17%	0.169	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136	-178.9	-69.6	-103.1	0	0	0	110.1	L12 V29 R30 L40 L75 M77 A86	L12-Y88 HydrophobicContact CD1-CD1 3.75Å; L12-Y88 HydrophobicContact CD1-CD2 3.91Å; L12-Y88 HydrophobicContact CD1-CE1 4.38Å; L12-Y88 HydrophobicContact CD1-CG 3.48Å; L12-Y88 VanDerWaalsContact CD1-CG 3.48Å; V29-Y88 WeakPolarHBondContact O-CA 3.3Å; R30-Y88 HydrophobicContact CB-CD1 3.97Å; R30-Y88 HydrophobicContact CB-CE1 4.02Å; R30-Y88 HydrophobicContact CB-CG 4.37Å; L40-Y88 HydrophobicContact CD1-CD1 3.87Å; L40-Y88 HydrophobicContact CD1-CE1 3.69Å; L75-Y88 HydrophobicContact CD2-CD1 3.94Å; L75-Y88 HydrophobicContact CD2-CE1 4.04Å; M77-Y88 HydrophobicContact SD-CD1 4.42Å; M77-Y88 HydrophobicContact SD-CE1 3.61Å; A86-Y88 HydrophobicContact CB-CE2 4.06Å; A86-Y88 WeakPolarHBondContact O-CD2 3.44Å; A86-Y88 WeakPolarHBondContact O-CE2 3.44Å
89	Y	95.6	Very high	81.8	Confident	98 Å²	98	72.3 Å²	72.3	38%	0.384	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	140.8	-178.4	-52.8	-84	0	0	0	109.7	W28 V29 Q31 L37 T87	W28-Y89 WeakPolarHBondContact CA-O 3.42Å; V29-Y89 PolarHBondContact N-O 3.14Å; V29-Y89 PolarHBondContact O-N 3.26Å; Q31-Y89 HydrophobicContact CB-CE2 3.84Å; Q31-Y89 PolarHBondContact OE1-OH 3.01Å; L37-Y89 HydrophobicContact CD2-CD2 3.99Å; L37-Y89 HydrophobicContact CD2-CE2 3.97Å; T87-Y89 HydrophobicContact CG2-CD1 4.46Å; T87-Y89 HydrophobicContact CG2-CE1 3.71Å; T87-Y89 HydrophobicContact CG2-CE2 3.79Å; T87-Y89 WeakPolarHBondContact CG2-OH 3.38Å
90	C	96	Very high	82	Confident	43 Å²	43	71.8 Å²	71.8	29%	0.291	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	142	164.3	48.4	0	0	0	0	108.9	C14 S27 L73	C14-C90 HydrophobicContact CB-CB 3.49Å; C14-C90 VanDerWaalsContact CB-CB 3.49Å; C14-C90 WeakPolarHBondContact CB-SG 3.41Å; C14-C90 WeakPolarHBondContact SG-CB 3.45Å; C14-C90 CovalentContact SG-SG 2Å; C14-C90 PolarHBondContact SG-SG 3.24Å; S27-C90 CarbonylContact O-C 3.46Å; S27-C90 VanDerWaalsContact O-CA 3.3Å; S27-C90 WeakPolarHBondContact O-CA 3.43Å; L73-C90 HydrophobicContact CD2-CB 3.99Å
91	A	96.2	Very high	82.6	Confident	40 Å²	40	76 Å²	76	33%	0.331	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	139.4	176.7	0	0	0	0	0	110	S27	S27-A91 PolarHBondContact N-O 3.23Å; S27-A91 PolarHBondContact O-N 3.02Å
92	R	94.9	Very high	83.5	Confident	135 Å²	135	71.2 Å²	71.2	51%	0.509	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	144.1	166	70.9	177.2	-178.7	172.3	0.1	109.5	F19 M26	F19-R92 VanDerWaalsContact CB-NH1 3.29Å; F19-R92 HydrophobicContact CE2-CB 4.04Å; F19-R92 HydrophobicContact CZ-CB 4.04Å; M26-R92 HydrophobicContact CE-CB 4.17Å; M26-R92 HydrophobicContact SD-CB 3.83Å
93	G	88.4	Confident	85.6	Confident	54 Å²	54	69.5 Å²	69.5	56%	0.557	41%	0.406	S	S	*	.			trans	-95.2	0	171.9	0	0	0	0	0	114.5	Y24 Y25	Y24-G93 WeakPolarHBondContact CD1-O 3.48Å; Y25-G93 VanDerWaalsContact CE1-CA 3.48Å; Y25-G93 WeakPolarHBondContact CE1-OXT 3.42Å; Y25-G93 VanDerWaalsContact CE2-CA 3.41Å; Y25-G93 PolarHBondContact O-N 2.64Å; Y25-G93 PolarHBondContact OH-OXT 2.83Å

Retrieved 93 of 93 residues in 21.2 ms (Link to these results)

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