A0A077ZAY5_TRITR Loading...

Protein ttr

AlphaFold DB , UniProt , Accession A0A077ZAY5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 148 aa.

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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	66	Low	86	Confident	171 Å²	171	110.1 Å²	110.1	84%	0.842	57%	0.569	S	S	*	*				0	131.8	0	-76.2	159.8	75.8	0	0	108.5	Q5 V6 V9	M1-Q5 VanDerWaalsContact CA-OE1 3.25Å; M1-Q5 HydrophobicContact CB-CB 4.47Å; M1-V6 HydrophobicContact CB-CG2 4.03Å; M1-V6 HydrophobicContact CE-CG2 4.2Å; M1-V9 HydrophobicContact CE-CG2 4.35Å
2	T	90.1	Very high	85.3	Confident	83 Å²	83	110.3 Å²	110.3	51%	0.509	57%	0.571	S	S	.	*			trans	-76.9	155.5	174.7	60.8	0	0	0	0	110.2	K4 Q5 V6	T2-K4 PolarHBondContact O-N 3.48Å; T2-K4 VanDerWaalsContact O-N 3.11Å; T2-Q5 WeakPolarHBondContact O-CA 3.46Å; T2-Q5 WeakPolarHBondContact O-CB 3.3Å; T2-Q5 PolarHBondContact O-N 3Å; T2-Q5 WeakPolarHBondContact OG1-CG 3.2Å; T2-Q5 PolarHBondContact OG1-N 3.31Å; T2-V6 PolarHBondContact O-N 2.83Å
3	F	86.9	Confident	84.4	Confident	165 Å²	165	110 Å²	110	72%	0.724	57%	0.57	S	S	*	*	H	α-helix	trans	-51.1	-36.9	176.5	-174.9	-97.4	0	0	0	112.1	V6 L7	F3-V6 PolarHBondContact O-N 3.35Å; F3-L7 HydrophobicContact CD1-CD1 4.49Å; F3-L7 HydrophobicContact CE1-CD1 3.78Å; F3-L7 HydrophobicContact CZ-CD1 3.93Å; F3-L7 WeakPolarHBondContact O-CB 3.32Å; F3-L7 PolarHBondContact O-N 3.2Å
4	K	89.2	Confident	83.3	Confident	177 Å²	177	110.7 Å²	110.7	77%	0.77	57%	0.574	S	S	*	*	H	α-helix	trans	-62.5	-42.9	173.9	-67.8	-174.4	177	-177	0	113.1	T2 L7 L8	T2-K4 PolarHBondContact O-N 3.48Å; T2-K4 VanDerWaalsContact O-N 3.11Å; K4-L7 PolarHBondContact O-N 3.46Å; K4-L8 WeakPolarHBondContact O-CB 3.36Å; K4-L8 PolarHBondContact O-N 2.92Å
5	Q	88.8	Confident	82.2	Confident	101 Å²	101	112.6 Å²	112.6	47%	0.472	58%	0.579	S	S	.	*	H	α-helix	trans	-66	-40.2	175.3	-72.8	174.8	-34.7	0	0	111.5	M1 T2 L7 L8 V9	M1-Q5 VanDerWaalsContact CA-OE1 3.25Å; M1-Q5 HydrophobicContact CB-CB 4.47Å; T2-Q5 WeakPolarHBondContact O-CA 3.46Å; T2-Q5 WeakPolarHBondContact O-CB 3.3Å; T2-Q5 PolarHBondContact O-N 3Å; T2-Q5 WeakPolarHBondContact OG1-CG 3.2Å; T2-Q5 PolarHBondContact OG1-N 3.31Å; Q5-L7 VanDerWaalsContact C-N 3.34Å; Q5-L8 PolarHBondContact O-N 3.18Å; Q5-V9 WeakPolarHBondContact O-CB 3.39Å; Q5-V9 VanDerWaalsContact O-CG2 3.28Å; Q5-V9 WeakPolarHBondContact O-CG2 3.37Å; Q5-V9 PolarHBondContact O-N 2.95Å
6	V	89.9	Confident	80.9	Confident	72 Å²	72	113.4 Å²	113.4	44%	0.436	58%	0.584	S	S	.	*	H	α-helix	trans	-61.6	-44.1	174.8	178.3	0	0	0	0	110.4	M1 T2 F3 V9 A10	M1-V6 HydrophobicContact CB-CG2 4.03Å; M1-V6 HydrophobicContact CE-CG2 4.2Å; T2-V6 PolarHBondContact O-N 2.83Å; F3-V6 PolarHBondContact O-N 3.35Å; V6-V9 PolarHBondContact O-N 3.31Å; V6-A10 VanDerWaalsContact O-CB 3.3Å; V6-A10 WeakPolarHBondContact O-CB 3.31Å; V6-A10 PolarHBondContact O-N 3.47Å
7	L	89	Confident	79.9	Confident	106 Å²	106	112.6 Å²	112.6	56%	0.555	59%	0.585	S	S	*	*	H	α-helix	trans	-64.6	-40.2	177.3	-140.7	94.8	0	0	0	112.2	F3 K4 Q5 A10 L11	F3-L7 HydrophobicContact CD1-CD1 4.49Å; F3-L7 HydrophobicContact CE1-CD1 3.78Å; F3-L7 HydrophobicContact CZ-CD1 3.93Å; F3-L7 WeakPolarHBondContact O-CB 3.32Å; F3-L7 PolarHBondContact O-N 3.2Å; K4-L7 PolarHBondContact O-N 3.46Å; Q5-L7 VanDerWaalsContact C-N 3.34Å; L7-A10 PolarHBondContact O-N 3.41Å; L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 PolarHBondContact O-N 3.08Å
8	L	88.8	Confident	78.9	Confident	113 Å²	113	115.4 Å²	115.4	59%	0.592	59%	0.592	S	S	*	*	H	α-helix	trans	-64.3	-44.9	177.5	-160.3	82.4	0	0	0	111.2	K4 Q5 L11 L12	K4-L8 WeakPolarHBondContact O-CB 3.36Å; K4-L8 PolarHBondContact O-N 2.92Å; Q5-L8 PolarHBondContact O-N 3.18Å; L8-L11 PolarHBondContact O-N 3.46Å; L8-L12 WeakPolarHBondContact O-CG 3.32Å; L8-L12 PolarHBondContact O-N 2.9Å
9	V	88.6	Confident	78.5	Confident	66 Å²	66	110.3 Å²	110.3	40%	0.4	57%	0.57	S	S	.	*	H	α-helix	trans	-64.1	-43.6	175.4	172	0	0	0	0	110.4	M1 Q5 V6 L11 L12 L13	M1-V9 HydrophobicContact CE-CG2 4.35Å; Q5-V9 WeakPolarHBondContact O-CB 3.39Å; Q5-V9 VanDerWaalsContact O-CG2 3.28Å; Q5-V9 WeakPolarHBondContact O-CG2 3.37Å; Q5-V9 PolarHBondContact O-N 2.95Å; V6-V9 PolarHBondContact O-N 3.31Å; V9-L11 VanDerWaalsContact C-N 3.34Å; V9-L11 PolarHBondContact O-N 3.41Å; V9-L12 PolarHBondContact O-N 3.14Å; V9-L13 HydrophobicContact CG1-CD1 4.03Å; V9-L13 HydrophobicContact CG1-CG 4.42Å; V9-L13 VanDerWaalsContact O-CG 3.29Å; V9-L13 WeakPolarHBondContact O-CG 3.39Å; V9-L13 PolarHBondContact O-N 3.38Å
10	A	85.3	Confident	78.7	Confident	45 Å²	45	106.4 Å²	106.4	37%	0.372	56%	0.559	S	S	.	*	H	α-helix	trans	-61.8	-39.8	175.9	0	0	0	0	0	112.5	V6 L7 L13 L14	V6-A10 VanDerWaalsContact O-CB 3.3Å; V6-A10 WeakPolarHBondContact O-CB 3.31Å; V6-A10 PolarHBondContact O-N 3.47Å; L7-A10 PolarHBondContact O-N 3.41Å; A10-L13 PolarHBondContact O-N 3.29Å; A10-L14 PolarHBondContact O-N 3.37Å
11	L	83.1	Confident	79.2	Confident	112 Å²	112	105.4 Å²	105.4	59%	0.586	55%	0.551	S	S	*	*	H	α-helix	trans	-67.4	-38.4	176.8	-165.7	75.1	0	0	0	112	L7 L8 V9 L14 Q15	L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 PolarHBondContact O-N 3.08Å; L8-L11 PolarHBondContact O-N 3.46Å; V9-L11 VanDerWaalsContact C-N 3.34Å; V9-L11 PolarHBondContact O-N 3.41Å; L11-L14 WeakPolarHBondContact O-CB 3.39Å; L11-L14 PolarHBondContact O-N 3.48Å; L11-Q15 PolarHBondContact O-N 2.79Å
12	L	78.3	Confident	80.6	Confident	113 Å²	113	105.2 Å²	105.2	59%	0.592	54%	0.541	S	S	*	.	H	α-helix	trans	-65.1	-41.8	173.2	-75	164.5	0	0	0	111.5	L8 V9 L14 Q15	L8-L12 WeakPolarHBondContact O-CG 3.32Å; L8-L12 PolarHBondContact O-N 2.9Å; V9-L12 PolarHBondContact O-N 3.14Å; L12-L14 VanDerWaalsContact C-N 3.28Å; L12-L14 PolarHBondContact O-N 2.95Å; L12-Q15 PolarHBondContact O-N 3.06Å; L12-Q15 VanDerWaalsContact O-N 3.15Å
13	L	73.5	Confident	80.8	Confident	106 Å²	106	101.9 Å²	101.9	56%	0.555	52%	0.52	S	S	*	.	H	α-helix	trans	-63.7	-34	174.3	-70.3	170.2	0	0	0	111.9	V9 A10 Q15 L16	V9-L13 HydrophobicContact CG1-CD1 4.03Å; V9-L13 HydrophobicContact CG1-CG 4.42Å; V9-L13 VanDerWaalsContact O-CG 3.29Å; V9-L13 WeakPolarHBondContact O-CG 3.39Å; V9-L13 PolarHBondContact O-N 3.38Å; A10-L13 PolarHBondContact O-N 3.29Å; L13-Q15 PolarHBondContact O-N 3.37Å; L13-L16 HydrophobicContact CD2-CD1 4Å; L13-L16 WeakPolarHBondContact O-CB 3.31Å; L13-L16 PolarHBondContact O-N 3.37Å; L13-L16 VanDerWaalsContact O-N 3.09Å
14	L	68.9	Low	81.4	Confident	120 Å²	120	95.4 Å²	95.4	63%	0.628	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-14	175.1	-122.5	80.6	0	0	0	114	A10 L11 L12 L16 V17	A10-L14 PolarHBondContact O-N 3.37Å; L11-L14 WeakPolarHBondContact O-CB 3.39Å; L11-L14 PolarHBondContact O-N 3.48Å; L12-L14 VanDerWaalsContact C-N 3.28Å; L12-L14 PolarHBondContact O-N 2.95Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-V17 HydrophobicContact CG-CG2 4.45Å; L14-V17 WeakPolarHBondContact O-CG2 3.41Å
15	Q	65.9	Low	81.8	Confident	139 Å²	139	87.1 Å²	87.1	65%	0.65	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-18	172.6	-64.4	-75	-61.6	0	0	111.9	L11 L12 L13 V17	L11-Q15 PolarHBondContact O-N 2.79Å; L12-Q15 PolarHBondContact O-N 3.06Å; L12-Q15 VanDerWaalsContact O-N 3.15Å; L13-Q15 PolarHBondContact O-N 3.37Å; Q15-V17 VanDerWaalsContact C-N 3.33Å
16	L	62.2	Low	82.3	Confident	126 Å²	126	82.7 Å²	82.7	66%	0.66	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-80.1	-10	-179	-63.4	168.2	0	0	0	113.4	L13 L14 K18 G19	L13-L16 HydrophobicContact CD2-CD1 4Å; L13-L16 WeakPolarHBondContact O-CB 3.31Å; L13-L16 PolarHBondContact O-N 3.37Å; L13-L16 VanDerWaalsContact O-N 3.09Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L16-K18 PolarHBondContact O-N 2.73Å; L16-G19 PolarHBondContact O-N 3.18Å
17	V	63.3	Low	82.7	Confident	99 Å²	99	79.3 Å²	79.3	60%	0.6	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-74.6	10.3	-177.7	-120.7	0	0	0	0	114.4	L14 Q15 G19	L14-V17 HydrophobicContact CG-CG2 4.45Å; L14-V17 WeakPolarHBondContact O-CG2 3.41Å; Q15-V17 VanDerWaalsContact C-N 3.33Å; V17-G19 VanDerWaalsContact C-N 3.27Å
18	K	62.6	Low	83.2	Confident	163 Å²	163	75.1 Å²	75.1	71%	0.709	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-73.8	-20.3	170.8	-67.9	-172.6	179.4	-178.6	0	112.8	L16 Q21	L16-K18 PolarHBondContact O-N 2.73Å; K18-Q21 WeakPolarHBondContact O-CG 3Å
19	G	70.7	Confident	83.6	Confident	18 Å²	18	70 Å²	70	19%	0.186	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	155.2	172.2	0	0	0	0	0	113.3	L16 V17 Q21 L77	L16-G19 PolarHBondContact O-N 3.18Å; V17-G19 VanDerWaalsContact C-N 3.27Å; G19-Q21 VanDerWaalsContact C-N 3.31Å; G19-Q21 PolarHBondContact O-N 2.9Å; G19-L77 VanDerWaalsContact CA-O 3.25Å; G19-L77 WeakPolarHBondContact CA-O 3.29Å
20	G	82.4	Confident	84.1	Confident	33 Å²	33	70.1 Å²	70.1	34%	0.34	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	17	176.5	0	0	0	0	0	114.5	D76	G20-D76 WeakPolarHBondContact CA-O 3.34Å; G20-D76 PolarHBondContact N-O 2.98Å
21	Q	89.7	Confident	84.8	Confident	86 Å²	86	68 Å²	68	40%	0.402	36%	0.355	S	S	.	.			trans	-82.2	129.6	174.4	-64.4	-63.1	-67.8	0	0	109.7	K18 G19 Q23 S75 K109	K18-Q21 WeakPolarHBondContact O-CG 3Å; G19-Q21 VanDerWaalsContact C-N 3.31Å; G19-Q21 PolarHBondContact O-N 2.9Å; Q21-Q23 PolarHBondContact O-N 2.77Å; Q21-S75 WeakPolarHBondContact O-CB 3.05Å; Q21-K109 VanDerWaalsContact OE1-NZ 3.08Å
22	W	94.7	Very high	85.5	Confident	167 Å²	167	65.2 Å²	65.2	63%	0.633	34%	0.337	S	S	*	.			trans	-62.9	131.7	172.5	-70.2	93.5	0	0	0	111.4	C73 A74	W22-C73 HydrophobicContact CE3-CB 3.86Å; W22-C73 HydrophobicContact CZ3-CB 4.35Å; W22-A74 WeakPolarHBondContact CA-O 3.5Å
23	Q	96.2	Very high	86.5	Confident	12 Å²	12	61 Å²	61	6%	0.056	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.7	174.5	-63.6	173.2	-30	0	0	108	Q21 C73 A74 S80 I81 Y104 K109	Q21-Q23 PolarHBondContact O-N 2.77Å; Q23-C73 CarbonylContact O-C 3.53Å; Q23-C73 WeakPolarHBondContact O-CA 3.32Å; Q23-C73 WeakPolarHBondContact O-CB 3.31Å; Q23-A74 PolarHBondContact N-O 2.65Å; Q23-A74 PolarHBondContact O-N 2.72Å; Q23-S80 VanDerWaalsContact OE1-CA 3.24Å; Q23-I81 HydrophobicContact CB-CD1 3.94Å; Q23-I81 HydrophobicContact CB-CG1 3.95Å; Q23-I81 HydrophobicContact CB-CG2 4.01Å; Q23-Y104 PolarHBondContact NE2-OH 3.45Å; Q23-K109 CarbonylContact C-O 3.58Å; Q23-K109 WeakPolarHBondContact CA-O 3.3Å
24	C	97.9	Very high	87.6	Confident	29 Å²	29	61.5 Å²	61.5	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	143.5	-173.2	-55.7	0	0	0	0	110.8	G72 C73 K109 N110 F111	C24-G72 VanDerWaalsContact CA-O 3.29Å; C24-G72 WeakPolarHBondContact CA-O 3.34Å; C24-C73 HydrophobicContact CB-CB 4Å; C24-C73 WeakPolarHBondContact CB-SG 3.41Å; C24-C73 WeakPolarHBondContact SG-CB 3.42Å; C24-C73 CovalentContact SG-SG 2.04Å; C24-C73 PolarHBondContact SG-SG 2.83Å; C24-K109 PolarHBondContact N-O 3.45Å; C24-N110 WeakPolarHBondContact CB-OD1 3.43Å; C24-N110 WeakPolarHBondContact O-CA 3.39Å; C24-F111 WeakPolarHBondContact O-CD1 3.42Å; C24-F111 PolarHBondContact O-N 3.32Å; C24-F111 VanDerWaalsContact O-N 3.14Å
25	I	98.6	Very high	89	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.4	177.7	-173.7	-176.8	0	0	0	110.5	L46 M57 N71 G72 P83 I102 F111 F113	I25-L46 HydrophobicContact CG2-CD1 4.17Å; I25-L46 HydrophobicContact CG2-CD2 3.9Å; I25-M57 HydrophobicContact CG2-CE 3.63Å; I25-N71 CarbonylContact O-C 3.47Å; I25-N71 WeakPolarHBondContact O-CA 3.46Å; I25-G72 PolarHBondContact N-O 2.75Å; I25-G72 PolarHBondContact O-N 3.13Å; I25-P83 HydrophobicContact CD1-CB 4.48Å; I25-P83 HydrophobicContact CD1-CG 4.29Å; I25-P83 HydrophobicContact CG2-CB 4.43Å; I25-I102 HydrophobicContact CD1-CB 4.49Å; I25-I102 HydrophobicContact CD1-CD1 3.55Å; I25-I102 HydrophobicContact CD1-CG2 3.8Å; I25-F111 VanDerWaalsContact CA-O 3.29Å; I25-F111 WeakPolarHBondContact CA-O 3.47Å; I25-F111 HydrophobicContact CB-CD1 4.38Å; I25-F111 HydrophobicContact CB-CE1 3.89Å; I25-F111 HydrophobicContact CB-CE2 4.26Å; I25-F111 HydrophobicContact CB-CZ 3.84Å; I25-F111 HydrophobicContact CD1-CD2 4.18Å; I25-F111 HydrophobicContact CD1-CE1 4.41Å; I25-F111 HydrophobicContact CD1-CE2 3.36Å; I25-F111 HydrophobicContact CD1-CZ 3.5Å; I25-F111 HydrophobicContact CG1-CD2 4.03Å; I25-F111 HydrophobicContact CG1-CE1 4.19Å; I25-F111 HydrophobicContact CG1-CE2 3.64Å; I25-F111 HydrophobicContact CG1-CG 4.48Å; I25-F111 HydrophobicContact CG1-CZ 3.73Å; I25-F113 HydrophobicContact CD1-CB 4.06Å
26	A	98.7	Very high	90.6	Very high	8 Å²	8	58.9 Å²	58.9	7%	0.066	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.4	158	0	0	0	0	0	110.3	Y69 L70 N71 F111 N112 F113	A26-Y69 HydrophobicContact CB-CE2 4.02Å; A26-Y69 VanDerWaalsContact CB-OH 3.32Å; A26-Y69 WeakPolarHBondContact CB-OH 3.35Å; A26-L70 CarbonylContact C-O 3.51Å; A26-L70 WeakPolarHBondContact CA-O 3.48Å; A26-N71 HydrophobicContact CB-CB 3.9Å; A26-F111 PolarHBondContact N-O 2.02Å; A26-F111 VanDerWaalsContact N-O 3.1Å; A26-N112 WeakPolarHBondContact CB-OD1 3.18Å; A26-N112 CarbonylContact O-C 3.56Å; A26-N112 VanDerWaalsContact O-CA 3.3Å; A26-N112 WeakPolarHBondContact O-CA 3Å; A26-F113 PolarHBondContact O-N 2.62Å
27	V	98.7	Very high	92.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137	-178.6	65.5	0	0	0	0	111.4	L46 F68 Y69 L70 V85 I102 F113 F115	V27-L46 HydrophobicContact CG1-CD1 4Å; V27-L46 HydrophobicContact CG1-CD2 4.19Å; V27-L46 HydrophobicContact CG1-CG 4.46Å; V27-F68 HydrophobicContact CG1-CE2 4.31Å; V27-F68 HydrophobicContact CG2-CE2 4.2Å; V27-Y69 CarbonylContact O-C 3.6Å; V27-Y69 VanDerWaalsContact O-CA 3.31Å; V27-Y69 WeakPolarHBondContact O-CA 3.42Å; V27-L70 HydrophobicContact CG1-CB 3.92Å; V27-L70 PolarHBondContact N-O 3.24Å; V27-L70 PolarHBondContact O-N 2.88Å; V27-V85 HydrophobicContact CB-CG2 4.44Å; V27-V85 HydrophobicContact CG1-CG2 3.82Å; V27-V85 HydrophobicContact CG2-CG2 3.92Å; V27-I102 HydrophobicContact CB-CD1 4.02Å; V27-I102 HydrophobicContact CG2-CD1 3.73Å; V27-F113 CarbonylContact C-O 3.51Å; V27-F113 VanDerWaalsContact CA-O 3.24Å; V27-F113 WeakPolarHBondContact CA-O 3.11Å; V27-F113 HydrophobicContact CG2-CD1 4.16Å; V27-F115 HydrophobicContact CG2-CD2 4.15Å; V27-F115 HydrophobicContact CG2-CE2 3.75Å
28	A	98.9	Very high	94	Very high	19 Å²	19	52.8 Å²	52.8	16%	0.157	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157.1	173.9	0	0	0	0	0	112	F68 Y69 F113 T114 F115	A28-F68 VanDerWaalsContact CA-O 3.32Å; A28-F68 WeakPolarHBondContact CA-O 3.34Å; A28-Y69 HydrophobicContact CB-CD2 4.02Å; A28-F113 PolarHBondContact N-O 2.79Å; A28-T114 HydrophobicContact CB-CG2 4.37Å; A28-T114 WeakPolarHBondContact O-CA 3.38Å; A28-F115 PolarHBondContact O-N 2.9Å
29	G	98.8	Very high	95.5	Very high	5 Å²	5	54.6 Å²	54.6	5%	0.052	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	162.8	173.9	0	0	0	0	0	113.9	S67 F68	G29-S67 CarbonylContact O-C 3.56Å; G29-S67 VanDerWaalsContact O-CA 3.31Å; G29-S67 WeakPolarHBondContact O-CA 3.45Å; G29-F68 PolarHBondContact N-O 2.84Å; G29-F68 WeakPolarHBondContact O-CD1 3.3Å; G29-F68 PolarHBondContact O-N 3.42Å
30	D	98.8	Very high	96.7	Very high	69 Å²	69	58.3 Å²	58.3	37%	0.369	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135.1	174.4	-85.2	-75.6	0	0	0	110.7	R32 G66 V118 I119	D30-R32 IonicContact OD1-CZ 2.98Å; D30-R32 IonicContact OD1-NH1 2.72Å; D30-R32 PolarHBondContact OD1-NH1 3Å; D30-R32 IonicContact OD1-NH2 3.31Å; D30-R32 PolarHBondContact OD1-NH2 3.28Å; D30-G66 CarbonylContact C-O 3.53Å; D30-G66 WeakPolarHBondContact CA-O 3.49Å; D30-V118 HydrophobicContact CB-CG2 4.18Å; D30-I119 PolarHBondContact O-N 2.84Å
31	V	98.9	Very high	97.3	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.2	-174.9	-177	0	0	0	0	110.2	P38 V62 G66 F68 L87 I119 L121	V31-P38 HydrophobicContact CG1-CG 4.06Å; V31-P38 WeakPolarHBondContact O-CD 3.12Å; V31-V62 HydrophobicContact CB-CG1 4.04Å; V31-V62 HydrophobicContact CB-CG2 4.02Å; V31-V62 HydrophobicContact CG1-CG2 4.29Å; V31-V62 HydrophobicContact CG2-CG1 4.5Å; V31-V62 HydrophobicContact CG2-CG2 3.82Å; V31-G66 PolarHBondContact N-O 3.03Å; V31-F68 HydrophobicContact CG2-CD1 3.66Å; V31-F68 HydrophobicContact CG2-CE1 3.76Å; V31-L87 HydrophobicContact CG1-CD2 4.14Å; V31-L87 HydrophobicContact CG2-CD2 3.57Å; V31-I119 CarbonylContact C-O 3.57Å; V31-I119 VanDerWaalsContact CA-O 3.31Å; V31-I119 WeakPolarHBondContact CA-O 3.36Å; V31-I119 HydrophobicContact CG2-CB 4.4Å; V31-I119 HydrophobicContact CG2-CD1 4.4Å; V31-L121 HydrophobicContact CG1-CD1 3.42Å; V31-L121 VanDerWaalsContact CG1-CD1 3.42Å; V31-L121 HydrophobicContact CG1-CD2 4.35Å; V31-L121 HydrophobicContact CG1-CG 3.68Å
32	R	98.8	Very high	97.7	Very high	53 Å²	53	56.2 Å²	56.2	20%	0.2	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	169.8	176	-61.2	-64.2	176.8	-84.6	-3.1	111	D30 K36 G66 V118 I119 L121	D30-R32 IonicContact OD1-CZ 2.98Å; D30-R32 IonicContact OD1-NH1 2.72Å; D30-R32 PolarHBondContact OD1-NH1 3Å; D30-R32 IonicContact OD1-NH2 3.31Å; D30-R32 PolarHBondContact OD1-NH2 3.28Å; R32-K36 CarbonylContact C-O 3.46Å; R32-K36 WeakPolarHBondContact CA-O 3.3Å; R32-K36 WeakPolarHBondContact CB-O 3.35Å; R32-K36 VanDerWaalsContact CD-C 3.46Å; R32-K36 WeakPolarHBondContact CD-O 3.19Å; R32-G66 PolarHBondContact NH1-O 3.44Å; R32-V118 HydrophobicContact CB-CG1 3.98Å; R32-V118 HydrophobicContact CG-CG1 3.29Å; R32-I119 PolarHBondContact N-O 3.08Å; R32-L121 WeakPolarHBondContact O-CB 3.25Å; R32-L121 WeakPolarHBondContact O-CG 3.47Å; R32-L121 PolarHBondContact O-N 3.36Å
33	C	98.5	Very high	97.9	Very high	26 Å²	26	48.3 Å²	48.3	18%	0.176	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-139.8	105.5	171.3	176.2	0	0	0	0	107.6	K36 C91 D120	C33-K36 PolarHBondContact N-O 3.45Å; C33-K36 PolarHBondContact O-N 2.91Å; C33-C91 WeakPolarHBondContact CA-SG 3.49Å; C33-C91 HydrophobicContact CB-CB 3.92Å; C33-C91 WeakPolarHBondContact CB-SG 3.33Å; C33-C91 VanDerWaalsContact SG-CA 3.51Å; C33-C91 WeakPolarHBondContact SG-CB 3.31Å; C33-C91 CovalentContact SG-SG 2.02Å; C33-C91 PolarHBondContact SG-SG 2.87Å; C33-D120 WeakPolarHBondContact CA-OD1 3.45Å
34	N	97.8	Very high	98	Very high	116 Å²	116	47.8 Å²	47.8	62%	0.62	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	51	-170.5	-62.2	-75.1	0	0	0	112	K36 D120 A122	N34-K36 PolarHBondContact O-N 3.1Å; N34-D120 WeakPolarHBondContact CA-OD2 3.47Å; N34-D120 PolarHBondContact N-OD1 3.09Å; N34-D120 PolarHBondContact N-OD2 2.87Å; N34-A122 HydrophobicContact CB-CB 4.3Å; N34-A122 VanDerWaalsContact CG-CB 3.48Å; N34-A122 VanDerWaalsContact OD1-CB 3.27Å; N34-A122 WeakPolarHBondContact OD1-CB 3.27Å
35	G	98.1	Very high	98	Very high	56 Å²	56	48.9 Å²	48.9	58%	0.577	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	1.1	179.2	0	0	0	0	0	115.4	D120	G35-D120 PolarHBondContact N-OD2 2.8Å
36	K	98.5	Very high	98.1	Very high	147 Å²	147	48.7 Å²	48.7	64%	0.639	26%	0.263	S	S	*	.	B	Isolated β-bridge	trans	-112.8	156.9	-177.6	-66	175.7	-175.4	175.9	0	111.1	R32 C33 N34	R32-K36 CarbonylContact C-O 3.46Å; R32-K36 WeakPolarHBondContact CA-O 3.3Å; R32-K36 WeakPolarHBondContact CB-O 3.35Å; R32-K36 VanDerWaalsContact CD-C 3.46Å; R32-K36 WeakPolarHBondContact CD-O 3.19Å; C33-K36 PolarHBondContact N-O 3.45Å; C33-K36 PolarHBondContact O-N 2.91Å; N34-K36 PolarHBondContact O-N 3.1Å
37	V	98.2	Very high	98.1	Very high	70 Å²	70	48.8 Å²	48.8	42%	0.424	26%	0.262	S	S	.	.			trans	-57.1	137	171.3	-64.7	0	0	0	0	110	K39	V37-K39 PolarHBondContact O-N 3.41Å
38	P	97.9	Very high	98	Very high	27 Å²	27	48.8 Å²	48.8	18%	0.175	26%	0.262	C	S	.	.			trans	-58.5	131.3	-178.3	-25.9	35.2	0	0	0	112.3	V31 V42	V31-P38 HydrophobicContact CG1-CG 4.06Å; V31-P38 WeakPolarHBondContact O-CD 3.12Å; P38-V42 HydrophobicContact CB-CG2 3.83Å; P38-V42 HydrophobicContact CG-CG2 4.1Å
39	K	95.8	Very high	97.9	Very high	201 Å²	201	50.2 Å²	50.2	87%	0.874	27%	0.267	S	S	*	.	S	Bend	trans	-81.4	-25.7	177.6	-67.8	-177.3	178.3	-179.6	0	113.5	V37	V37-K39 PolarHBondContact O-N 3.41Å
40	L	94.7	Very high	97.6	Very high	97 Å²	97	52 Å²	52	51%	0.508	28%	0.275	S	S	.	.	S	Bend	trans	-106	150.3	178	-64.1	176.7	0	0	0	109	V42 K90	L40-V42 PolarHBondContact O-N 3.29Å; L40-K90 HydrophobicContact CD1-CB 3.84Å
41	P	96	Very high	97	Very high	69 Å²	69	56.9 Å²	56.9	45%	0.448	30%	0.3	S	S	.	.			trans	-55.4	133.3	175.3	-24.1	33.7	0	0	0	111.2	Y61 V135	P41-Y61 HydrophobicContact CB-CD1 4.2Å; P41-Y61 HydrophobicContact CB-CE1 4.46Å; P41-V135 HydrophobicContact CB-CG1 3.97Å; P41-V135 HydrophobicContact CB-CG2 4.33Å; P41-V135 HydrophobicContact CG-CG1 4.19Å
42	V	98	Very high	96.5	Very high	5 Å²	5	60 Å²	60	3%	0.03	33%	0.331	C	S	.	.			trans	-111.4	114.9	171.5	177.3	0	0	0	0	106.7	P38 L40 V44 Y61 V62 L87 Y88 H89 L121	P38-V42 HydrophobicContact CB-CG2 3.83Å; P38-V42 HydrophobicContact CG-CG2 4.1Å; L40-V42 PolarHBondContact O-N 3.29Å; V42-V44 HydrophobicContact CG1-CG2 4.43Å; V42-Y61 WeakPolarHBondContact O-CA 3.34Å; V42-V62 HydrophobicContact CB-CB 4.02Å; V42-V62 HydrophobicContact CB-CG2 3.64Å; V42-V62 HydrophobicContact CG1-CG2 3.71Å; V42-V62 PolarHBondContact O-N 3.45Å; V42-L87 HydrophobicContact CG1-CB 4.21Å; V42-L87 HydrophobicContact CG1-CD2 4.23Å; V42-Y88 WeakPolarHBondContact CA-O 3.24Å; V42-H89 HydrophobicContact CG1-CB 4.25Å; V42-H89 HydrophobicContact CG2-CB 4Å; V42-L121 HydrophobicContact CG1-CD1 4.04Å; V42-L121 HydrophobicContact CG2-CD1 3.71Å
43	L	98.4	Very high	96.2	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.01	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.3	174	167.9	68.3	0	0	0	108.1	R45 E59 Y61 L87 Y88	L43-R45 HydrophobicContact CD1-CG 4.4Å; L43-R45 HydrophobicContact CG-CG 4.3Å; L43-E59 HydrophobicContact CD1-CB 4.45Å; L43-Y61 HydrophobicContact CB-CD1 4.27Å; L43-Y61 HydrophobicContact CB-CE1 3.91Å; L43-Y61 HydrophobicContact CD1-CE1 4.13Å; L43-Y61 HydrophobicContact CD1-CE2 4.48Å; L43-L87 CarbonylContact O-C 3.59Å; L43-L87 WeakPolarHBondContact O-CA 3.34Å; L43-Y88 HydrophobicContact CB-CD2 4.41Å; L43-Y88 HydrophobicContact CD2-CD2 4.09Å; L43-Y88 HydrophobicContact CD2-CG 4.38Å; L43-Y88 HydrophobicContact CG-CD2 4.06Å; L43-Y88 PolarHBondContact N-O 2.92Å; L43-Y88 VanDerWaalsContact N-O 3.1Å; L43-Y88 PolarHBondContact O-N 2.86Å
44	V	98.6	Very high	96	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.3	180	-169.3	0	0	0	0	107.5	V42 E59 G60 V62 F68 L70 V85 S86 L87	V42-V44 HydrophobicContact CG1-CG2 4.43Å; V44-E59 WeakPolarHBondContact O-CA 3.48Å; V44-G60 PolarHBondContact N-O 2.83Å; V44-G60 PolarHBondContact O-N 2.86Å; V44-G60 VanDerWaalsContact O-O 3.13Å; V44-V62 HydrophobicContact CG2-CG2 3.55Å; V44-F68 HydrophobicContact CG1-CD2 3.87Å; V44-F68 HydrophobicContact CG1-CE2 4.14Å; V44-F68 HydrophobicContact CG1-CG 4.07Å; V44-F68 HydrophobicContact CG2-CB 4.13Å; V44-F68 HydrophobicContact CG2-CD1 4.43Å; V44-F68 HydrophobicContact CG2-CG 4.22Å; V44-L70 HydrophobicContact CB-CD1 4.07Å; V44-L70 HydrophobicContact CG1-CD1 3.67Å; V44-V85 HydrophobicContact CG1-CG1 3.28Å; V44-S86 CarbonylContact C-O 3.54Å; V44-S86 WeakPolarHBondContact CA-O 3.18Å; V44-L87 HydrophobicContact CG2-CD2 4.46Å
45	R	98.6	Very high	96	Very high	53 Å²	53	66.3 Å²	66.3	20%	0.2	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.7	174.6	-57.3	-175.6	165.9	154.2	-7.8	110.5	L43 D58 E59 V85 S86 Y88	L43-R45 HydrophobicContact CD1-CG 4.4Å; L43-R45 HydrophobicContact CG-CG 4.3Å; R45-D58 WeakPolarHBondContact CA-O 3.4Å; R45-E59 HydrophobicContact CB-CB 4.45Å; R45-E59 HydrophobicContact CG-CB 3.83Å; R45-E59 IonicContact CZ-OE2 2.7Å; R45-E59 IonicContact NE-OE2 3.99Å; R45-E59 PolarHBondContact NE-OE2 2.92Å; R45-E59 IonicContact NH2-OE2 3.63Å; R45-E59 PolarHBondContact NH2-OE2 3.01Å; R45-V85 CarbonylContact O-C 3.54Å; R45-V85 WeakPolarHBondContact O-CA 3.3Å; R45-S86 PolarHBondContact N-O 3.43Å; R45-S86 PolarHBondContact O-N 3.34Å; R45-S86 PolarHBondContact O-OG 2.8Å; R45-Y88 HydrophobicContact CB-CE2 4.4Å; R45-Y88 HydrophobicContact CG-CE2 3.91Å; R45-Y88 PolarHBondContact NH1-OH 3.31Å
46	L	98.8	Very high	95.9	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.4	170.2	174.5	63.8	0	0	0	108.4	I25 V27 M57 D58 L70 V85 I102	I25-L46 HydrophobicContact CG2-CD1 4.17Å; I25-L46 HydrophobicContact CG2-CD2 3.9Å; V27-L46 HydrophobicContact CG1-CD1 4Å; V27-L46 HydrophobicContact CG1-CD2 4.19Å; V27-L46 HydrophobicContact CG1-CG 4.46Å; L46-M57 HydrophobicContact CB-CB 4.42Å; L46-M57 HydrophobicContact CD1-SD 4.27Å; L46-M57 HydrophobicContact CD2-CB 4.06Å; L46-M57 HydrophobicContact CD2-CE 4.21Å; L46-M57 HydrophobicContact CD2-SD 4.29Å; L46-M57 HydrophobicContact CG-CB 3.91Å; L46-M57 HydrophobicContact CG-CE 4.42Å; L46-M57 HydrophobicContact CG-CG 4.47Å; L46-M57 HydrophobicContact CG-SD 3.86Å; L46-M57 PolarHBondContact O-N 2.79Å; L46-D58 HydrophobicContact CB-CB 4.31Å; L46-D58 PolarHBondContact N-O 3.33Å; L46-D58 PolarHBondContact O-N 3.27Å; L46-L70 HydrophobicContact CB-CB 4.13Å; L46-L70 HydrophobicContact CB-CD1 3.94Å; L46-L70 HydrophobicContact CD2-CB 4.41Å; L46-V85 HydrophobicContact CD1-CG2 4.36Å; L46-I102 HydrophobicContact CD1-CD1 4.18Å
47	K	98.6	Very high	95.9	Very high	9 Å²	9	65 Å²	65	4%	0.039	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	162	-176.8	-66.1	-180	170.1	-164.1	0	111.4	D54 D55 Y56 P83 Y84	K47-D54 HydrophobicContact CD-CB 4.48Å; K47-D55 CarbonylContact C-O 3.6Å; K47-D55 WeakPolarHBondContact CA-O 3.29Å; K47-D55 WeakPolarHBondContact CB-O 3.31Å; K47-Y56 HydrophobicContact CD-CE1 4.47Å; K47-Y56 HydrophobicContact CG-CD1 4.46Å; K47-Y56 PolarHBondContact NZ-OH 2.91Å; K47-P83 CarbonylContact O-C 3.54Å; K47-P83 VanDerWaalsContact O-CA 3.3Å; K47-P83 WeakPolarHBondContact O-CA 3.44Å; K47-Y84 HydrophobicContact CB-CD1 4.24Å; K47-Y84 HydrophobicContact CB-CD2 4.48Å; K47-Y84 HydrophobicContact CB-CE1 3.71Å; K47-Y84 HydrophobicContact CB-CE2 3.97Å; K47-Y84 HydrophobicContact CD-CE1 4.48Å; K47-Y84 HydrophobicContact CD-CE2 3.87Å; K47-Y84 WeakPolarHBondContact CD-OH 3.4Å; K47-Y84 HydrophobicContact CG-CE2 4.43Å; K47-Y84 PolarHBondContact N-O 2.92Å; K47-Y84 PolarHBondContact O-N 2.87Å
48	D	98.1	Very high	95.9	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	137.9	167.3	-154.9	3.5	0	0	0	110.3	D54 D55 M57 A74 I81 D82	D48-D54 WeakPolarHBondContact O-CA 3.41Å; D48-D54 WeakPolarHBondContact O-CB 3.35Å; D48-D55 HydrophobicContact CB-CB 3.96Å; D48-D55 PolarHBondContact N-O 3.41Å; D48-D55 PolarHBondContact O-N 2.95Å; D48-M57 HydrophobicContact CB-SD 4.3Å; D48-A74 HydrophobicContact CB-CB 3.73Å; D48-A74 WeakPolarHBondContact OD2-CB 3.33Å; D48-I81 WeakPolarHBondContact OD1-CA 3.43Å; D48-I81 WeakPolarHBondContact OD1-CB 3.39Å; D48-I81 WeakPolarHBondContact OD2-CB 3.45Å; D48-I81 WeakPolarHBondContact OD2-CG2 3.4Å; D48-D82 PolarHBondContact OD1-N 2.87Å
49	D	97	Very high	95.9	Very high	50 Å²	50	67.8 Å²	67.8	27%	0.267	34%	0.336	S	S	.	.			trans	-86.8	112.7	177	-164.7	-5.6	0	0	0	109.2	D82 Y84 R101	D49-D82 HydrophobicContact CB-CB 3.89Å; D49-D82 WeakPolarHBondContact CB-O 3.32Å; D49-D82 PolarHBondContact N-O 2.82Å; D49-D82 VanDerWaalsContact N-O 3.09Å; D49-Y84 HydrophobicContact CB-CD1 3.99Å; D49-Y84 HydrophobicContact CB-CE1 4.01Å; D49-R101 IonicContact OD2-CZ 2.92Å; D49-R101 IonicContact OD2-NE 2.65Å; D49-R101 IonicContact OD2-NH2 3.99Å; D49-R101 PolarHBondContact OD2-NH2 3.09Å
50	D	92.3	Very high	96	Very high	41 Å²	41	59 Å²	59	22%	0.219	30%	0.304	C	S	.	.			trans	-116.1	157.8	-171.6	-96.3	-64.6	0	0	0	112.2	G52 Y53 D55	D50-G52 VanDerWaalsContact C-N 3.31Å; D50-G52 PolarHBondContact O-N 2.87Å; D50-Y53 WeakPolarHBondContact CB-O 3.25Å; D50-D55 PolarHBondContact OD2-N 3.16Å
51	I	85.8	Confident	96.2	Very high	173 Å²	173	59.1 Å²	59.1	89%	0.887	30%	0.298	S	S	*	.	S	Bend	trans	-69.1	94.3	163.6	-59.1	174.8	0	0	0	108.6
52	G	88.1	Confident	96.3	Very high	64 Å²	64	56.7 Å²	56.7	66%	0.66	28%	0.282	S	S	*	.	S	Bend	trans	119.3	-88.1	174.7	0	0	0	0	0	112.6	D50	D50-G52 VanDerWaalsContact C-N 3.31Å; D50-G52 PolarHBondContact O-N 2.87Å
53	Y	91.9	Very high	96.3	Very high	216 Å²	216	59.2 Å²	59.2	85%	0.847	30%	0.297	S	S	*	.	S	Bend	trans	-116.5	116.7	-179.6	-66.7	-76	0	0	0	110.4	D50 D55	D50-Y53 WeakPolarHBondContact CB-O 3.25Å; Y53-D55 PolarHBondContact O-N 3.35Å
54	D	95.7	Very high	96.2	Very high	47 Å²	47	68.2 Å²	68.2	25%	0.251	34%	0.336	S	S	.	.			trans	-56	128.1	172.9	-54.2	9.3	0	0	0	112.3	K47 D48 Y56 Y84	K47-D54 HydrophobicContact CD-CB 4.48Å; D48-D54 WeakPolarHBondContact O-CA 3.41Å; D48-D54 WeakPolarHBondContact O-CB 3.35Å; D54-Y56 PolarHBondContact O-N 3.1Å; D54-Y84 PolarHBondContact OD2-OH 2.89Å
55	D	96.1	Very high	96.2	Very high	66 Å²	66	74.8 Å²	74.8	35%	0.353	37%	0.367	S	S	.	.			trans	-67.6	128.6	173.1	-84.1	-20	0	0	0	111.4	K47 D48 D50 Y53 A74	K47-D55 CarbonylContact C-O 3.6Å; K47-D55 WeakPolarHBondContact CA-O 3.29Å; K47-D55 WeakPolarHBondContact CB-O 3.31Å; D48-D55 HydrophobicContact CB-CB 3.96Å; D48-D55 PolarHBondContact N-O 3.41Å; D48-D55 PolarHBondContact O-N 2.95Å; D50-D55 PolarHBondContact OD2-N 3.16Å; Y53-D55 PolarHBondContact O-N 3.35Å; D55-A74 HydrophobicContact CB-CB 4.21Å
56	Y	97.5	Very high	96.2	Very high	149 Å²	149	72.2 Å²	72.2	58%	0.584	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	114.1	172	-79.4	-100.3	0	0	0	109.7	K47 D54	K47-Y56 HydrophobicContact CD-CE1 4.47Å; K47-Y56 HydrophobicContact CG-CD1 4.46Å; K47-Y56 PolarHBondContact NZ-OH 2.91Å; D54-Y56 PolarHBondContact O-N 3.1Å
57	M	98.4	Very high	96.2	Very high	26 Å²	26	74.3 Å²	74.3	13%	0.128	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-46.2	-176	-57.5	170.9	72.8	0	0	111.9	I25 L46 D48 G72 A74 I81	I25-M57 HydrophobicContact CG2-CE 3.63Å; L46-M57 HydrophobicContact CB-CB 4.42Å; L46-M57 HydrophobicContact CD1-SD 4.27Å; L46-M57 HydrophobicContact CD2-CB 4.06Å; L46-M57 HydrophobicContact CD2-CE 4.21Å; L46-M57 HydrophobicContact CD2-SD 4.29Å; L46-M57 HydrophobicContact CG-CB 3.91Å; L46-M57 HydrophobicContact CG-CE 4.42Å; L46-M57 HydrophobicContact CG-CG 4.47Å; L46-M57 HydrophobicContact CG-SD 3.86Å; L46-M57 PolarHBondContact O-N 2.79Å; D48-M57 HydrophobicContact CB-SD 4.3Å; M57-G72 VanDerWaalsContact CE-O 3.25Å; M57-G72 WeakPolarHBondContact CE-O 3.22Å; M57-A74 HydrophobicContact CE-CB 4.2Å; M57-A74 HydrophobicContact CG-CB 4.11Å; M57-A74 HydrophobicContact SD-CB 4.14Å; M57-I81 HydrophobicContact CE-CD1 4.47Å
58	D	98.6	Very high	96.2	Very high	50 Å²	50	74.4 Å²	74.4	27%	0.267	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	157.4	-179.1	-164.4	9.5	0	0	0	111.5	R45 L46 L70 N71	R45-D58 WeakPolarHBondContact CA-O 3.4Å; L46-D58 HydrophobicContact CB-CB 4.31Å; L46-D58 PolarHBondContact N-O 3.33Å; L46-D58 PolarHBondContact O-N 3.27Å; D58-L70 HydrophobicContact CB-CB 4.16Å; D58-L70 HydrophobicContact CB-CD2 4.45Å; D58-L70 VanDerWaalsContact OD2-CA 3.3Å; D58-L70 WeakPolarHBondContact OD2-CA 3.35Å; D58-L70 WeakPolarHBondContact OD2-CB 3.21Å; D58-L70 WeakPolarHBondContact OD2-CD2 3.16Å; D58-N71 VanDerWaalsContact CB-O 3.31Å; D58-N71 WeakPolarHBondContact CB-O 3.4Å; D58-N71 PolarHBondContact OD2-N 3.39Å
59	E	98.1	Very high	96.2	Very high	105 Å²	105	81.3 Å²	81.3	49%	0.491	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	151.2	170	75.3	173.8	175.2	0	0	113.2	L43 V44 R45	L43-E59 HydrophobicContact CD1-CB 4.45Å; V44-E59 WeakPolarHBondContact O-CA 3.48Å; R45-E59 HydrophobicContact CB-CB 4.45Å; R45-E59 HydrophobicContact CG-CB 3.83Å; R45-E59 IonicContact CZ-OE2 2.7Å; R45-E59 IonicContact NE-OE2 3.99Å; R45-E59 PolarHBondContact NE-OE2 2.92Å; R45-E59 IonicContact NH2-OE2 3.63Å; R45-E59 PolarHBondContact NH2-OE2 3.01Å
60	G	97.6	Very high	96.3	Very high	18 Å²	18	79.2 Å²	79.2	19%	0.186	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	-172.6	178.9	0	0	0	0	0	111.9	V44	V44-G60 PolarHBondContact N-O 2.83Å; V44-G60 PolarHBondContact O-N 2.86Å; V44-G60 VanDerWaalsContact O-O 3.13Å
61	Y	97.6	Very high	96.6	Very high	99 Å²	99	81.4 Å²	81.4	39%	0.388	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.9	179.5	-66.8	-88.6	0	0	0	110.4	P41 V42 L43 T63 V135 P136	P41-Y61 HydrophobicContact CB-CD1 4.2Å; P41-Y61 HydrophobicContact CB-CE1 4.46Å; V42-Y61 WeakPolarHBondContact O-CA 3.34Å; L43-Y61 HydrophobicContact CB-CD1 4.27Å; L43-Y61 HydrophobicContact CB-CE1 3.91Å; L43-Y61 HydrophobicContact CD1-CE1 4.13Å; L43-Y61 HydrophobicContact CD1-CE2 4.48Å; Y61-T63 PolarHBondContact O-N 2.91Å; Y61-V135 HydrophobicContact CE1-CG1 3.85Å; Y61-V135 HydrophobicContact CE1-CG2 4.38Å; Y61-P136 VanDerWaalsContact OH-CD 3.3Å; Y61-P136 WeakPolarHBondContact OH-CD 3.41Å
62	V	98.3	Very high	97.2	Very high	17 Å²	17	73.7 Å²	73.7	10%	0.103	36%	0.363	C	S	.	.			trans	-58.2	128.8	166.1	178.8	0	0	0	0	108.6	V31 V42 V44 G66 S67 F68	V31-V62 HydrophobicContact CB-CG1 4.04Å; V31-V62 HydrophobicContact CB-CG2 4.02Å; V31-V62 HydrophobicContact CG1-CG2 4.29Å; V31-V62 HydrophobicContact CG2-CG1 4.5Å; V31-V62 HydrophobicContact CG2-CG2 3.82Å; V42-V62 HydrophobicContact CB-CB 4.02Å; V42-V62 HydrophobicContact CB-CG2 3.64Å; V42-V62 HydrophobicContact CG1-CG2 3.71Å; V42-V62 PolarHBondContact O-N 3.45Å; V44-V62 HydrophobicContact CG2-CG2 3.55Å; V62-G66 VanDerWaalsContact CG1-C 3.49Å; V62-S67 CarbonylContact C-O 3.55Å; V62-S67 WeakPolarHBondContact CA-O 3.33Å; V62-F68 HydrophobicContact CG2-CB 4.47Å
63	T	98	Very high	97.6	Very high	59 Å²	59	73.3 Å²	73.3	36%	0.362	35%	0.35	S	S	.	.			trans	-63.6	166.9	179.1	67.6	0	0	0	0	111.3	Y61 Q65 G66 S67	Y61-T63 PolarHBondContact O-N 2.91Å; T63-Q65 PolarHBondContact O-N 3.41Å; T63-Q65 VanDerWaalsContact O-N 3.14Å; T63-Q65 PolarHBondContact OG1-N 2.81Å; T63-G66 PolarHBondContact O-N 2.93Å; T63-G66 PolarHBondContact OG1-N 2.84Å; T63-S67 WeakPolarHBondContact CG2-O 3.45Å; T63-S67 PolarHBondContact N-O 3.31Å; T63-S67 PolarHBondContact OG1-N 2.97Å; T63-S67 VanDerWaalsContact OG1-N 3.08Å; T63-S67 PolarHBondContact OG1-O 2.91Å; T63-S67 PolarHBondContact OG1-OG 3.02Å
64	K	96.8	Very high	97.9	Very high	191 Å²	191	63 Å²	63	83%	0.83	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.7	174.9	-66.4	-175.5	-180	177.8	0	113.1	G66	K64-G66 VanDerWaalsContact C-N 3.29Å
65	Q	97.9	Very high	97.8	Very high	137 Å²	137	62.2 Å²	62.2	64%	0.64	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-4.1	175.1	-67.7	73.1	23.8	0	0	112.4	T63	T63-Q65 PolarHBondContact O-N 3.41Å; T63-Q65 VanDerWaalsContact O-N 3.14Å; T63-Q65 PolarHBondContact OG1-N 2.81Å
66	G	98.5	Very high	97.6	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	83.4	27.7	178.1	0	0	0	0	0	113.5	D30 V31 R32 V62 T63 K64	D30-G66 CarbonylContact C-O 3.53Å; D30-G66 WeakPolarHBondContact CA-O 3.49Å; V31-G66 PolarHBondContact N-O 3.03Å; R32-G66 PolarHBondContact NH1-O 3.44Å; V62-G66 VanDerWaalsContact CG1-C 3.49Å; T63-G66 PolarHBondContact O-N 2.93Å; T63-G66 PolarHBondContact OG1-N 2.84Å; K64-G66 VanDerWaalsContact C-N 3.29Å
67	S	98.6	Very high	97.1	Very high	44 Å²	44	58.4 Å²	58.4	31%	0.308	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	157.6	176.9	61.7	0	0	0	0	111.8	G29 V62 T63	G29-S67 CarbonylContact O-C 3.56Å; G29-S67 VanDerWaalsContact O-CA 3.31Å; G29-S67 WeakPolarHBondContact O-CA 3.45Å; V62-S67 CarbonylContact C-O 3.55Å; V62-S67 WeakPolarHBondContact CA-O 3.33Å; T63-S67 WeakPolarHBondContact CG2-O 3.45Å; T63-S67 PolarHBondContact N-O 3.31Å; T63-S67 PolarHBondContact OG1-N 2.97Å; T63-S67 VanDerWaalsContact OG1-N 3.08Å; T63-S67 PolarHBondContact OG1-O 2.91Å; T63-S67 PolarHBondContact OG1-OG 3.02Å
68	F	98.8	Very high	96.4	Very high	10 Å²	10	65.5 Å²	65.5	4%	0.044	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	156.8	167.6	69	-90.6	0	0	0	110.8	V27 A28 G29 V31 V44 V62 V85 F115 I119	V27-F68 HydrophobicContact CG1-CE2 4.31Å; V27-F68 HydrophobicContact CG2-CE2 4.2Å; A28-F68 VanDerWaalsContact CA-O 3.32Å; A28-F68 WeakPolarHBondContact CA-O 3.34Å; G29-F68 PolarHBondContact N-O 2.84Å; G29-F68 WeakPolarHBondContact O-CD1 3.3Å; G29-F68 PolarHBondContact O-N 3.42Å; V31-F68 HydrophobicContact CG2-CD1 3.66Å; V31-F68 HydrophobicContact CG2-CE1 3.76Å; V44-F68 HydrophobicContact CG1-CD2 3.87Å; V44-F68 HydrophobicContact CG1-CE2 4.14Å; V44-F68 HydrophobicContact CG1-CG 4.07Å; V44-F68 HydrophobicContact CG2-CB 4.13Å; V44-F68 HydrophobicContact CG2-CD1 4.43Å; V44-F68 HydrophobicContact CG2-CG 4.22Å; V62-F68 HydrophobicContact CG2-CB 4.47Å; F68-V85 HydrophobicContact CE2-CG1 4.33Å; F68-V85 HydrophobicContact CE2-CG2 4.37Å; F68-V85 HydrophobicContact CZ-CG1 4.32Å; F68-F115 AromaticContact CZ-CD2 3.88Å; F68-F115 HydrophobicContact CZ-CD2 3.88Å; F68-F115 HydrophobicContact CZ-CE2 4.04Å; F68-I119 HydrophobicContact CE1-CD1 3.93Å; F68-I119 HydrophobicContact CZ-CD1 4.3Å
69	Y	98.8	Very high	95.9	Very high	146 Å²	146	65.5 Å²	65.5	57%	0.573	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.3	124.8	170.8	178.7	-88.9	0	0	0	107.7	A26 V27 A28 N71	A26-Y69 HydrophobicContact CB-CE2 4.02Å; A26-Y69 VanDerWaalsContact CB-OH 3.32Å; A26-Y69 WeakPolarHBondContact CB-OH 3.35Å; V27-Y69 CarbonylContact O-C 3.6Å; V27-Y69 VanDerWaalsContact O-CA 3.31Å; V27-Y69 WeakPolarHBondContact O-CA 3.42Å; A28-Y69 HydrophobicContact CB-CD2 4.02Å; Y69-N71 HydrophobicContact CE1-CB 4.42Å
70	L	98.8	Very high	95.7	Very high	6 Å²	6	62 Å²	62	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	155.8	177.1	-63.4	-178.5	0	0	0	109.2	A26 V27 V44 L46 D58	A26-L70 CarbonylContact C-O 3.51Å; A26-L70 WeakPolarHBondContact CA-O 3.48Å; V27-L70 HydrophobicContact CG1-CB 3.92Å; V27-L70 PolarHBondContact N-O 3.24Å; V27-L70 PolarHBondContact O-N 2.88Å; V44-L70 HydrophobicContact CB-CD1 4.07Å; V44-L70 HydrophobicContact CG1-CD1 3.67Å; L46-L70 HydrophobicContact CB-CB 4.13Å; L46-L70 HydrophobicContact CB-CD1 3.94Å; L46-L70 HydrophobicContact CD2-CB 4.41Å; D58-L70 HydrophobicContact CB-CB 4.16Å; D58-L70 HydrophobicContact CB-CD2 4.45Å; D58-L70 VanDerWaalsContact OD2-CA 3.3Å; D58-L70 WeakPolarHBondContact OD2-CA 3.35Å; D58-L70 WeakPolarHBondContact OD2-CB 3.21Å; D58-L70 WeakPolarHBondContact OD2-CD2 3.16Å
71	N	98.6	Very high	95.6	Very high	87 Å²	87	61.2 Å²	61.2	47%	0.465	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	143.3	176	69.5	113.2	0	0	0	111.3	I25 A26 D58 Y69	I25-N71 CarbonylContact O-C 3.47Å; I25-N71 WeakPolarHBondContact O-CA 3.46Å; A26-N71 HydrophobicContact CB-CB 3.9Å; D58-N71 VanDerWaalsContact CB-O 3.31Å; D58-N71 WeakPolarHBondContact CB-O 3.4Å; D58-N71 PolarHBondContact OD2-N 3.39Å; Y69-N71 HydrophobicContact CE1-CB 4.42Å
72	G	98.4	Very high	95.6	Very high	11 Å²	11	61 Å²	61	11%	0.113	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	-178.7	175.9	0	0	0	0	0	112.1	C24 I25 M57	C24-G72 VanDerWaalsContact CA-O 3.29Å; C24-G72 WeakPolarHBondContact CA-O 3.34Å; I25-G72 PolarHBondContact N-O 2.75Å; I25-G72 PolarHBondContact O-N 3.13Å; M57-G72 VanDerWaalsContact CE-O 3.25Å; M57-G72 WeakPolarHBondContact CE-O 3.22Å
73	C	97.7	Very high	95.6	Very high	56 Å²	56	60.2 Å²	60.2	38%	0.378	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.8	-179.5	-48	0	0	0	0	110.1	W22 Q23 C24	W22-C73 HydrophobicContact CE3-CB 3.86Å; W22-C73 HydrophobicContact CZ3-CB 4.35Å; Q23-C73 CarbonylContact O-C 3.53Å; Q23-C73 WeakPolarHBondContact O-CA 3.32Å; Q23-C73 WeakPolarHBondContact O-CB 3.31Å; C24-C73 HydrophobicContact CB-CB 4Å; C24-C73 WeakPolarHBondContact CB-SG 3.41Å; C24-C73 WeakPolarHBondContact SG-CB 3.42Å; C24-C73 CovalentContact SG-SG 2.04Å; C24-C73 PolarHBondContact SG-SG 2.83Å
74	A	96.7	Very high	95.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	176.2	174	0	0	0	0	0	109.4	W22 Q23 D48 D55 M57 I81	W22-A74 WeakPolarHBondContact CA-O 3.5Å; Q23-A74 PolarHBondContact N-O 2.65Å; Q23-A74 PolarHBondContact O-N 2.72Å; D48-A74 HydrophobicContact CB-CB 3.73Å; D48-A74 WeakPolarHBondContact OD2-CB 3.33Å; D55-A74 HydrophobicContact CB-CB 4.21Å; M57-A74 HydrophobicContact CE-CB 4.2Å; M57-A74 HydrophobicContact CG-CB 4.11Å; M57-A74 HydrophobicContact SD-CB 4.14Å; A74-I81 HydrophobicContact CB-CG2 4.01Å
75	S	93.9	Very high	95.7	Very high	29 Å²	29	48.8 Å²	48.8	20%	0.203	26%	0.263	C	S	.	.			trans	-155.3	124.3	177.4	67.9	0	0	0	0	112.3	Q21	Q21-S75 WeakPolarHBondContact O-CB 3.05Å
76	D	92.1	Very high	95.8	Very high	14 Å²	14	42.2 Å²	42.2	8%	0.075	23%	0.233	C	C	.	.			trans	-93.3	139.5	177.2	-67.7	-10.4	0	0	0	112.7	G20 F78 S80 I81	G20-D76 WeakPolarHBondContact CA-O 3.34Å; G20-D76 PolarHBondContact N-O 2.98Å; D76-F78 PolarHBondContact O-N 3.14Å; D76-S80 VanDerWaalsContact OD2-C 3.31Å; D76-I81 VanDerWaalsContact OD2-CA 3.3Å; D76-I81 WeakPolarHBondContact OD2-CA 3.42Å; D76-I81 PolarHBondContact OD2-N 3.19Å
77	L	86.7	Confident	95.8	Very high	122 Å²	122	42.2 Å²	42.2	64%	0.639	23%	0.233	S	C	*	.	S	Bend	trans	-61.8	-28.4	175.7	-175	59.8	0	0	0	112.4	G19	G19-L77 VanDerWaalsContact CA-O 3.25Å; G19-L77 WeakPolarHBondContact CA-O 3.29Å
78	F	84.9	Confident	95.8	Very high	174 Å²	174	40.3 Å²	40.3	76%	0.763	22%	0.219	S	C	*	.	S	Bend	trans	-132.7	91.2	-178.7	-59.6	-69.4	0	0	0	111.7	D76	D76-F78 PolarHBondContact O-N 3.14Å
79	G	88.2	Confident	95.7	Very high	50 Å²	50	39.9 Å²	39.9	52%	0.515	22%	0.217	S	C	.	.	S	Bend	trans	112.4	-130.7	171.1	0	0	0	0	0	112.8
80	S	93.3	Very high	95.7	Very high	33 Å²	33	37.4 Å²	37.4	23%	0.231	21%	0.209	C	C	.	.			trans	-128.3	150.3	-177.8	54.8	0	0	0	0	109.5	Q23 D76 G106	Q23-S80 VanDerWaalsContact OE1-CA 3.24Å; D76-S80 VanDerWaalsContact OD2-C 3.31Å; S80-G106 VanDerWaalsContact CB-CA 3.45Å
81	I	96.1	Very high	95.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.216	C	C	.	.			trans	-49.8	148.8	176.9	66.1	163.1	0	0	0	111.6	Q23 D48 M57 A74 D76 P83 Y104 F111	Q23-I81 HydrophobicContact CB-CD1 3.94Å; Q23-I81 HydrophobicContact CB-CG1 3.95Å; Q23-I81 HydrophobicContact CB-CG2 4.01Å; D48-I81 WeakPolarHBondContact OD1-CA 3.43Å; D48-I81 WeakPolarHBondContact OD1-CB 3.39Å; D48-I81 WeakPolarHBondContact OD2-CB 3.45Å; D48-I81 WeakPolarHBondContact OD2-CG2 3.4Å; M57-I81 HydrophobicContact CE-CD1 4.47Å; A74-I81 HydrophobicContact CB-CG2 4.01Å; D76-I81 VanDerWaalsContact OD2-CA 3.3Å; D76-I81 WeakPolarHBondContact OD2-CA 3.42Å; D76-I81 PolarHBondContact OD2-N 3.19Å; I81-P83 VanDerWaalsContact C-CD 3.4Å; I81-P83 HydrophobicContact CD1-CB 4.33Å; I81-P83 HydrophobicContact CD1-CG 4.09Å; I81-P83 HydrophobicContact CG1-CG 4.33Å; I81-P83 VanDerWaalsContact O-CD 3.28Å; I81-P83 WeakPolarHBondContact O-CD 3.47Å; I81-Y104 HydrophobicContact CD1-CE1 4.37Å; I81-Y104 HydrophobicContact CG1-CD1 3.75Å; I81-Y104 HydrophobicContact CG1-CE1 3.49Å; I81-Y104 VanDerWaalsContact CG1-CE1 3.49Å; I81-Y104 VanDerWaalsContact O-CD1 3.27Å; I81-Y104 WeakPolarHBondContact O-CD1 3.36Å; I81-F111 HydrophobicContact CD1-CE1 4.41Å
82	D	96.6	Very high	95.5	Very high	94 Å²	94	37.8 Å²	37.8	50%	0.503	21%	0.209	S	C	.	.			trans	-116.9	69.2	175.4	-77.2	-44.6	0	0	0	110.1	D48 D49	D48-D82 PolarHBondContact OD1-N 2.87Å; D49-D82 HydrophobicContact CB-CB 3.89Å; D49-D82 WeakPolarHBondContact CB-O 3.32Å; D49-D82 PolarHBondContact N-O 2.82Å; D49-D82 VanDerWaalsContact N-O 3.09Å
83	P	98.3	Very high	95.4	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.013	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	145	-166.4	27.8	-33.5	0	0	0	112.9	I25 K47 I81 I102 F111	I25-P83 HydrophobicContact CD1-CB 4.48Å; I25-P83 HydrophobicContact CD1-CG 4.29Å; I25-P83 HydrophobicContact CG2-CB 4.43Å; K47-P83 CarbonylContact O-C 3.54Å; K47-P83 VanDerWaalsContact O-CA 3.3Å; K47-P83 WeakPolarHBondContact O-CA 3.44Å; I81-P83 VanDerWaalsContact C-CD 3.4Å; I81-P83 HydrophobicContact CD1-CB 4.33Å; I81-P83 HydrophobicContact CD1-CG 4.09Å; I81-P83 HydrophobicContact CG1-CG 4.33Å; I81-P83 VanDerWaalsContact O-CD 3.28Å; I81-P83 WeakPolarHBondContact O-CD 3.47Å; P83-I102 HydrophobicContact CB-CD1 4.36Å; P83-I102 HydrophobicContact CG-CB 4.18Å; P83-I102 HydrophobicContact CG-CG2 4.47Å; P83-I102 WeakPolarHBondContact O-CB 3.27Å; P83-I102 PolarHBondContact O-N 2.67Å; P83-F111 HydrophobicContact CG-CZ 4.19Å
84	Y	98.7	Very high	95.4	Very high	9 Å²	9	41.1 Å²	41.1	4%	0.035	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	156.4	175.4	71.9	-93	0	0	0	112.5	K47 D49 D54 V99 L100	K47-Y84 HydrophobicContact CB-CD1 4.24Å; K47-Y84 HydrophobicContact CB-CD2 4.48Å; K47-Y84 HydrophobicContact CB-CE1 3.71Å; K47-Y84 HydrophobicContact CB-CE2 3.97Å; K47-Y84 HydrophobicContact CD-CE1 4.48Å; K47-Y84 HydrophobicContact CD-CE2 3.87Å; K47-Y84 WeakPolarHBondContact CD-OH 3.4Å; K47-Y84 HydrophobicContact CG-CE2 4.43Å; K47-Y84 PolarHBondContact N-O 2.92Å; K47-Y84 PolarHBondContact O-N 2.87Å; D49-Y84 HydrophobicContact CB-CD1 3.99Å; D49-Y84 HydrophobicContact CB-CE1 4.01Å; D54-Y84 PolarHBondContact OD2-OH 2.89Å; Y84-V99 HydrophobicContact CD2-CG1 3.64Å; Y84-V99 HydrophobicContact CE2-CG1 4.21Å; Y84-V99 HydrophobicContact CE2-CG2 4.5Å; Y84-V99 HydrophobicContact CG-CG1 4.12Å; Y84-L100 WeakPolarHBondContact CA-O 3.26Å
85	V	98.7	Very high	95.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.5	172	177.1	0	0	0	0	109.5	V27 V44 R45 L46 F68 L87 L100 I102 F115	V27-V85 HydrophobicContact CB-CG2 4.44Å; V27-V85 HydrophobicContact CG1-CG2 3.82Å; V27-V85 HydrophobicContact CG2-CG2 3.92Å; V44-V85 HydrophobicContact CG1-CG1 3.28Å; R45-V85 CarbonylContact O-C 3.54Å; R45-V85 WeakPolarHBondContact O-CA 3.3Å; L46-V85 HydrophobicContact CD1-CG2 4.36Å; F68-V85 HydrophobicContact CE2-CG1 4.33Å; F68-V85 HydrophobicContact CE2-CG2 4.37Å; F68-V85 HydrophobicContact CZ-CG1 4.32Å; V85-L87 HydrophobicContact CG1-CD1 3.97Å; V85-L87 HydrophobicContact CG1-CG 4.29Å; V85-L100 PolarHBondContact N-O 3.46Å; V85-L100 PolarHBondContact O-N 2.81Å; V85-I102 HydrophobicContact CG2-CD1 4.16Å; V85-F115 HydrophobicContact CB-CE2 4.36Å; V85-F115 HydrophobicContact CG2-CE2 4.07Å
86	S	98.6	Very high	95.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.7	168.2	53.4	0	0	0	0	111.2	V44 R45 Y88 V98	V44-S86 CarbonylContact C-O 3.54Å; V44-S86 WeakPolarHBondContact CA-O 3.18Å; R45-S86 PolarHBondContact N-O 3.43Å; R45-S86 PolarHBondContact O-N 3.34Å; R45-S86 PolarHBondContact O-OG 2.8Å; S86-Y88 WeakPolarHBondContact OG-CE2 3.38Å; S86-V98 CarbonylContact C-O 3.54Å; S86-V98 VanDerWaalsContact CA-O 3.24Å; S86-V98 WeakPolarHBondContact CA-O 3.09Å
87	L	98.7	Very high	95.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.2	176.2	-61	97.8	0	0	0	109.6	V31 V42 L43 V44 V85 R97 V98 L100 I119 L121	V31-L87 HydrophobicContact CG1-CD2 4.14Å; V31-L87 HydrophobicContact CG2-CD2 3.57Å; V42-L87 HydrophobicContact CG1-CB 4.21Å; V42-L87 HydrophobicContact CG1-CD2 4.23Å; L43-L87 CarbonylContact O-C 3.59Å; L43-L87 WeakPolarHBondContact O-CA 3.34Å; V44-L87 HydrophobicContact CG2-CD2 4.46Å; V85-L87 HydrophobicContact CG1-CD1 3.97Å; V85-L87 HydrophobicContact CG1-CG 4.29Å; L87-R97 WeakPolarHBondContact O-CA 3.07Å; L87-V98 PolarHBondContact N-O 2.04Å; L87-V98 PolarHBondContact O-N 3Å; L87-L100 HydrophobicContact CD1-CD1 3.66Å; L87-L100 HydrophobicContact CD1-CG 4.01Å; L87-I119 HydrophobicContact CD2-CG2 4.41Å; L87-L121 HydrophobicContact CB-CD2 4.21Å; L87-L121 HydrophobicContact CD2-CD2 4.29Å
88	Y	98.7	Very high	96.5	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	120.2	177.4	-56.7	-102.9	0	0	0	109.3	V42 L43 R45 S86 K96 R97 H131 Y133	V42-Y88 WeakPolarHBondContact CA-O 3.24Å; L43-Y88 HydrophobicContact CB-CD2 4.41Å; L43-Y88 HydrophobicContact CD2-CD2 4.09Å; L43-Y88 HydrophobicContact CD2-CG 4.38Å; L43-Y88 HydrophobicContact CG-CD2 4.06Å; L43-Y88 PolarHBondContact N-O 2.92Å; L43-Y88 VanDerWaalsContact N-O 3.1Å; L43-Y88 PolarHBondContact O-N 2.86Å; R45-Y88 HydrophobicContact CB-CE2 4.4Å; R45-Y88 HydrophobicContact CG-CE2 3.91Å; R45-Y88 PolarHBondContact NH1-OH 3.31Å; S86-Y88 WeakPolarHBondContact OG-CE2 3.38Å; Y88-K96 WeakPolarHBondContact CA-O 3.36Å; Y88-R97 HydrophobicContact CD1-CB 3.95Å; Y88-R97 HydrophobicContact CD1-CG 4.01Å; Y88-R97 HydrophobicContact CE1-CB 4.05Å; Y88-R97 VanDerWaalsContact CE1-CD 3.46Å; Y88-R97 HydrophobicContact CE1-CG 3.77Å; Y88-R97 HydrophobicContact CE2-CG 4.47Å; Y88-R97 HydrophobicContact CG-CG 4.5Å; Y88-H131 AromaticContact CD1-CD2 3.7Å; Y88-H131 AromaticContact CE1-CD2 3.4Å; Y88-H131 VanDerWaalsContact CE1-CD2 3.4Å; Y88-H131 WeakPolarHBondContact CE1-CD2 3.06Å; Y88-H131 AromaticContact CE1-NE2 3.58Å; Y88-Y133 HydrophobicContact CD1-CD1 4.31Å; Y88-Y133 HydrophobicContact CD1-CG 4.12Å; Y88-Y133 HydrophobicContact CG-CG 4.24Å
89	H	98.2	Very high	97.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	171.7	-169	69.1	106.3	0	0	0	112.9	V42 C91 S95 K96 L121 Y133	V42-H89 HydrophobicContact CG1-CB 4.25Å; V42-H89 HydrophobicContact CG2-CB 4Å; H89-C91 VanDerWaalsContact ND1-CB 3.35Å; H89-C91 WeakPolarHBondContact ND1-CB 3.46Å; H89-C91 PolarHBondContact ND1-N 2.99Å; H89-S95 WeakPolarHBondContact O-CA 3.32Å; H89-K96 PolarHBondContact N-O 3.01Å; H89-K96 WeakPolarHBondContact NE2-CB 3.17Å; H89-K96 PolarHBondContact O-N 3.43Å; H89-L121 HydrophobicContact CB-CD1 3.68Å; H89-L121 PolarHBondContact CE1-O 3.44Å; H89-Y133 WeakPolarHBondContact CA-OH 3.42Å; H89-Y133 PolarHBondContact N-OH 3.34Å; H89-Y133 WeakPolarHBondContact O-CE1 3.48Å; H89-Y133 PolarHBondContact O-OH 2.92Å
90	K	97.4	Very high	97.7	Very high	95 Å²	95	30.6 Å²	30.6	41%	0.413	17%	0.174	S	C	.	.			trans	-127.1	25.5	174.3	-73.5	176.2	-176.3	-178.9	0	112.6	L40 K92 G93 N94 S95 Y133	L40-K90 HydrophobicContact CD1-CB 3.84Å; K90-K92 VanDerWaalsContact C-N 3.27Å; K90-K92 PolarHBondContact O-N 2.95Å; K90-G93 PolarHBondContact O-N 3.29Å; K90-G93 VanDerWaalsContact O-N 3.08Å; K90-N94 WeakPolarHBondContact CA-O 3.3Å; K90-S95 WeakPolarHBondContact CE-OG 3.24Å; K90-Y133 HydrophobicContact CG-CE1 4.35Å; K90-Y133 PolarHBondContact N-OH 3.03Å
91	C	97.8	Very high	97.9	Very high	27 Å²	27	35.1 Å²	35.1	18%	0.182	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-39	-174.5	178.8	0	0	0	0	112.6	C33 H89 G93 L121	C33-C91 WeakPolarHBondContact CA-SG 3.49Å; C33-C91 HydrophobicContact CB-CB 3.92Å; C33-C91 WeakPolarHBondContact CB-SG 3.33Å; C33-C91 VanDerWaalsContact SG-CA 3.51Å; C33-C91 WeakPolarHBondContact SG-CB 3.31Å; C33-C91 CovalentContact SG-SG 2.02Å; C33-C91 PolarHBondContact SG-SG 2.87Å; H89-C91 VanDerWaalsContact ND1-CB 3.35Å; H89-C91 WeakPolarHBondContact ND1-CB 3.46Å; H89-C91 PolarHBondContact ND1-N 2.99Å; C91-G93 VanDerWaalsContact C-N 3.28Å; C91-G93 PolarHBondContact O-N 3.31Å; C91-L121 HydrophobicContact CB-CB 3.73Å
92	K	96.8	Very high	98	Very high	73 Å²	73	35.7 Å²	35.7	32%	0.317	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	7.4	-179.4	-60.3	-179.7	-180	174.3	0	114	K90 N94 L121 A122 E123 E128	K90-K92 VanDerWaalsContact C-N 3.27Å; K90-K92 PolarHBondContact O-N 2.95Å; K92-N94 PolarHBondContact O-OD1 2.74Å; K92-L121 VanDerWaalsContact CE-O 3.3Å; K92-L121 WeakPolarHBondContact CE-O 3.09Å; K92-A122 WeakPolarHBondContact CE-O 3.39Å; K92-E123 WeakPolarHBondContact CE-O 3.36Å; K92-E123 PolarHBondContact NZ-O 3.15Å; K92-E128 WeakPolarHBondContact CD-OE1 3.29Å; K92-E128 IonicContact NZ-OE1 3.48Å; K92-E128 PolarHBondContact NZ-OE1 2.72Å; K92-E128 IonicContact NZ-OE2 3.37Å; K92-E128 PolarHBondContact NZ-OE2 3.35Å
93	G	95.8	Very high	98	Very high	74 Å²	74	35.7 Å²	35.7	76%	0.763	19%	0.194	S	C	*	.	S	Bend	trans	94.2	-21.8	-179.6	0	0	0	0	0	114.9	K90 C91	K90-G93 PolarHBondContact O-N 3.29Å; K90-G93 VanDerWaalsContact O-N 3.08Å; C91-G93 VanDerWaalsContact C-N 3.28Å; C91-G93 PolarHBondContact O-N 3.31Å
94	N	96.4	Very high	97.9	Very high	63 Å²	63	37.5 Å²	37.5	34%	0.337	20%	0.201	S	C	.	.	S	Bend	trans	-116.2	161	173	53.8	-42.2	0	0	0	111.8	K90 K92 K96 D130	K90-N94 WeakPolarHBondContact CA-O 3.3Å; K92-N94 PolarHBondContact O-OD1 2.74Å; N94-K96 WeakPolarHBondContact ND2-CE 3.05Å; N94-K96 PolarHBondContact ND2-NZ 3.46Å; N94-K96 PolarHBondContact O-N 3.01Å; N94-D130 PolarHBondContact ND2-OD1 3.29Å
95	S	98.1	Very high	97.5	Very high	32 Å²	32	42.7 Å²	42.7	22%	0.224	23%	0.229	C	C	.	.			trans	-73	120.2	179.3	-52.5	0	0	0	0	110.9	H89 K90 H131	H89-S95 WeakPolarHBondContact O-CA 3.32Å; K90-S95 WeakPolarHBondContact CE-OG 3.24Å; S95-H131 CarbonylContact C-O 3.58Å; S95-H131 WeakPolarHBondContact CB-O 3.38Å; S95-H131 PolarHBondContact O-N 2.94Å
96	K	98.4	Very high	97.1	Very high	31 Å²	31	43.9 Å²	43.9	14%	0.135	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	151.6	-178.1	-67.2	-63.3	-158.2	-172	0	110.8	Y88 H89 N94 E128 V129 D130	Y88-K96 WeakPolarHBondContact CA-O 3.36Å; H89-K96 PolarHBondContact N-O 3.01Å; H89-K96 WeakPolarHBondContact NE2-CB 3.17Å; H89-K96 PolarHBondContact O-N 3.43Å; N94-K96 WeakPolarHBondContact ND2-CE 3.05Å; N94-K96 PolarHBondContact ND2-NZ 3.46Å; N94-K96 PolarHBondContact O-N 3.01Å; K96-E128 HydrophobicContact CB-CG 4.39Å; K96-E128 HydrophobicContact CD-CG 4.22Å; K96-E128 WeakPolarHBondContact CD-OE1 3.36Å; K96-E128 WeakPolarHBondContact CE-OE1 3.48Å; K96-E128 WeakPolarHBondContact CG-OE1 3.41Å; K96-V129 WeakPolarHBondContact CA-O 3.28Å; K96-D130 WeakPolarHBondContact CD-OD1 3.45Å; K96-D130 VanDerWaalsContact CE-OD1 3.32Å; K96-D130 WeakPolarHBondContact CE-OD1 3.17Å; K96-D130 IonicContact NZ-OD1 3.29Å; K96-D130 PolarHBondContact NZ-OD1 2.94Å; K96-D130 IonicContact NZ-OD2 3.57Å; K96-D130 PolarHBondContact NZ-OD2 3.36Å
97	R	98.5	Very high	96.7	Very high	60 Å²	60	49 Å²	49	23%	0.226	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122	164.2	179.2	-176.7	69.4	152.2	-1.8	108.4	L87 Y88 E128 V129 H131	L87-R97 WeakPolarHBondContact O-CA 3.07Å; Y88-R97 HydrophobicContact CD1-CB 3.95Å; Y88-R97 HydrophobicContact CD1-CG 4.01Å; Y88-R97 HydrophobicContact CE1-CB 4.05Å; Y88-R97 VanDerWaalsContact CE1-CD 3.46Å; Y88-R97 HydrophobicContact CE1-CG 3.77Å; Y88-R97 HydrophobicContact CE2-CG 4.47Å; Y88-R97 HydrophobicContact CG-CG 4.5Å; R97-E128 WeakPolarHBondContact O-CA 3.3Å; R97-V129 HydrophobicContact CB-CG2 4.26Å; R97-V129 PolarHBondContact N-O 2.92Å; R97-V129 PolarHBondContact O-N 3.27Å; R97-H131 HydrophobicContact CB-CB 3.58Å
98	V	98.6	Very high	96.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	136.7	169	171.9	0	0	0	0	108.4	S86 L87 L100 H125 E127 E128	S86-V98 CarbonylContact C-O 3.54Å; S86-V98 VanDerWaalsContact CA-O 3.24Å; S86-V98 WeakPolarHBondContact CA-O 3.09Å; L87-V98 PolarHBondContact N-O 2.04Å; L87-V98 PolarHBondContact O-N 3Å; V98-L100 HydrophobicContact CG1-CD2 3.86Å; V98-L100 HydrophobicContact CG1-CG 4.07Å; V98-H125 HydrophobicContact CG1-CB 3.72Å; V98-H125 HydrophobicContact CG2-CB 4.1Å; V98-E127 CarbonylContact C-O 3.6Å; V98-E127 WeakPolarHBondContact CA-O 3.43Å; V98-E128 HydrophobicContact CG2-CB 4.2Å; V98-E128 HydrophobicContact CG2-CG 3.86Å
99	V	98.6	Very high	96.2	Very high	17 Å²	17	59.5 Å²	59.5	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.8	172.2	174.5	0	0	0	0	109	Y84 E127	Y84-V99 HydrophobicContact CD2-CG1 3.64Å; Y84-V99 HydrophobicContact CE2-CG1 4.21Å; Y84-V99 HydrophobicContact CE2-CG2 4.5Å; Y84-V99 HydrophobicContact CG-CG1 4.12Å; V99-E127 HydrophobicContact CB-CB 3.91Å; V99-E127 PolarHBondContact N-O 3.04Å
100	L	98.5	Very high	96.1	Very high	29 Å²	29	65.1 Å²	65.1	15%	0.152	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	109.4	174.8	-58	179.5	0	0	0	108.6	Y84 V85 L87 V98 F115 I119	Y84-L100 WeakPolarHBondContact CA-O 3.26Å; V85-L100 PolarHBondContact N-O 3.46Å; V85-L100 PolarHBondContact O-N 2.81Å; L87-L100 HydrophobicContact CD1-CD1 3.66Å; L87-L100 HydrophobicContact CD1-CG 4.01Å; V98-L100 HydrophobicContact CG1-CD2 3.86Å; V98-L100 HydrophobicContact CG1-CG 4.07Å; L100-F115 HydrophobicContact CB-CE1 3.71Å; L100-F115 HydrophobicContact CB-CZ 3.61Å; L100-F115 HydrophobicContact CD1-CD1 4.42Å; L100-F115 HydrophobicContact CD1-CE1 4Å; L100-F115 HydrophobicContact CD1-CZ 4.12Å; L100-F115 HydrophobicContact CG-CE1 4.47Å; L100-I119 HydrophobicContact CD1-CB 4.43Å; L100-I119 HydrophobicContact CD1-CD1 3.43Å; L100-I119 VanDerWaalsContact CD1-CD1 3.43Å; L100-I119 HydrophobicContact CD1-CG1 3.65Å; L100-I119 HydrophobicContact CD1-CG2 3.88Å
101	R	98.2	Very high	96.1	Very high	128 Å²	128	61.7 Å²	61.7	48%	0.483	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	142.4	176.4	-70.7	-169.2	158.6	88.5	7.2	111.2	D49 E127	D49-R101 IonicContact OD2-CZ 2.92Å; D49-R101 IonicContact OD2-NE 2.65Å; D49-R101 IonicContact OD2-NH2 3.99Å; D49-R101 PolarHBondContact OD2-NH2 3.09Å; R101-E127 IonicContact CZ-OE1 3.83Å; R101-E127 IonicContact CZ-OE2 3.78Å; R101-E127 IonicContact NH1-OE1 2.79Å; R101-E127 PolarHBondContact NH1-OE1 3.36Å; R101-E127 IonicContact NH1-OE2 2.62Å; R101-E127 PolarHBondContact NH1-OE2 2.9Å; R101-E127 IonicContact NH2-OE2 3.73Å
102	I	98.1	Very high	96.1	Very high	11 Å²	11	66.7 Å²	66.7	6%	0.056	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-100.4	126.7	177.3	-60.4	172.8	0	0	0	108.2	I25 V27 L46 P83 V85 Y104 F111 F113 F115	I25-I102 HydrophobicContact CD1-CB 4.49Å; I25-I102 HydrophobicContact CD1-CD1 3.55Å; I25-I102 HydrophobicContact CD1-CG2 3.8Å; V27-I102 HydrophobicContact CB-CD1 4.02Å; V27-I102 HydrophobicContact CG2-CD1 3.73Å; L46-I102 HydrophobicContact CD1-CD1 4.18Å; P83-I102 HydrophobicContact CB-CD1 4.36Å; P83-I102 HydrophobicContact CG-CB 4.18Å; P83-I102 HydrophobicContact CG-CG2 4.47Å; P83-I102 WeakPolarHBondContact O-CB 3.27Å; P83-I102 PolarHBondContact O-N 2.67Å; V85-I102 HydrophobicContact CG2-CD1 4.16Å; I102-Y104 PolarHBondContact O-N 2.7Å; I102-F111 HydrophobicContact CG2-CE2 4.36Å; I102-F113 HydrophobicContact CB-CD1 4.32Å; I102-F113 HydrophobicContact CD1-CD1 4.38Å; I102-F113 HydrophobicContact CG1-CD1 3.99Å; I102-F113 HydrophobicContact CG1-CE1 4.33Å; I102-F113 HydrophobicContact CG2-CB 3.8Å; I102-F113 HydrophobicContact CG2-CD1 3.63Å; I102-F113 HydrophobicContact CG2-CD2 3.96Å; I102-F113 HydrophobicContact CG2-CE1 4.17Å; I102-F113 HydrophobicContact CG2-CE2 4.47Å; I102-F113 HydrophobicContact CG2-CG 3.51Å; I102-F115 HydrophobicContact CG1-CZ 4.14Å
103	P	96.5	Very high	96.2	Very high	94 Å²	94	65.1 Å²	65.1	61%	0.61	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-68	126.6	174.7	28.6	-33.7	0	0	0	110.3	F113	P103-F113 HydrophobicContact CG-CD2 4.34Å; P103-F113 HydrophobicContact CG-CE2 3.6Å; P103-F113 HydrophobicContact CG-CZ 4Å
104	Y	95.7	Very high	96.3	Very high	41 Å²	41	66 Å²	66	16%	0.161	34%	0.344	C	S	.	.			trans	-146.9	141.1	175.9	177.8	-127.1	0	0	0	110	Q23 I81 I102 G106 E108 F111	Q23-Y104 PolarHBondContact NE2-OH 3.45Å; I81-Y104 HydrophobicContact CD1-CE1 4.37Å; I81-Y104 HydrophobicContact CG1-CD1 3.75Å; I81-Y104 HydrophobicContact CG1-CE1 3.49Å; I81-Y104 VanDerWaalsContact CG1-CE1 3.49Å; I81-Y104 VanDerWaalsContact O-CD1 3.27Å; I81-Y104 WeakPolarHBondContact O-CD1 3.36Å; I102-Y104 PolarHBondContact O-N 2.7Å; Y104-G106 VanDerWaalsContact CZ-CA 3.42Å; Y104-E108 VanDerWaalsContact CE2-O 3.26Å; Y104-E108 WeakPolarHBondContact CE2-O 3.36Å; Y104-E108 PolarHBondContact OH-O 3.48Å; Y104-F111 HydrophobicContact CD1-CE1 4.17Å; Y104-F111 HydrophobicContact CD1-CZ 4.12Å; Y104-F111 AromaticContact CD2-CD1 3.83Å; Y104-F111 HydrophobicContact CD2-CD1 3.83Å; Y104-F111 HydrophobicContact CD2-CD2 4.26Å; Y104-F111 AromaticContact CD2-CE1 3.33Å; Y104-F111 HydrophobicContact CD2-CE1 3.33Å; Y104-F111 AromaticContact CD2-CE2 3.8Å; Y104-F111 HydrophobicContact CD2-CE2 3.8Å; Y104-F111 HydrophobicContact CD2-CG 4.27Å; Y104-F111 AromaticContact CD2-CZ 3.3Å; Y104-F111 HydrophobicContact CD2-CZ 3.3Å; Y104-F111 HydrophobicContact CE1-CE1 4.12Å; Y104-F111 AromaticContact CE2-CD1 3.55Å; Y104-F111 HydrophobicContact CE2-CD1 3.55Å; Y104-F111 AromaticContact CE2-CE1 3.3Å; Y104-F111 HydrophobicContact CE2-CE1 3.3Å; Y104-F111 HydrophobicContact CE2-CG 4.28Å; Y104-F111 AromaticContact CE2-CZ 3.82Å; Y104-F111 HydrophobicContact CE2-CZ 3.82Å; Y104-F111 AromaticContact CG-CE1 3.8Å; Y104-F111 HydrophobicContact CG-CE1 3.8Å; Y104-F111 HydrophobicContact CG-CE2 4.18Å; Y104-F111 AromaticContact CG-CZ 3.48Å; Y104-F111 HydrophobicContact CG-CZ 3.48Å; Y104-F111 VanDerWaalsContact CG-CZ 3.48Å; Y104-F111 AromaticContact CZ-CE1 3.71Å
105	D	91.6	Very high	96.4	Very high	117 Å²	117	64.4 Å²	64.4	63%	0.626	33%	0.334	S	S	*	.			trans	-109.7	2.4	-173.7	68.1	-1.1	0	0	0	113.6	V107	D105-V107 HydrophobicContact CB-CG2 4.42Å; D105-V107 PolarHBondContact O-N 3.37Å; D105-V107 WeakPolarHBondContact OD1-CB 3.28Å; D105-V107 WeakPolarHBondContact OD1-CG2 3.17Å; D105-V107 PolarHBondContact OD1-N 2.5Å; D105-V107 WeakPolarHBondContact OD2-CG2 3.4Å
106	G	89.9	Confident	96.4	Very high	25 Å²	25	68.5 Å²	68.5	26%	0.258	36%	0.36	S	S	.	.	S	Bend	trans	75.2	4.2	179.7	0	0	0	0	0	115.2	S80 Y104	S80-G106 VanDerWaalsContact CB-CA 3.45Å; Y104-G106 VanDerWaalsContact CZ-CA 3.42Å
107	V	89.6	Confident	96.3	Very high	109 Å²	109	74.3 Å²	74.3	66%	0.661	39%	0.389	S	S	*	.			trans	-82.7	-51.7	-175.6	179.7	0	0	0	0	111.2	D105	D105-V107 HydrophobicContact CB-CG2 4.42Å; D105-V107 PolarHBondContact O-N 3.37Å; D105-V107 WeakPolarHBondContact OD1-CB 3.28Å; D105-V107 WeakPolarHBondContact OD1-CG2 3.17Å; D105-V107 PolarHBondContact OD1-N 2.5Å; D105-V107 WeakPolarHBondContact OD2-CG2 3.4Å
108	E	93.4	Very high	96.3	Very high	120 Å²	120	75 Å²	75	56%	0.561	40%	0.401	S	S	*	.			trans	-90.4	112.7	-177.7	-68.5	-170.1	174.3	0	0	111.9	Y104 N110 F111	Y104-E108 VanDerWaalsContact CE2-O 3.26Å; Y104-E108 WeakPolarHBondContact CE2-O 3.36Å; Y104-E108 PolarHBondContact OH-O 3.48Å; E108-N110 PolarHBondContact O-N 2.97Å; E108-F111 HydrophobicContact CB-CB 4.22Å
109	K	93.5	Very high	96.3	Very high	102 Å²	102	75.6 Å²	75.6	44%	0.443	40%	0.403	S	S	.	.	S	Bend	trans	-64.6	-22.4	178.7	-64.7	-167.9	177	-168.2	0	114.6	Q21 Q23 C24	Q21-K109 VanDerWaalsContact OE1-NZ 3.08Å; Q23-K109 CarbonylContact C-O 3.58Å; Q23-K109 WeakPolarHBondContact CA-O 3.3Å; C24-K109 PolarHBondContact N-O 3.45Å
110	N	97.1	Very high	96.3	Very high	119 Å²	119	75.7 Å²	75.7	64%	0.636	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	116.3	177.2	-60.8	-78.2	0	0	0	107.7	C24 E108	C24-N110 WeakPolarHBondContact CB-OD1 3.43Å; C24-N110 WeakPolarHBondContact O-CA 3.39Å; E108-N110 PolarHBondContact O-N 2.97Å
111	F	97.2	Very high	96.3	Very high	23 Å²	23	74.4 Å²	74.4	10%	0.101	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	161.6	-176.9	68.6	-76.4	0	0	0	111.5	C24 I25 A26 I81 P83 I102 Y104 E108	C24-F111 WeakPolarHBondContact O-CD1 3.42Å; C24-F111 PolarHBondContact O-N 3.32Å; C24-F111 VanDerWaalsContact O-N 3.14Å; I25-F111 VanDerWaalsContact CA-O 3.29Å; I25-F111 WeakPolarHBondContact CA-O 3.47Å; I25-F111 HydrophobicContact CB-CD1 4.38Å; I25-F111 HydrophobicContact CB-CE1 3.89Å; I25-F111 HydrophobicContact CB-CE2 4.26Å; I25-F111 HydrophobicContact CB-CZ 3.84Å; I25-F111 HydrophobicContact CD1-CD2 4.18Å; I25-F111 HydrophobicContact CD1-CE1 4.41Å; I25-F111 HydrophobicContact CD1-CE2 3.36Å; I25-F111 HydrophobicContact CD1-CZ 3.5Å; I25-F111 HydrophobicContact CG1-CD2 4.03Å; I25-F111 HydrophobicContact CG1-CE1 4.19Å; I25-F111 HydrophobicContact CG1-CE2 3.64Å; I25-F111 HydrophobicContact CG1-CG 4.48Å; I25-F111 HydrophobicContact CG1-CZ 3.73Å; A26-F111 PolarHBondContact N-O 2.02Å; A26-F111 VanDerWaalsContact N-O 3.1Å; I81-F111 HydrophobicContact CD1-CE1 4.41Å; P83-F111 HydrophobicContact CG-CZ 4.19Å; I102-F111 HydrophobicContact CG2-CE2 4.36Å; Y104-F111 HydrophobicContact CD1-CE1 4.17Å; Y104-F111 HydrophobicContact CD1-CZ 4.12Å; Y104-F111 AromaticContact CD2-CD1 3.83Å; Y104-F111 HydrophobicContact CD2-CD1 3.83Å; Y104-F111 HydrophobicContact CD2-CD2 4.26Å; Y104-F111 AromaticContact CD2-CE1 3.33Å; Y104-F111 HydrophobicContact CD2-CE1 3.33Å; Y104-F111 AromaticContact CD2-CE2 3.8Å; Y104-F111 HydrophobicContact CD2-CE2 3.8Å; Y104-F111 HydrophobicContact CD2-CG 4.27Å; Y104-F111 AromaticContact CD2-CZ 3.3Å; Y104-F111 HydrophobicContact CD2-CZ 3.3Å; Y104-F111 HydrophobicContact CE1-CE1 4.12Å; Y104-F111 AromaticContact CE2-CD1 3.55Å; Y104-F111 HydrophobicContact CE2-CD1 3.55Å; Y104-F111 AromaticContact CE2-CE1 3.3Å; Y104-F111 HydrophobicContact CE2-CE1 3.3Å; Y104-F111 HydrophobicContact CE2-CG 4.28Å; Y104-F111 AromaticContact CE2-CZ 3.82Å; Y104-F111 HydrophobicContact CE2-CZ 3.82Å; Y104-F111 AromaticContact CG-CE1 3.8Å; Y104-F111 HydrophobicContact CG-CE1 3.8Å; Y104-F111 HydrophobicContact CG-CE2 4.18Å; Y104-F111 AromaticContact CG-CZ 3.48Å; Y104-F111 HydrophobicContact CG-CZ 3.48Å; Y104-F111 VanDerWaalsContact CG-CZ 3.48Å; Y104-F111 AromaticContact CZ-CE1 3.71Å; E108-F111 HydrophobicContact CB-CB 4.22Å
112	N	98.1	Very high	96.3	Very high	133 Å²	133	69.6 Å²	69.6	71%	0.711	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.4	176.4	-63.1	-25.1	0	0	0	108.8	A26	A26-N112 WeakPolarHBondContact CB-OD1 3.18Å; A26-N112 CarbonylContact O-C 3.56Å; A26-N112 VanDerWaalsContact O-CA 3.3Å; A26-N112 WeakPolarHBondContact O-CA 3Å
113	F	98.4	Very high	96.3	Very high	40 Å²	40	74.8 Å²	74.8	18%	0.175	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133	172.6	-173.7	-104.2	0	0	0	110.3	I25 A26 V27 A28 I102 P103 F115	I25-F113 HydrophobicContact CD1-CB 4.06Å; A26-F113 PolarHBondContact O-N 2.62Å; V27-F113 CarbonylContact C-O 3.51Å; V27-F113 VanDerWaalsContact CA-O 3.24Å; V27-F113 WeakPolarHBondContact CA-O 3.11Å; V27-F113 HydrophobicContact CG2-CD1 4.16Å; A28-F113 PolarHBondContact N-O 2.79Å; I102-F113 HydrophobicContact CB-CD1 4.32Å; I102-F113 HydrophobicContact CD1-CD1 4.38Å; I102-F113 HydrophobicContact CG1-CD1 3.99Å; I102-F113 HydrophobicContact CG1-CE1 4.33Å; I102-F113 HydrophobicContact CG2-CB 3.8Å; I102-F113 HydrophobicContact CG2-CD1 3.63Å; I102-F113 HydrophobicContact CG2-CD2 3.96Å; I102-F113 HydrophobicContact CG2-CE1 4.17Å; I102-F113 HydrophobicContact CG2-CE2 4.47Å; I102-F113 HydrophobicContact CG2-CG 3.51Å; P103-F113 HydrophobicContact CG-CD2 4.34Å; P103-F113 HydrophobicContact CG-CE2 3.6Å; P103-F113 HydrophobicContact CG-CZ 4Å; F113-F115 HydrophobicContact CD1-CD2 4.37Å; F113-F115 HydrophobicContact CD1-CE2 4.32Å; F113-F115 HydrophobicContact CD1-CZ 4.48Å; F113-F115 AromaticContact CE1-CD1 3.76Å; F113-F115 HydrophobicContact CE1-CD1 3.76Å; F113-F115 HydrophobicContact CE1-CD2 4.09Å; F113-F115 AromaticContact CE1-CE1 3.78Å; F113-F115 HydrophobicContact CE1-CE1 3.78Å; F113-F115 HydrophobicContact CE1-CE2 4.12Å; F113-F115 AromaticContact CE1-CG 3.91Å; F113-F115 HydrophobicContact CE1-CG 3.91Å; F113-F115 AromaticContact CE1-CZ 3.97Å; F113-F115 HydrophobicContact CE1-CZ 3.97Å; F113-F115 HydrophobicContact CZ-CD1 4.45Å
114	T	98.6	Very high	96.3	Very high	92 Å²	92	79.2 Å²	79.2	56%	0.564	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.4	171	-62.8	0	0	0	0	107.9	A28 P116	A28-T114 HydrophobicContact CB-CG2 4.37Å; A28-T114 WeakPolarHBondContact O-CA 3.38Å; T114-P116 WeakPolarHBondContact O-CD 3.49Å; T114-P116 VanDerWaalsContact O-N 3.13Å
115	F	98.4	Very high	96.3	Very high	29 Å²	29	79 Å²	79	13%	0.127	42%	0.422	C	S	.	.			trans	-58.1	119	174.8	-76.9	-82.6	0	0	0	108.8	V27 A28 F68 V85 L100 I102 F113 M117 I119	V27-F115 HydrophobicContact CG2-CD2 4.15Å; V27-F115 HydrophobicContact CG2-CE2 3.75Å; A28-F115 PolarHBondContact O-N 2.9Å; F68-F115 AromaticContact CZ-CD2 3.88Å; F68-F115 HydrophobicContact CZ-CD2 3.88Å; F68-F115 HydrophobicContact CZ-CE2 4.04Å; V85-F115 HydrophobicContact CB-CE2 4.36Å; V85-F115 HydrophobicContact CG2-CE2 4.07Å; L100-F115 HydrophobicContact CB-CE1 3.71Å; L100-F115 HydrophobicContact CB-CZ 3.61Å; L100-F115 HydrophobicContact CD1-CD1 4.42Å; L100-F115 HydrophobicContact CD1-CE1 4Å; L100-F115 HydrophobicContact CD1-CZ 4.12Å; L100-F115 HydrophobicContact CG-CE1 4.47Å; I102-F115 HydrophobicContact CG1-CZ 4.14Å; F113-F115 HydrophobicContact CD1-CD2 4.37Å; F113-F115 HydrophobicContact CD1-CE2 4.32Å; F113-F115 HydrophobicContact CD1-CZ 4.48Å; F113-F115 AromaticContact CE1-CD1 3.76Å; F113-F115 HydrophobicContact CE1-CD1 3.76Å; F113-F115 HydrophobicContact CE1-CD2 4.09Å; F113-F115 AromaticContact CE1-CE1 3.78Å; F113-F115 HydrophobicContact CE1-CE1 3.78Å; F113-F115 HydrophobicContact CE1-CE2 4.12Å; F113-F115 AromaticContact CE1-CG 3.91Å; F113-F115 HydrophobicContact CE1-CG 3.91Å; F113-F115 AromaticContact CE1-CZ 3.97Å; F113-F115 HydrophobicContact CE1-CZ 3.97Å; F113-F115 HydrophobicContact CZ-CD1 4.45Å; F115-M117 PolarHBondContact O-N 3.48Å; F115-I119 HydrophobicContact CB-CD1 4.21Å; F115-I119 HydrophobicContact CD1-CD1 4.44Å; F115-I119 HydrophobicContact CD2-CD1 4.09Å; F115-I119 HydrophobicContact CG-CD1 3.99Å
116	P	97.4	Very high	96.6	Very high	119 Å²	119	80.6 Å²	80.6	77%	0.773	44%	0.436	S	S	*	.	S	Bend	trans	-73	-21.1	-172.5	27.8	-35	0	0	0	112.6	T114	T114-P116 WeakPolarHBondContact O-CD 3.49Å; T114-P116 VanDerWaalsContact O-N 3.13Å
117	M	96.1	Very high	97	Very high	152 Å²	152	82.9 Å²	82.9	75%	0.749	44%	0.439	S	S	*	.	S	Bend	trans	-109.6	151.5	179.8	-57.6	-170.1	-59	0	0	110.3	F115 I119	F115-M117 PolarHBondContact O-N 3.48Å; M117-I119 PolarHBondContact O-N 2.74Å
118	V	98.3	Very high	97.4	Very high	76 Å²	76	79.6 Å²	79.6	46%	0.461	42%	0.417	S	S	.	.			trans	-67.6	127.7	169.2	177.3	0	0	0	0	109	D30 R32 D120	D30-V118 HydrophobicContact CB-CG2 4.18Å; R32-V118 HydrophobicContact CB-CG1 3.98Å; R32-V118 HydrophobicContact CG-CG1 3.29Å; V118-D120 PolarHBondContact O-N 3.23Å
119	I	98.6	Very high	97.7	Very high	11 Å²	11	77.1 Å²	77.1	6%	0.056	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	98.6	177.3	-59.7	154.1	0	0	0	107.9	D30 V31 R32 F68 L87 L100 F115 M117 L121	D30-I119 PolarHBondContact O-N 2.84Å; V31-I119 CarbonylContact C-O 3.57Å; V31-I119 VanDerWaalsContact CA-O 3.31Å; V31-I119 WeakPolarHBondContact CA-O 3.36Å; V31-I119 HydrophobicContact CG2-CB 4.4Å; V31-I119 HydrophobicContact CG2-CD1 4.4Å; R32-I119 PolarHBondContact N-O 3.08Å; F68-I119 HydrophobicContact CE1-CD1 3.93Å; F68-I119 HydrophobicContact CZ-CD1 4.3Å; L87-I119 HydrophobicContact CD2-CG2 4.41Å; L100-I119 HydrophobicContact CD1-CB 4.43Å; L100-I119 HydrophobicContact CD1-CD1 3.43Å; L100-I119 VanDerWaalsContact CD1-CD1 3.43Å; L100-I119 HydrophobicContact CD1-CG1 3.65Å; L100-I119 HydrophobicContact CD1-CG2 3.88Å; F115-I119 HydrophobicContact CB-CD1 4.21Å; F115-I119 HydrophobicContact CD1-CD1 4.44Å; F115-I119 HydrophobicContact CD2-CD1 4.09Å; F115-I119 HydrophobicContact CG-CD1 3.99Å; M117-I119 PolarHBondContact O-N 2.74Å; I119-L121 HydrophobicContact CG2-CD2 4.19Å
120	D	98.6	Very high	97.9	Very high	20 Å²	20	77.5 Å²	77.5	11%	0.107	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	111.8	172.9	-161.9	-26.5	0	0	0	111	C33 N34 G35 V118 A122 E123 H125	C33-D120 WeakPolarHBondContact CA-OD1 3.45Å; N34-D120 WeakPolarHBondContact CA-OD2 3.47Å; N34-D120 PolarHBondContact N-OD1 3.09Å; N34-D120 PolarHBondContact N-OD2 2.87Å; G35-D120 PolarHBondContact N-OD2 2.8Å; V118-D120 PolarHBondContact O-N 3.23Å; D120-A122 PolarHBondContact O-N 3.48Å; D120-A122 VanDerWaalsContact O-N 3.16Å; D120-A122 VanDerWaalsContact OD1-CB 3.31Å; D120-A122 WeakPolarHBondContact OD1-CB 3.33Å; D120-A122 PolarHBondContact OD1-N 3.25Å; D120-E123 HydrophobicContact CB-CG 4.03Å; D120-E123 PolarHBondContact O-N 3.03Å; D120-E123 VanDerWaalsContact O-N 3.13Å; D120-H125 PolarHBondContact O-NE2 2.95Å
121	L	98.6	Very high	97.9	Very high	1 Å²	1	75 Å²	75	1%	0.005	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-5.1	-179.7	-63	174.4	0	0	0	113.7	V31 R32 V42 L87 H89 C91 K92 I119	V31-L121 HydrophobicContact CG1-CD1 3.42Å; V31-L121 VanDerWaalsContact CG1-CD1 3.42Å; V31-L121 HydrophobicContact CG1-CD2 4.35Å; V31-L121 HydrophobicContact CG1-CG 3.68Å; R32-L121 WeakPolarHBondContact O-CB 3.25Å; R32-L121 WeakPolarHBondContact O-CG 3.47Å; R32-L121 PolarHBondContact O-N 3.36Å; V42-L121 HydrophobicContact CG1-CD1 4.04Å; V42-L121 HydrophobicContact CG2-CD1 3.71Å; L87-L121 HydrophobicContact CB-CD2 4.21Å; L87-L121 HydrophobicContact CD2-CD2 4.29Å; H89-L121 HydrophobicContact CB-CD1 3.68Å; H89-L121 PolarHBondContact CE1-O 3.44Å; C91-L121 HydrophobicContact CB-CB 3.73Å; K92-L121 VanDerWaalsContact CE-O 3.3Å; K92-L121 WeakPolarHBondContact CE-O 3.09Å; I119-L121 HydrophobicContact CG2-CD2 4.19Å
122	A	98	Very high	97.8	Very high	28 Å²	28	78.1 Å²	78.1	23%	0.231	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-22.9	171.2	0	0	0	0	0	112.9	N34 K92 D120	N34-A122 HydrophobicContact CB-CB 4.3Å; N34-A122 VanDerWaalsContact CG-CB 3.48Å; N34-A122 VanDerWaalsContact OD1-CB 3.27Å; N34-A122 WeakPolarHBondContact OD1-CB 3.27Å; K92-A122 WeakPolarHBondContact CE-O 3.39Å; D120-A122 PolarHBondContact O-N 3.48Å; D120-A122 VanDerWaalsContact O-N 3.16Å; D120-A122 VanDerWaalsContact OD1-CB 3.31Å; D120-A122 WeakPolarHBondContact OD1-CB 3.33Å; D120-A122 PolarHBondContact OD1-N 3.25Å
123	E	97.8	Very high	97.6	Very high	120 Å²	120	73.6 Å²	73.6	56%	0.561	40%	0.404	S	S	*	.	S	Bend	trans	-75.1	164.9	178.1	-65.7	179	174.3	0	0	111.5	K92 D120 H125	K92-E123 WeakPolarHBondContact CE-O 3.36Å; K92-E123 PolarHBondContact NZ-O 3.15Å; D120-E123 HydrophobicContact CB-CG 4.03Å; D120-E123 PolarHBondContact O-N 3.03Å; D120-E123 VanDerWaalsContact O-N 3.13Å; E123-H125 PolarHBondContact O-CD2 3.32Å; E123-H125 VanDerWaalsContact O-CD2 3.24Å
124	E	96.5	Very high	97.2	Very high	186 Å²	186	78.6 Å²	78.6	87%	0.869	43%	0.428	S	S	*	.			trans	-77	130.1	171.9	-68.1	-173.2	169.5	0	0	110.2
125	H	97.6	Very high	96.5	Very high	38 Å²	38	76.3 Å²	76.3	18%	0.176	41%	0.413	C	S	.	.			trans	-111	143.4	174.3	-65.4	-95	0	0	0	109.5	V98 D120 E123 E127 E128	V98-H125 HydrophobicContact CG1-CB 3.72Å; V98-H125 HydrophobicContact CG2-CB 4.1Å; D120-H125 PolarHBondContact O-NE2 2.95Å; E123-H125 PolarHBondContact O-CD2 3.32Å; E123-H125 VanDerWaalsContact O-CD2 3.24Å; H125-E127 PolarHBondContact O-N 3.42Å; H125-E128 HydrophobicContact CB-CB 4.26Å; H125-E128 IonicContact CD2-OE2 3.93Å
126	T	97.4	Very high	95.8	Very high	150 Å²	150	78.5 Å²	78.5	92%	0.92	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-37.8	-177.8	-53.6	0	0	0	0	112.5
127	E	98	Very high	94.9	Very high	72 Å²	72	82.2 Å²	82.2	34%	0.336	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	72.5	-179.4	-65.4	-179.6	-123.3	0	0	110.8	V98 V99 R101 H125	V98-E127 CarbonylContact C-O 3.6Å; V98-E127 WeakPolarHBondContact CA-O 3.43Å; V99-E127 HydrophobicContact CB-CB 3.91Å; V99-E127 PolarHBondContact N-O 3.04Å; R101-E127 IonicContact CZ-OE1 3.83Å; R101-E127 IonicContact CZ-OE2 3.78Å; R101-E127 IonicContact NH1-OE1 2.79Å; R101-E127 PolarHBondContact NH1-OE1 3.36Å; R101-E127 IonicContact NH1-OE2 2.62Å; R101-E127 PolarHBondContact NH1-OE2 2.9Å; R101-E127 IonicContact NH2-OE2 3.73Å; H125-E127 PolarHBondContact O-N 3.42Å
128	E	98.4	Very high	94.1	Very high	41 Å²	41	80.6 Å²	80.6	19%	0.192	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132	176.5	-172.6	179.9	157.7	0	0	111.2	K92 K96 R97 V98 H125	K92-E128 WeakPolarHBondContact CD-OE1 3.29Å; K92-E128 IonicContact NZ-OE1 3.48Å; K92-E128 PolarHBondContact NZ-OE1 2.72Å; K92-E128 IonicContact NZ-OE2 3.37Å; K92-E128 PolarHBondContact NZ-OE2 3.35Å; K96-E128 HydrophobicContact CB-CG 4.39Å; K96-E128 HydrophobicContact CD-CG 4.22Å; K96-E128 WeakPolarHBondContact CD-OE1 3.36Å; K96-E128 WeakPolarHBondContact CE-OE1 3.48Å; K96-E128 WeakPolarHBondContact CG-OE1 3.41Å; R97-E128 WeakPolarHBondContact O-CA 3.3Å; V98-E128 HydrophobicContact CG2-CB 4.2Å; V98-E128 HydrophobicContact CG2-CG 3.86Å; H125-E128 HydrophobicContact CB-CB 4.26Å; H125-E128 IonicContact CD2-OE2 3.93Å
129	V	98.1	Very high	93.2	Very high	68 Å²	68	81.5 Å²	81.5	41%	0.412	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	152.6	177.1	-64.3	0	0	0	0	111.3	K96 R97 H131	K96-V129 WeakPolarHBondContact CA-O 3.28Å; R97-V129 HydrophobicContact CB-CG2 4.26Å; R97-V129 PolarHBondContact N-O 2.92Å; R97-V129 PolarHBondContact O-N 3.27Å; V129-H131 HydrophobicContact CG2-CB 4.34Å; V129-H131 PolarHBondContact O-N 2.99Å
130	D	98.1	Very high	91.7	Very high	110 Å²	110	90.1 Å²	90.1	59%	0.588	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	121.8	163	-74.4	-51.2	0	0	0	109.3	N94 K96	N94-D130 PolarHBondContact ND2-OD1 3.29Å; K96-D130 WeakPolarHBondContact CD-OD1 3.45Å; K96-D130 VanDerWaalsContact CE-OD1 3.32Å; K96-D130 WeakPolarHBondContact CE-OD1 3.17Å; K96-D130 IonicContact NZ-OD1 3.29Å; K96-D130 PolarHBondContact NZ-OD1 2.94Å; K96-D130 IonicContact NZ-OD2 3.57Å; K96-D130 PolarHBondContact NZ-OD2 3.36Å
131	H	97.6	Very high	89.9	Confident	67 Å²	67	96.7 Å²	96.7	31%	0.31	53%	0.527	S	S	.	.			trans	-149.8	114.4	-176.1	-164.6	94.8	0	0	0	110.1	Y88 S95 R97 V129	Y88-H131 AromaticContact CD1-CD2 3.7Å; Y88-H131 AromaticContact CE1-CD2 3.4Å; Y88-H131 VanDerWaalsContact CE1-CD2 3.4Å; Y88-H131 WeakPolarHBondContact CE1-CD2 3.06Å; Y88-H131 AromaticContact CE1-NE2 3.58Å; S95-H131 CarbonylContact C-O 3.58Å; S95-H131 WeakPolarHBondContact CB-O 3.38Å; S95-H131 PolarHBondContact O-N 2.94Å; R97-H131 HydrophobicContact CB-CB 3.58Å; V129-H131 HydrophobicContact CG2-CB 4.34Å; V129-H131 PolarHBondContact O-N 2.99Å
132	A	95.2	Very high	87.6	Confident	87 Å²	87	99.1 Å²	99.1	72%	0.719	55%	0.553	S	S	*	*			trans	-71.9	138.2	173.3	0	0	0	0	0	110.2
133	Y	93.6	Very high	85.1	Confident	38 Å²	38	107.3 Å²	107.3	15%	0.149	58%	0.583	C	S	.	*			trans	-143.8	156.1	176	65.7	-76.4	0	0	0	109.2	Y88 H89 K90 V135	Y88-Y133 HydrophobicContact CD1-CD1 4.31Å; Y88-Y133 HydrophobicContact CD1-CG 4.12Å; Y88-Y133 HydrophobicContact CG-CG 4.24Å; H89-Y133 WeakPolarHBondContact CA-OH 3.42Å; H89-Y133 PolarHBondContact N-OH 3.34Å; H89-Y133 WeakPolarHBondContact O-CE1 3.48Å; H89-Y133 PolarHBondContact O-OH 2.92Å; K90-Y133 HydrophobicContact CG-CE1 4.35Å; K90-Y133 PolarHBondContact N-OH 3.03Å; Y133-V135 HydrophobicContact CD2-CG2 3.91Å; Y133-V135 HydrophobicContact CE2-CG2 3.51Å
134	H	89.7	Confident	82.7	Confident	146 Å²	146	109.6 Å²	109.6	68%	0.676	59%	0.594	S	S	*	*			trans	-106.3	129.4	178	-175.8	71.5	0	0	0	109.6
135	V	85.3	Confident	80.1	Confident	43 Å²	43	107 Å²	107	26%	0.261	59%	0.591	S	S	.	*			trans	-102.2	114.9	165.9	-179.2	0	0	0	0	106.4	P41 Y61 Y133 K137	P41-V135 HydrophobicContact CB-CG1 3.97Å; P41-V135 HydrophobicContact CB-CG2 4.33Å; P41-V135 HydrophobicContact CG-CG1 4.19Å; Y61-V135 HydrophobicContact CE1-CG1 3.85Å; Y61-V135 HydrophobicContact CE1-CG2 4.38Å; Y133-V135 HydrophobicContact CD2-CG2 3.91Å; Y133-V135 HydrophobicContact CE2-CG2 3.51Å; V135-K137 PolarHBondContact O-N 3.39Å
136	P	82.8	Confident	77.6	Confident	75 Å²	75	110 Å²	110	49%	0.487	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-55.2	136.3	173.9	-23.1	33.8	0	0	0	110	Y61 C138	Y61-P136 VanDerWaalsContact OH-CD 3.3Å; Y61-P136 WeakPolarHBondContact OH-CD 3.41Å; P136-C138 PolarHBondContact O-N 2.89Å
137	K	79.4	Confident	74.8	Confident	197 Å²	197	112.5 Å²	112.5	86%	0.857	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-67.1	134.7	169.2	-64.9	-175	-179.4	-178.7	0	107.8	V135 A139	V135-K137 PolarHBondContact O-N 3.39Å; K137-A139 PolarHBondContact O-N 3.39Å
138	C	78.3	Confident	72.6	Confident	119 Å²	119	120.3 Å²	120.3	80%	0.804	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-56.7	139.8	166.4	-63.4	0	0	0	0	108.3	P136 E140	P136-C138 PolarHBondContact O-N 2.89Å; C138-E140 PolarHBondContact O-N 2.86Å
139	A	79.5	Confident	71.3	Confident	95 Å²	95	124.3 Å²	124.3	79%	0.785	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-60.1	123.1	165.9	0	0	0	0	0	107.2	K137 D141	K137-A139 PolarHBondContact O-N 3.39Å; A139-D141 PolarHBondContact O-N 3.42Å
140	E	67	Low	69.9	Low	191 Å²	191	127.2 Å²	127.2	89%	0.893	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-63.9	127.8	165.7	-62.7	-157.3	177.2	0	0	106.8	C138	C138-E140 PolarHBondContact O-N 2.86Å
141	D	60.5	Low	68.3	Low	158 Å²	158	128.2 Å²	128.2	85%	0.845	70%	0.696	S	S	*	*			trans	-9.1	125	-177	-166	27	0	0	0	116.3	A139 K143	A139-D141 PolarHBondContact O-N 3.42Å; D141-K143 PolarHBondContact O-N 3.33Å
142	G	51.3	Low	66.6	Low	53 Å²	53	131.8 Å²	131.8	55%	0.546	72%	0.719	S	S	.	*			trans	-50	134.2	174.7	0	0	0	0	0	111.1	E144	G142-E144 PolarHBondContact O-N 2.97Å
143	K	45	Very low	64.8	Low	199 Å²	199	134.6 Å²	134.6	87%	0.865	72%	0.719	S	S	*	*			trans	-57.5	97.9	140	-79.7	-177.7	176.8	179.2	0	106.2	D141 T145	D141-K143 PolarHBondContact O-N 3.33Å; K143-T145 PolarHBondContact O-N 2.94Å
144	E	47.2	Very low	62.9	Low	169 Å²	169	141 Å²	141	79%	0.79	76%	0.756	S	S	*	*			trans	-47.6	103.6	171.6	-158.5	178.6	172.4	0	0	108.4	G142 T146	G142-E144 PolarHBondContact O-N 2.97Å; E144-T146 WeakPolarHBondContact CG-OG1 3.46Å; E144-T146 PolarHBondContact O-N 3.11Å
145	T	41.6	Very low	61	Low	131 Å²	131	140.6 Å²	140.6	80%	0.804	76%	0.762	S	S	*	*			trans	-93.5	64.4	172.6	36.2	0	0	0	0	108.2	K143 K147	K143-T145 PolarHBondContact O-N 2.94Å; T145-K147 PolarHBondContact O-N 3.42Å
146	T	44.5	Very low	59.1	Low	102 Å²	102	148.2 Å²	148.2	63%	0.626	80%	0.801	S	S	*	*			trans	-76.7	82.1	162.8	-46.2	0	0	0	0	107.2	E144 L148	E144-T146 WeakPolarHBondContact CG-OG1 3.46Å; E144-T146 PolarHBondContact O-N 3.11Å; T146-L148 PolarHBondContact O-N 2.89Å
147	K	39.2	Very low	57.1	Low	201 Å²	201	154.3 Å²	154.3	87%	0.874	83%	0.827	S	S	*	*			trans	-77.9	108.5	159.9	-91.3	-173.9	175.1	-178.2	0	107.4	T145	T145-K147 PolarHBondContact O-N 3.42Å
148	L	51.7	Low	55.1	Low	236 Å²	236	150.4 Å²	150.4	100%	1.236	82%	0.824	S	S	*	*			trans	-109.1	0	149.8	-100.2	152.7	0	0	0	107.1	T146	T146-L148 PolarHBondContact O-N 2.89Å

Retrieved 148 of 148 residues in 28 ms (Link to these results)

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