A0A075B606_MOUSE Loading...

T cell receptor alpha variable 13D-1

AlphaFold DB , UniProt , Accession A0A075B606, Species MOUSE (Mus musculus, Mouse), Gene Trav13d-1, Length 110 aa.

						>A0A075B606_MOUSE|A0A075B606|Trav13d-1
MKRLLCSLLGLLCTQVCWVKGQQVQQSPTSLVLQEGENAELQCNFSTSLNSMQWFYQRPGGSLVSVFYNPSGTKQSGRLTSTTVIKERRSSLHISSSQITDSGTYLCAME
					

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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	62	Low	76.9	Confident	197 Å²	197	128.5 Å²	128.5	97%	0.97	66%	0.664	S	S	*	*				0	-58.5	0	-58.3	-166.1	-52.7	0	0	113.4	R3 L4 L5	M1-R3 PolarHBondContact O-N 3.14Å; M1-L4 PolarHBondContact O-N 3.45Å; M1-L5 PolarHBondContact O-N 2.85Å; M1-L5 VanDerWaalsContact O-N 3.11Å
2	K	74.3	Confident	76.8	Confident	188 Å²	188	127.2 Å²	127.2	82%	0.817	66%	0.658	S	S	*	*	H	α-helix	trans	-53.8	-44.2	-178.5	-69.3	-177.7	177.4	-179.2	0	114.9	L5 C6	K2-L5 PolarHBondContact O-N 2.73Å; K2-C6 PolarHBondContact O-N 3.19Å; K2-C6 PolarHBondContact O-SG 3.26Å
3	R	77	Confident	76.8	Confident	219 Å²	219	122.5 Å²	122.5	83%	0.826	64%	0.642	S	S	*	*	H	α-helix	trans	-62.4	-44.3	178.8	-67.4	-173	179.7	-146.3	0.7	112.9	M1 L5 C6 S7	M1-R3 PolarHBondContact O-N 3.14Å; R3-L5 VanDerWaalsContact C-N 3.33Å; R3-L5 PolarHBondContact O-N 3.46Å; R3-C6 PolarHBondContact O-N 2.82Å; R3-S7 PolarHBondContact O-N 3.17Å; R3-S7 PolarHBondContact O-OG 3.19Å; R3-S7 VanDerWaalsContact O-OG 3.13Å
4	L	78.6	Confident	76.6	Confident	123 Å²	123	119.6 Å²	119.6	64%	0.644	63%	0.632	S	S	*	*	H	α-helix	trans	-61.2	-40.7	175.4	-86.6	138.1	0	0	0	111.7	M1 S7 L8	M1-L4 PolarHBondContact O-N 3.45Å; L4-S7 PolarHBondContact O-N 3.33Å; L4-L8 WeakPolarHBondContact O-CD1 3.28Å; L4-L8 PolarHBondContact O-N 2.85Å
5	L	77.5	Confident	76.2	Confident	132 Å²	132	121.1 Å²	121.1	69%	0.691	63%	0.634	S	S	*	*	H	α-helix	trans	-64.1	-43.5	177.2	-139.7	95.2	0	0	0	111.8	M1 K2 R3 L8 L9	M1-L5 PolarHBondContact O-N 2.85Å; M1-L5 VanDerWaalsContact O-N 3.11Å; K2-L5 PolarHBondContact O-N 2.73Å; R3-L5 VanDerWaalsContact C-N 3.33Å; R3-L5 PolarHBondContact O-N 3.46Å; L5-L8 PolarHBondContact O-N 3.35Å; L5-L9 VanDerWaalsContact O-CB 3.31Å; L5-L9 WeakPolarHBondContact O-CB 3.46Å; L5-L9 PolarHBondContact O-N 3.03Å
6	C	77.4	Confident	75.8	Confident	89 Å²	89	120.1 Å²	120.1	60%	0.601	63%	0.634	S	S	*	*	H	α-helix	trans	-64.7	-40.5	175.5	-69.5	0	0	0	0	112.4	K2 R3 G10	K2-C6 PolarHBondContact O-N 3.19Å; K2-C6 PolarHBondContact O-SG 3.26Å; R3-C6 PolarHBondContact O-N 2.82Å; C6-G10 PolarHBondContact O-N 3.2Å
7	S	82.2	Confident	75.7	Confident	78 Å²	78	119.6 Å²	119.6	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-65.5	-43.5	176.6	-62.6	0	0	0	0	112	R3 L4 G10 L11	R3-S7 PolarHBondContact O-N 3.17Å; R3-S7 PolarHBondContact O-OG 3.19Å; R3-S7 VanDerWaalsContact O-OG 3.13Å; L4-S7 PolarHBondContact O-N 3.33Å; S7-G10 PolarHBondContact O-N 3.06Å; S7-L11 PolarHBondContact O-N 2.87Å
8	L	80.2	Confident	75.7	Confident	122 Å²	122	124.3 Å²	124.3	64%	0.639	65%	0.649	S	S	*	*	H	α-helix	trans	-63.7	-45.3	174.8	-101.7	101.5	0	0	0	111.9	L4 L5 G10 L11 L12	L4-L8 WeakPolarHBondContact O-CD1 3.28Å; L4-L8 PolarHBondContact O-N 2.85Å; L5-L8 PolarHBondContact O-N 3.35Å; L8-G10 VanDerWaalsContact C-N 3.33Å; L8-G10 PolarHBondContact O-N 2.86Å; L8-L11 PolarHBondContact O-N 2.88Å; L8-L12 WeakPolarHBondContact O-CB 3.34Å; L8-L12 PolarHBondContact O-N 2.82Å
9	L	78.1	Confident	75.6	Confident	107 Å²	107	124.3 Å²	124.3	56%	0.56	65%	0.654	S	S	*	*	H	α-helix	trans	-64.2	-40.1	178.4	-175.1	64.9	0	0	0	111.4	L5 L12 C13	L5-L9 VanDerWaalsContact O-CB 3.31Å; L5-L9 WeakPolarHBondContact O-CB 3.46Å; L5-L9 PolarHBondContact O-N 3.03Å; L9-L12 PolarHBondContact O-N 2.9Å; L9-C13 VanDerWaalsContact O-CB 3.3Å; L9-C13 WeakPolarHBondContact O-CB 3.23Å; L9-C13 PolarHBondContact O-N 2.69Å; L9-C13 PolarHBondContact O-SG 3.11Å; L9-C13 VanDerWaalsContact O-SG 3.39Å
10	G	79.4	Confident	75.6	Confident	35 Å²	35	127.2 Å²	127.2	36%	0.361	66%	0.661	S	S	.	*	H	α-helix	trans	-60.7	-48.1	174	0	0	0	0	0	111.9	C6 S7 L8 C13 T14	C6-G10 PolarHBondContact O-N 3.2Å; S7-G10 PolarHBondContact O-N 3.06Å; L8-G10 VanDerWaalsContact C-N 3.33Å; L8-G10 PolarHBondContact O-N 2.86Å; G10-C13 PolarHBondContact O-N 2.8Å; G10-T14 WeakPolarHBondContact O-CG2 3.37Å; G10-T14 PolarHBondContact O-N 2.8Å
11	L	79.4	Confident	75.8	Confident	123 Å²	123	124.2 Å²	124.2	64%	0.644	66%	0.661	S	S	*	*	H	α-helix	trans	-60.7	-47	175.9	-122.6	98.8	0	0	0	111.4	S7 L8 C13 T14 Q15	S7-L11 PolarHBondContact O-N 2.87Å; L8-L11 PolarHBondContact O-N 2.88Å; L11-C13 PolarHBondContact O-N 2.91Å; L11-T14 PolarHBondContact O-N 2.84Å; L11-T14 PolarHBondContact O-OG1 2.92Å; L11-Q15 WeakPolarHBondContact O-CG 3.36Å; L11-Q15 PolarHBondContact O-N 2.86Å; L11-Q15 VanDerWaalsContact O-N 3.13Å
12	L	75.7	Confident	76.7	Confident	113 Å²	113	120.9 Å²	120.9	59%	0.592	64%	0.643	S	S	*	*	H	α-helix	trans	-62.7	-43.3	179.8	-165.2	72.9	0	0	0	111.5	L8 L9 T14 Q15 V16	L8-L12 WeakPolarHBondContact O-CB 3.34Å; L8-L12 PolarHBondContact O-N 2.82Å; L9-L12 PolarHBondContact O-N 2.9Å; L12-T14 PolarHBondContact O-N 3.27Å; L12-Q15 PolarHBondContact O-N 3.01Å; L12-V16 WeakPolarHBondContact O-CG2 3.47Å; L12-V16 PolarHBondContact O-N 2.81Å
13	C	76.3	Confident	77.4	Confident	67 Å²	67	117.8 Å²	117.8	45%	0.453	63%	0.631	S	S	.	*	H	α-helix	trans	-59.8	-43	174	-80.7	0	0	0	0	112	L9 G10 L11 Q15 V16 C17	L9-C13 VanDerWaalsContact O-CB 3.3Å; L9-C13 WeakPolarHBondContact O-CB 3.23Å; L9-C13 PolarHBondContact O-N 2.69Å; L9-C13 PolarHBondContact O-SG 3.11Å; L9-C13 VanDerWaalsContact O-SG 3.39Å; G10-C13 PolarHBondContact O-N 2.8Å; L11-C13 PolarHBondContact O-N 2.91Å; C13-Q15 VanDerWaalsContact C-N 3.28Å; C13-Q15 PolarHBondContact O-N 2.86Å; C13-V16 PolarHBondContact O-N 3.42Å; C13-C17 WeakPolarHBondContact O-CB 3.31Å; C13-C17 PolarHBondContact O-N 2.9Å; C13-C17 PolarHBondContact O-SG 3.37Å
14	T	73.9	Confident	78.2	Confident	82 Å²	82	109.9 Å²	109.9	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-63.5	-34.6	178.2	60.6	0	0	0	0	112.8	G10 L11 L12	G10-T14 WeakPolarHBondContact O-CG2 3.37Å; G10-T14 PolarHBondContact O-N 2.8Å; L11-T14 PolarHBondContact O-N 2.84Å; L11-T14 PolarHBondContact O-OG1 2.92Å; L12-T14 PolarHBondContact O-N 3.27Å
15	Q	71.4	Confident	79	Confident	141 Å²	141	109.6 Å²	109.6	66%	0.659	60%	0.603	S	S	*	*	H	α-helix	trans	-70.8	-42.6	177.3	-65.6	-64.1	-66.3	0	0	111.7	L11 L12 C13 C17 W18	L11-Q15 WeakPolarHBondContact O-CG 3.36Å; L11-Q15 PolarHBondContact O-N 2.86Å; L11-Q15 VanDerWaalsContact O-N 3.13Å; L12-Q15 PolarHBondContact O-N 3.01Å; C13-Q15 VanDerWaalsContact C-N 3.28Å; C13-Q15 PolarHBondContact O-N 2.86Å; Q15-C17 VanDerWaalsContact C-N 3.34Å; Q15-C17 PolarHBondContact O-N 2.9Å; Q15-W18 PolarHBondContact O-N 3.23Å
16	V	69.6	Low	80	Confident	106 Å²	106	106 Å²	106	64%	0.642	58%	0.582	S	S	*	*	H	α-helix	trans	-69.2	-33.1	179	-179.8	0	0	0	0	111.7	L12 C13 W18	L12-V16 WeakPolarHBondContact O-CG2 3.47Å; L12-V16 PolarHBondContact O-N 2.81Å; C13-V16 PolarHBondContact O-N 3.42Å; V16-W18 VanDerWaalsContact C-N 3.25Å; V16-W18 PolarHBondContact O-N 3.39Å
17	C	74.1	Confident	81	Confident	111 Å²	111	103.6 Å²	103.6	75%	0.75	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-7.6	179.6	-70.8	0	0	0	0	114.8	C13 Q15	C13-C17 WeakPolarHBondContact O-CB 3.31Å; C13-C17 PolarHBondContact O-N 2.9Å; C13-C17 PolarHBondContact O-SG 3.37Å; Q15-C17 VanDerWaalsContact C-N 3.34Å; Q15-C17 PolarHBondContact O-N 2.9Å
18	W	75.6	Confident	81.7	Confident	205 Å²	205	102.7 Å²	102.7	78%	0.777	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	16.4	-175.5	-154	-81.8	0	0	0	114.7	Q15 V16 K20	Q15-W18 PolarHBondContact O-N 3.23Å; V16-W18 VanDerWaalsContact C-N 3.25Å; V16-W18 PolarHBondContact O-N 3.39Å; W18-K20 PolarHBondContact O-N 3.46Å; W18-K20 VanDerWaalsContact O-N 3.12Å
19	V	73.3	Confident	82.5	Confident	123 Å²	123	103.8 Å²	103.8	75%	0.745	57%	0.571	S	S	*	*			trans	-78.4	104.6	175.5	-175.1	0	0	0	0	110
20	K	76.5	Confident	83.4	Confident	183 Å²	183	103.3 Å²	103.3	80%	0.796	58%	0.576	S	S	*	*			trans	-87.4	107.9	164.9	-68.2	-171.9	-178.7	-177.5	0	108.6	W18	W18-K20 PolarHBondContact O-N 3.46Å; W18-K20 VanDerWaalsContact O-N 3.12Å
21	G	78.6	Confident	84.2	Confident	64 Å²	64	105.6 Å²	105.6	66%	0.66	58%	0.58	S	S	*	*			trans	-69.2	150.3	173.2	0	0	0	0	0	112
22	Q	82.1	Confident	85.1	Confident	127 Å²	127	106.5 Å²	106.5	59%	0.593	59%	0.59	S	S	*	*			trans	-78.4	137.1	163	-64.2	175.3	-85.6	0	0	108.5	T47 M109	Q22-T47 HydrophobicContact CG-CG2 4.01Å; Q22-T47 PolarHBondContact NE2-OG1 3.1Å; Q22-M109 HydrophobicContact CB-CE 4.46Å; Q22-M109 HydrophobicContact CB-SD 3.52Å; Q22-M109 VanDerWaalsContact CB-SD 3.52Å; Q22-M109 VanDerWaalsContact CD-SD 3.58Å; Q22-M109 HydrophobicContact CG-SD 4.05Å; Q22-M109 PolarHBondContact NE2-SD 3.33Å
23	Q	88.9	Confident	86.1	Confident	124 Å²	124	103.7 Å²	103.7	58%	0.579	58%	0.575	S	S	*	*			trans	-113.2	131.1	-177.7	-173.5	175.7	-19.5	0	0	109.9	F45 S46	Q23-F45 WeakPolarHBondContact O-CA 3.5Å; Q23-S46 PolarHBondContact N-OG 2.87Å; Q23-S46 VanDerWaalsContact N-OG 3.1Å; Q23-S46 PolarHBondContact O-N 2.83Å; Q23-S46 PolarHBondContact O-OG 3.04Å
24	V	93.5	Very high	87.1	Confident	53 Å²	53	107.5 Å²	107.5	32%	0.321	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121	134.9	171.5	176.9	0	0	0	0	107.7	C43 N44 F45 C107 M109	V24-C43 WeakPolarHBondContact CG1-SG 3.31Å; V24-N44 CarbonylContact C-O 3.48Å; V24-N44 WeakPolarHBondContact CA-O 3.15Å; V24-F45 HydrophobicContact CG2-CB 4.36Å; V24-C107 WeakPolarHBondContact CG1-SG 3.05Å; V24-M109 HydrophobicContact CG2-CE 3.73Å; V24-M109 HydrophobicContact CG2-CG 4.01Å; V24-M109 HydrophobicContact CG2-SD 4.17Å
25	Q	96.1	Very high	88.2	Confident	116 Å²	116	109.8 Å²	109.8	54%	0.542	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.9	120.2	178.2	-177.5	175.9	-22.4	0	0	109.6	C43 N44	Q25-C43 WeakPolarHBondContact O-CA 3.29Å; Q25-N44 PolarHBondContact N-O 3.29Å; Q25-N44 PolarHBondContact O-N 3.28Å
26	Q	97.7	Very high	89.5	Confident	57 Å²	57	105 Å²	105	27%	0.266	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.3	143.1	175.9	-75.8	-176.3	-122.9	0	0	112.1	Q42 C43 Y105 C107	Q26-Q42 CarbonylContact C-O 3.56Å; Q26-Q42 VanDerWaalsContact CA-O 3.23Å; Q26-Q42 WeakPolarHBondContact CA-O 3.36Å; Q26-C43 HydrophobicContact CG-CB 4.42Å; Q26-Y105 PolarHBondContact NE2-O 3.19Å; Q26-C107 HydrophobicContact CG-CB 4.44Å; Q26-C107 WeakPolarHBondContact CG-SG 3.31Å; Q26-C107 PolarHBondContact OE1-SG 3.41Å; Q26-C107 VanDerWaalsContact OE1-SG 3.42Å
27	S	98.2	Very high	90.9	Very high	39 Å²	39	104.7 Å²	104.7	27%	0.273	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-147.3	145.2	174.7	57.5	0	0	0	0	112.3	Q42	S27-Q42 PolarHBondContact N-O 2.95Å; S27-Q42 PolarHBondContact O-N 2.77Å
28	P	98.1	Very high	92	Very high	58 Å²	58	104.3 Å²	104.3	38%	0.377	56%	0.562	S	S	.	*			cis	-67.7	162.5	-11.9	32.7	-37.3	0	0	0	111.5	S30 L31	P28-S30 VanDerWaalsContact C-N 3.31Å; P28-S30 WeakPolarHBondContact CB-O 3.34Å; P28-L31 HydrophobicContact CG-CB 4.15Å; P28-L31 HydrophobicContact CG-CD1 4.3Å
29	T	96.6	Very high	93.1	Very high	145 Å²	145	94.9 Å²	94.9	89%	0.89	53%	0.528	S	S	*	.	S	Bend	trans	-69.5	-32.1	177.3	-52.4	0	0	0	0	112.1
30	S	96.7	Very high	94.3	Very high	97 Å²	97	93.2 Å²	93.2	68%	0.678	51%	0.512	S	S	*	.			trans	-143.4	149	173.1	57.3	0	0	0	0	109.1	P28	P28-S30 VanDerWaalsContact C-N 3.31Å; P28-S30 WeakPolarHBondContact CB-O 3.34Å
31	L	96.5	Very high	95.3	Very high	83 Å²	83	85.7 Å²	85.7	44%	0.435	48%	0.481	S	S	.	.			trans	-134.4	129.1	177.9	-174.8	63.1	0	0	0	108.1	P28 L33 A39	P28-L31 HydrophobicContact CG-CB 4.15Å; P28-L31 HydrophobicContact CG-CD1 4.3Å; L31-L33 HydrophobicContact CD2-CD2 3.59Å; L31-L33 HydrophobicContact CG-CD2 3.83Å; L31-A39 HydrophobicContact CD2-CB 3.71Å
32	V	97.3	Very high	96.3	Very high	142 Å²	142	84.9 Å²	84.9	86%	0.861	46%	0.46	S	S	*	.			trans	-122.9	123.8	174.8	-179	0	0	0	0	106.8
33	L	96.4	Very high	97	Very high	54 Å²	54	78.9 Å²	78.9	28%	0.283	43%	0.432	S	S	.	.			trans	-147.9	161.1	-175	54.9	82.3	0	0	0	110	L31 E37 A39	L31-L33 HydrophobicContact CD2-CD2 3.59Å; L31-L33 HydrophobicContact CG-CD2 3.83Å; L33-E37 HydrophobicContact CB-CB 4.15Å; L33-E37 HydrophobicContact CD1-CB 4.36Å; L33-A39 HydrophobicContact CD2-CB 3.66Å
34	Q	97.9	Very high	97.3	Very high	147 Å²	147	75.7 Å²	75.7	69%	0.687	42%	0.419	S	S	*	.			trans	-81.1	155.2	173.5	-60.5	-65.9	-18.7	0	0	111.1	G36 E37	Q34-G36 PolarHBondContact O-N 2.87Å; Q34-E37 HydrophobicContact CB-CG 4.17Å; Q34-E37 VanDerWaalsContact CB-OE2 3.28Å; Q34-E37 WeakPolarHBondContact CB-OE2 3.27Å; Q34-E37 PolarHBondContact N-OE2 2.8Å; Q34-E37 WeakPolarHBondContact O-CB 3.25Å; Q34-E37 PolarHBondContact O-N 2.85Å; Q34-E37 VanDerWaalsContact O-N 3.14Å
35	E	97.7	Very high	97.3	Very high	130 Å²	130	73.8 Å²	73.8	61%	0.607	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	137.5	170.9	-171.7	173.3	-169	0	0	110.8	E37 S97 I99	E35-E37 VanDerWaalsContact C-N 3.3Å; E35-E37 PolarHBondContact O-N 2.8Å; E35-S97 WeakPolarHBondContact CA-O 3.39Å; E35-S97 WeakPolarHBondContact CG-O 3.23Å; E35-I99 HydrophobicContact CB-CD1 4.38Å
36	G	98.3	Very high	97	Very high	41 Å²	41	70.6 Å²	70.6	42%	0.423	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	-14.9	-176.3	0	0	0	0	0	115	Q34 S97	Q34-G36 PolarHBondContact O-N 2.87Å; G36-S97 PolarHBondContact N-O 3.08Å
37	E	98.4	Very high	96.4	Very high	100 Å²	100	69.9 Å²	69.9	47%	0.467	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-70	164	170	-64.9	-168.3	83.2	0	0	111.4	L33 Q34 E35 S97	L33-E37 HydrophobicContact CB-CB 4.15Å; L33-E37 HydrophobicContact CD1-CB 4.36Å; Q34-E37 HydrophobicContact CB-CG 4.17Å; Q34-E37 VanDerWaalsContact CB-OE2 3.28Å; Q34-E37 WeakPolarHBondContact CB-OE2 3.27Å; Q34-E37 PolarHBondContact N-OE2 2.8Å; Q34-E37 WeakPolarHBondContact O-CB 3.25Å; Q34-E37 PolarHBondContact O-N 2.85Å; Q34-E37 VanDerWaalsContact O-N 3.14Å; E35-E37 VanDerWaalsContact C-N 3.3Å; E35-E37 PolarHBondContact O-N 2.8Å; E37-S97 VanDerWaalsContact O-CB 3.29Å; E37-S97 WeakPolarHBondContact O-CB 3.48Å; E37-S97 PolarHBondContact O-N 3.03Å; E37-S97 PolarHBondContact O-OG 2.83Å
38	N	98.4	Very high	95.6	Very high	102 Å²	102	72.9 Å²	72.9	55%	0.545	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-97.4	135	176.3	-65.4	-25.5	0	0	0	110.2	I94 S95 S96	N38-I94 CarbonylContact C-O 3.58Å; N38-I94 WeakPolarHBondContact CA-O 3.49Å; N38-S95 VanDerWaalsContact OD1-CA 3.31Å; N38-S95 WeakPolarHBondContact OD1-CA 3.3Å; N38-S96 PolarHBondContact OD1-N 2.98Å
39	A	98	Very high	94.7	Very high	8 Å²	8	70.8 Å²	70.8	7%	0.066	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	140.6	172.6	0	0	0	0	0	110.7	L31 L33 H93 I94	L31-A39 HydrophobicContact CD2-CB 3.71Å; L33-A39 HydrophobicContact CD2-CB 3.66Å; A39-H93 CarbonylContact O-C 3.59Å; A39-H93 VanDerWaalsContact O-CA 3.31Å; A39-H93 WeakPolarHBondContact O-CA 3.31Å; A39-H93 PolarHBondContact O-CD2 3.06Å; A39-I94 HydrophobicContact CB-CB 4.06Å; A39-I94 HydrophobicContact CB-CG1 4.36Å; A39-I94 PolarHBondContact N-O 2.76Å; A39-I94 PolarHBondContact O-N 2.82Å
40	E	98.4	Very high	94.1	Very high	87 Å²	87	69.7 Å²	69.7	41%	0.407	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.7	168.5	-166.1	-171.8	149.9	0	0	110.3	Q42	E40-Q42 PolarHBondContact OE1-NE2 2.89Å
41	L	98.5	Very high	93.8	Very high	25 Å²	25	65.1 Å²	65.1	13%	0.131	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141	170.4	-59.5	174	0	0	0	108.7	W54 S91 L92 Y105	L41-W54 HydrophobicContact CB-CH2 3.98Å; L41-W54 HydrophobicContact CB-CZ3 4.06Å; L41-W54 HydrophobicContact CD1-CZ3 4.42Å; L41-S91 CarbonylContact O-C 3.57Å; L41-S91 WeakPolarHBondContact O-CA 3.5Å; L41-S91 WeakPolarHBondContact O-CB 3.3Å; L41-L92 HydrophobicContact CB-CB 4.4Å; L41-L92 HydrophobicContact CD1-CD2 4.45Å; L41-L92 PolarHBondContact N-O 2.02Å; L41-L92 PolarHBondContact O-N 2.81Å; L41-Y105 VanDerWaalsContact CD1-CB 3.4Å; L41-Y105 HydrophobicContact CD1-CD2 4.19Å; L41-Y105 HydrophobicContact CD1-CG 3.92Å
42	Q	98.2	Very high	93.8	Very high	48 Å²	48	61.1 Å²	61.1	22%	0.224	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.6	179.5	-63.8	172.2	11.5	0	0	109.5	Q26 S27 E40 R89 S90	Q26-Q42 CarbonylContact C-O 3.56Å; Q26-Q42 VanDerWaalsContact CA-O 3.23Å; Q26-Q42 WeakPolarHBondContact CA-O 3.36Å; S27-Q42 PolarHBondContact N-O 2.95Å; S27-Q42 PolarHBondContact O-N 2.77Å; E40-Q42 PolarHBondContact OE1-NE2 2.89Å; Q42-R89 VanDerWaalsContact OE1-NH2 3.11Å; Q42-S90 CarbonylContact C-O 3.59Å; Q42-S90 WeakPolarHBondContact CA-O 3.36Å
43	C	97.5	Very high	93.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	108.1	-178.2	-178.5	0	0	0	0	108.8	V24 Q25 Q26 M52 W54 R89 S90 C107	V24-C43 WeakPolarHBondContact CG1-SG 3.31Å; Q25-C43 WeakPolarHBondContact O-CA 3.29Å; Q26-C43 HydrophobicContact CG-CB 4.42Å; C43-M52 HydrophobicContact CB-CE 4.43Å; C43-M52 VanDerWaalsContact SG-CE 3.54Å; C43-W54 HydrophobicContact CB-CH2 3.72Å; C43-W54 HydrophobicContact CB-CZ2 3.65Å; C43-R89 CarbonylContact O-C 3.52Å; C43-R89 WeakPolarHBondContact O-CA 3.45Å; C43-S90 PolarHBondContact N-O 3.31Å; C43-S90 PolarHBondContact O-N 2.94Å; C43-C107 HydrophobicContact CB-CB 3.58Å; C43-C107 WeakPolarHBondContact CB-SG 3.42Å; C43-C107 WeakPolarHBondContact SG-CB 3.32Å; C43-C107 CovalentContact SG-SG 2.02Å; C43-C107 PolarHBondContact SG-SG 3.49Å
44	N	96	Very high	93.8	Very high	58 Å²	58	53.9 Å²	53.9	31%	0.31	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	146.8	176	-63.2	-35.2	0	0	0	109.7	V24 Q25 R88 R89	V24-N44 CarbonylContact C-O 3.48Å; V24-N44 WeakPolarHBondContact CA-O 3.15Å; Q25-N44 PolarHBondContact N-O 3.29Å; Q25-N44 PolarHBondContact O-N 3.28Å; N44-R88 WeakPolarHBondContact CA-O 3.46Å; N44-R89 VanDerWaalsContact OD1-CG 3.32Å; N44-R89 WeakPolarHBondContact OD1-CG 3.27Å
45	F	92.6	Very high	93.8	Very high	12 Å²	12	48.7 Å²	48.7	5%	0.053	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	150.4	-175.2	47.6	-94	0	0	0	113.5	Q23 V24 T47 L49 M52 R88 R89 M109	Q23-F45 WeakPolarHBondContact O-CA 3.5Å; V24-F45 HydrophobicContact CG2-CB 4.36Å; F45-T47 WeakPolarHBondContact CD2-O 3.39Å; F45-L49 HydrophobicContact CB-CD2 4.38Å; F45-L49 HydrophobicContact CD1-CD2 3.58Å; F45-L49 HydrophobicContact CD2-CD2 3.39Å; F45-L49 HydrophobicContact CD2-CG 3.93Å; F45-L49 HydrophobicContact CE1-CD2 3.48Å; F45-L49 VanDerWaalsContact CE1-CD2 3.48Å; F45-L49 HydrophobicContact CE1-CG 4.3Å; F45-L49 HydrophobicContact CE2-CD1 4.25Å; F45-L49 HydrophobicContact CE2-CD2 3.25Å; F45-L49 HydrophobicContact CE2-CG 3.41Å; F45-L49 VanDerWaalsContact CE2-CG 3.41Å; F45-L49 HydrophobicContact CG-CD2 3.52Å; F45-L49 HydrophobicContact CZ-CD1 3.99Å; F45-L49 HydrophobicContact CZ-CD2 3.29Å; F45-L49 HydrophobicContact CZ-CG 3.62Å; F45-M52 HydrophobicContact CD1-CE 3.44Å; F45-M52 VanDerWaalsContact CD1-CE 3.44Å; F45-M52 HydrophobicContact CE1-CE 3.6Å; F45-M52 HydrophobicContact CG-CE 4.42Å; F45-R88 WeakPolarHBondContact CD1-O 3.46Å; F45-R88 HydrophobicContact CD2-CB 3.6Å; F45-R88 HydrophobicContact CD2-CG 4.13Å; F45-R88 WeakPolarHBondContact CE1-O 3.3Å; F45-R88 HydrophobicContact CE2-CB 3.54Å; F45-R88 HydrophobicContact CE2-CG 3.92Å; F45-R88 HydrophobicContact CG-CB 4.22Å; F45-R88 WeakPolarHBondContact CG-O 3.16Å; F45-R88 HydrophobicContact CZ-CB 4.09Å; F45-R88 PolarHBondContact N-O 2.86Å; F45-R88 VanDerWaalsContact O-CB 3.24Å; F45-R88 WeakPolarHBondContact O-CB 3.39Å; F45-R88 WeakPolarHBondContact O-CD 3.38Å; F45-R89 VanDerWaalsContact CE1-N 3.33Å; F45-M109 HydrophobicContact CB-CE 3.43Å; F45-M109 VanDerWaalsContact CB-CE 3.43Å; F45-M109 HydrophobicContact CD2-CE 4.46Å; F45-M109 HydrophobicContact CG-CE 4.21Å
46	S	89.3	Confident	93.8	Very high	49 Å²	49	44.6 Å²	44.6	34%	0.343	25%	0.248	S	C	.	.	S	Bend	trans	-85.5	-29.1	-171.6	66.6	0	0	0	0	114.4	Q23 R88	Q23-S46 PolarHBondContact N-OG 2.87Å; Q23-S46 VanDerWaalsContact N-OG 3.1Å; Q23-S46 PolarHBondContact O-N 2.83Å; Q23-S46 PolarHBondContact O-OG 3.04Å; S46-R88 PolarHBondContact O-NH1 3.04Å
47	T	86.4	Confident	93.7	Very high	43 Å²	43	45.8 Å²	45.8	26%	0.264	24%	0.243	S	C	.	.	S	Bend	trans	-111.3	160.3	-174.2	60.3	0	0	0	0	112.1	Q22 F45	Q22-T47 HydrophobicContact CG-CG2 4.01Å; Q22-T47 PolarHBondContact NE2-OG1 3.1Å; F45-T47 WeakPolarHBondContact CD2-O 3.39Å
48	S	81.4	Confident	93.3	Very high	102 Å²	102	47 Å²	47	71%	0.713	24%	0.243	S	C	*	.			trans	-56.2	141.8	162.2	47.2	0	0	0	0	109.9
49	L	78.3	Confident	92.7	Very high	13 Å²	13	48 Å²	48	7%	0.068	26%	0.255	C	S	.	.			trans	-131.2	160.3	175	56.8	80.3	0	0	0	109.7	F45 S51 M52 M109	F45-L49 HydrophobicContact CB-CD2 4.38Å; F45-L49 HydrophobicContact CD1-CD2 3.58Å; F45-L49 HydrophobicContact CD2-CD2 3.39Å; F45-L49 HydrophobicContact CD2-CG 3.93Å; F45-L49 HydrophobicContact CE1-CD2 3.48Å; F45-L49 VanDerWaalsContact CE1-CD2 3.48Å; F45-L49 HydrophobicContact CE1-CG 4.3Å; F45-L49 HydrophobicContact CE2-CD1 4.25Å; F45-L49 HydrophobicContact CE2-CD2 3.25Å; F45-L49 HydrophobicContact CE2-CG 3.41Å; F45-L49 VanDerWaalsContact CE2-CG 3.41Å; F45-L49 HydrophobicContact CG-CD2 3.52Å; F45-L49 HydrophobicContact CZ-CD1 3.99Å; F45-L49 HydrophobicContact CZ-CD2 3.29Å; F45-L49 HydrophobicContact CZ-CG 3.62Å; L49-S51 VanDerWaalsContact CD1-C 3.49Å; L49-M52 HydrophobicContact CD2-CE 3.78Å; L49-M109 HydrophobicContact CB-CB 4.1Å; L49-M109 HydrophobicContact CD2-CB 3.74Å; L49-M109 HydrophobicContact CD2-CE 4.35Å
50	N	84.5	Confident	92.2	Very high	123 Å²	123	51.8 Å²	51.8	66%	0.658	30%	0.295	S	S	*	.	S	Bend	trans	-85.4	-36.1	173.9	-64.5	-38.2	0	0	0	110.5	P70 E110	N50-P70 WeakPolarHBondContact O-CA 3.39Å; N50-E110 WeakPolarHBondContact CB-O 3.49Å; N50-E110 PolarHBondContact N-O 3.08Å
51	S	90.9	Very high	91.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.294	C	S	.	.			trans	-158.4	149.5	-177.2	43.3	0	0	0	0	114.1	L49 Y68 E110	L49-S51 VanDerWaalsContact CD1-C 3.49Å; S51-Y68 WeakPolarHBondContact OG-CE2 3.39Å; S51-Y68 VanDerWaalsContact OG-CZ 3.31Å; S51-Y68 PolarHBondContact OG-OH 3.12Å; S51-Y68 VanDerWaalsContact OG-OH 3.08Å; S51-E110 PolarHBondContact N-O 2.78Å; S51-E110 PolarHBondContact O-N 3.05Å
52	M	95.2	Very high	91.5	Very high	0 Å²	0	51 Å²	51	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	132.9	167.6	-174.2	59.3	61.2	0	0	109.8	C43 F45 L49 N69 T83 S90 C107	C43-M52 HydrophobicContact CB-CE 4.43Å; C43-M52 VanDerWaalsContact SG-CE 3.54Å; F45-M52 HydrophobicContact CD1-CE 3.44Å; F45-M52 VanDerWaalsContact CD1-CE 3.44Å; F45-M52 HydrophobicContact CE1-CE 3.6Å; F45-M52 HydrophobicContact CG-CE 4.42Å; L49-M52 HydrophobicContact CD2-CE 3.78Å; M52-N69 PolarHBondContact N-O 2.99Å; M52-N69 PolarHBondContact O-N 3.22Å; M52-T83 HydrophobicContact CB-CG2 4.11Å; M52-S90 WeakPolarHBondContact CG-OG 3.22Å; M52-C107 HydrophobicContact SD-CB 3.71Å
53	Q	96.3	Very high	91.4	Very high	43 Å²	43	53 Å²	53	20%	0.201	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.3	169.1	-172.1	149.9	-113.8	0	0	110.4	F55 S65 F67 C107 A108	Q53-F55 HydrophobicContact CB-CE2 4.08Å; Q53-F55 HydrophobicContact CB-CZ 4.46Å; Q53-F55 HydrophobicContact CG-CD2 4.12Å; Q53-F55 HydrophobicContact CG-CE1 4.12Å; Q53-F55 HydrophobicContact CG-CE2 3.57Å; Q53-F55 HydrophobicContact CG-CZ 3.61Å; Q53-S65 PolarHBondContact OE1-OG 3.36Å; Q53-S65 VanDerWaalsContact OE1-OG 3.08Å; Q53-F67 CarbonylContact C-O 3.54Å; Q53-F67 VanDerWaalsContact CA-O 3.3Å; Q53-F67 WeakPolarHBondContact CA-O 3.19Å; Q53-C107 CarbonylContact O-C 3.54Å; Q53-C107 WeakPolarHBondContact O-CA 3.31Å; Q53-A108 PolarHBondContact N-O 2.92Å; Q53-A108 PolarHBondContact O-N 3.31Å
54	W	97.9	Very high	91.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133	173.1	-74.7	95	0	0	0	109.6	L41 C43 V66 F67 S81 S90 L92 C107	L41-W54 HydrophobicContact CB-CH2 3.98Å; L41-W54 HydrophobicContact CB-CZ3 4.06Å; L41-W54 HydrophobicContact CD1-CZ3 4.42Å; C43-W54 HydrophobicContact CB-CH2 3.72Å; C43-W54 HydrophobicContact CB-CZ2 3.65Å; W54-V66 HydrophobicContact CB-CB 4.46Å; W54-V66 WeakPolarHBondContact O-CB 2.98Å; W54-V66 PolarHBondContact O-N 3.24Å; W54-F67 HydrophobicContact CB-CB 4.36Å; W54-F67 PolarHBondContact N-O 3.43Å; W54-F67 PolarHBondContact O-N 3.45Å; W54-S81 VanDerWaalsContact CD1-OG 3.26Å; W54-S81 PolarHBondContact NE1-OG 2.84Å; W54-S90 PolarHBondContact NE1-OG 3.06Å; W54-L92 HydrophobicContact CB-CD2 4.45Å; W54-L92 HydrophobicContact CD2-CB 3.66Å; W54-L92 HydrophobicContact CD2-CD2 4.09Å; W54-L92 HydrophobicContact CD2-CG 4.34Å; W54-L92 HydrophobicContact CE3-CB 3.75Å; W54-L92 HydrophobicContact CE3-CD2 3.74Å; W54-L92 HydrophobicContact CE3-CG 4.35Å; W54-L92 HydrophobicContact CG-CB 4.27Å; W54-L92 HydrophobicContact CG-CD1 4.45Å; W54-L92 HydrophobicContact CG-CD2 4.41Å; W54-L92 HydrophobicContact CH2-CB 3.9Å; W54-L92 HydrophobicContact CZ2-CB 3.83Å; W54-L92 HydrophobicContact CZ3-CB 3.86Å; W54-L92 HydrophobicContact CZ3-CD2 4.3Å; W54-C107 HydrophobicContact CD2-CB 4.02Å; W54-C107 HydrophobicContact CE3-CB 3.83Å; W54-C107 HydrophobicContact CH2-CB 3.9Å; W54-C107 HydrophobicContact CZ2-CB 4.06Å; W54-C107 HydrophobicContact CZ3-CB 3.78Å
55	F	97.7	Very high	91.3	Very high	38 Å²	38	55 Å²	55	17%	0.167	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.6	178.6	-64	-85.6	0	0	0	111.3	Q53 L63 V64 Y105 L106 A108	Q53-F55 HydrophobicContact CB-CE2 4.08Å; Q53-F55 HydrophobicContact CB-CZ 4.46Å; Q53-F55 HydrophobicContact CG-CD2 4.12Å; Q53-F55 HydrophobicContact CG-CE1 4.12Å; Q53-F55 HydrophobicContact CG-CE2 3.57Å; Q53-F55 HydrophobicContact CG-CZ 3.61Å; F55-L63 HydrophobicContact CB-CD2 4.35Å; F55-L63 HydrophobicContact CD1-CB 4.09Å; F55-V64 CarbonylContact C-O 3.53Å; F55-V64 WeakPolarHBondContact CA-O 3.02Å; F55-Y105 CarbonylContact O-C 3.42Å; F55-Y105 VanDerWaalsContact O-CA 3.27Å; F55-Y105 WeakPolarHBondContact O-CA 3.32Å; F55-L106 HydrophobicContact CB-CB 4.45Å; F55-L106 PolarHBondContact N-O 2.82Å; F55-L106 PolarHBondContact O-N 2.93Å; F55-A108 HydrophobicContact CD2-CB 4.42Å; F55-A108 HydrophobicContact CE2-CB 3.88Å
56	Y	97.4	Very high	91.6	Very high	45 Å²	45	56.4 Å²	56.4	18%	0.176	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128	164.3	174.5	-110.1	0	0	0	108.9	R58 V64 S102 Y105	Y56-R58 HydrophobicContact CD1-CG 4.2Å; Y56-R58 HydrophobicContact CE1-CG 4.08Å; Y56-V64 PolarHBondContact N-O 3.28Å; Y56-V64 PolarHBondContact O-N 3.06Å; Y56-S102 PolarHBondContact OH-O 3Å; Y56-Y105 HydrophobicContact CD2-CD1 4.14Å; Y56-Y105 HydrophobicContact CD2-CD2 4.23Å; Y56-Y105 AromaticContact CD2-CE1 3.69Å; Y56-Y105 HydrophobicContact CD2-CE1 3.69Å; Y56-Y105 AromaticContact CD2-CE2 3.78Å; Y56-Y105 HydrophobicContact CD2-CE2 3.78Å; Y56-Y105 HydrophobicContact CD2-CG 4.4Å; Y56-Y105 AromaticContact CD2-CZ 3.49Å; Y56-Y105 VanDerWaalsContact CD2-CZ 3.49Å; Y56-Y105 HydrophobicContact CE2-CE2 4.05Å; Y56-Y105 HydrophobicContact CG-CE1 4.26Å
57	Q	96.4	Very high	92	Very high	65 Å²	65	54.8 Å²	54.8	30%	0.304	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114	175	-168.8	174.2	31.2	0	0	109.6	G61 S62 L63 T104	Q57-G61 PolarHBondContact NE2-O 3.33Å; Q57-S62 WeakPolarHBondContact CA-O 3.42Å; Q57-L63 HydrophobicContact CB-CD2 3.79Å; Q57-L63 HydrophobicContact CG-CD2 3.94Å; Q57-T104 PolarHBondContact N-O 2.86Å
58	R	89.5	Confident	92.5	Very high	126 Å²	126	57.6 Å²	57.6	48%	0.475	34%	0.339	S	S	.	.			trans	-68.7	157.6	176	-64.9	-166	-174.4	100.9	-0.6	111.4	Y56 G60 G61 S62 V64	Y56-R58 HydrophobicContact CD1-CG 4.2Å; Y56-R58 HydrophobicContact CE1-CG 4.08Å; R58-G60 PolarHBondContact O-N 2.69Å; R58-G61 PolarHBondContact O-N 2.97Å; R58-S62 PolarHBondContact N-O 3.49Å; R58-V64 HydrophobicContact CG-CG2 3.79Å; R58-V64 VanDerWaalsContact NH2-CG2 3.29Å
59	P	85.5	Confident	93.1	Very high	123 Å²	123	52.8 Å²	52.8	80%	0.799	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	125.2	159.8	-25	34.4	0	0	0	109.9
60	G	87.8	Confident	93.9	Very high	88 Å²	88	54.2 Å²	54.2	91%	0.907	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	-1.2	-172.7	0	0	0	0	0	115.4	R58	R58-G60 PolarHBondContact O-N 2.69Å
61	G	89.4	Confident	94.4	Very high	37 Å²	37	51.8 Å²	51.8	38%	0.381	31%	0.307	S	S	.	.	S	Bend	trans	93.1	-8.4	163.9	0	0	0	0	0	116.2	Q57 R58	Q57-G61 PolarHBondContact NE2-O 3.33Å; R58-G61 PolarHBondContact O-N 2.97Å
62	S	94	Very high	94.7	Very high	58 Å²	58	53.6 Å²	53.6	41%	0.406	33%	0.326	S	S	.	.			trans	-65.5	135	176.4	69.2	0	0	0	0	111.9	Q57 R58	Q57-S62 WeakPolarHBondContact CA-O 3.42Å; R58-S62 PolarHBondContact N-O 3.49Å
63	L	95.6	Very high	94.8	Very high	91 Å²	91	58 Å²	58	48%	0.476	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	138	176	-64.3	178.7	0	0	0	111.3	F55 Q57 L106	F55-L63 HydrophobicContact CB-CD2 4.35Å; F55-L63 HydrophobicContact CD1-CB 4.09Å; Q57-L63 HydrophobicContact CB-CD2 3.79Å; Q57-L63 HydrophobicContact CG-CD2 3.94Å; L63-L106 HydrophobicContact CD2-CD1 3.93Å
64	V	95.9	Very high	94.9	Very high	36 Å²	36	60.2 Å²	60.2	22%	0.218	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125.8	177.7	-170.3	0	0	0	0	108.2	F55 Y56 R58 V66	F55-V64 CarbonylContact C-O 3.53Å; F55-V64 WeakPolarHBondContact CA-O 3.02Å; Y56-V64 PolarHBondContact N-O 3.28Å; Y56-V64 PolarHBondContact O-N 3.06Å; R58-V64 HydrophobicContact CG-CG2 3.79Å; R58-V64 VanDerWaalsContact NH2-CG2 3.29Å; V64-V66 PolarHBondContact O-N 3.13Å
65	S	96.5	Very high	94.9	Very high	63 Å²	63	66.8 Å²	66.8	44%	0.441	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	123.5	171.6	-173	0	0	0	0	109.5	Q53	Q53-S65 PolarHBondContact OE1-OG 3.36Å; Q53-S65 VanDerWaalsContact OE1-OG 3.08Å
66	V	96.9	Very high	94.9	Very high	42 Å²	42	68.7 Å²	68.7	26%	0.255	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-46.2	177.7	-178.8	0	0	0	0	109.6	W54 V64 L79	W54-V66 HydrophobicContact CB-CB 4.46Å; W54-V66 WeakPolarHBondContact O-CB 2.98Å; W54-V66 PolarHBondContact O-N 3.24Å; V64-V66 PolarHBondContact O-N 3.13Å; V66-L79 HydrophobicContact CG1-CD2 3.5Å
67	F	97.9	Very high	94.9	Very high	15 Å²	15	69.7 Å²	69.7	7%	0.066	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	140.5	174.5	-75.4	-71.9	0	0	0	111.4	Q53 W54 K74 L79 S81 L92	Q53-F67 CarbonylContact C-O 3.54Å; Q53-F67 VanDerWaalsContact CA-O 3.3Å; Q53-F67 WeakPolarHBondContact CA-O 3.19Å; W54-F67 HydrophobicContact CB-CB 4.36Å; W54-F67 PolarHBondContact N-O 3.43Å; W54-F67 PolarHBondContact O-N 3.45Å; F67-K74 HydrophobicContact CD1-CB 4.01Å; F67-K74 HydrophobicContact CE1-CB 4.01Å; F67-L79 HydrophobicContact CE2-CB 3.78Å; F67-L79 HydrophobicContact CZ-CB 4.18Å; F67-L79 WeakPolarHBondContact CZ-O 3.33Å; F67-S81 VanDerWaalsContact CD2-CB 3.48Å; F67-L92 HydrophobicContact CD2-CD1 3.81Å; F67-L92 HydrophobicContact CE2-CD1 3.92Å
68	Y	96.8	Very high	94.9	Very high	102 Å²	102	69.4 Å²	69.4	40%	0.4	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	112.7	157.1	175.3	-96.1	0	0	0	108.2	S51 P70 K74 E110	S51-Y68 WeakPolarHBondContact OG-CE2 3.39Å; S51-Y68 VanDerWaalsContact OG-CZ 3.31Å; S51-Y68 PolarHBondContact OG-OH 3.12Å; S51-Y68 VanDerWaalsContact OG-OH 3.08Å; Y68-P70 HydrophobicContact CD1-CG 4.32Å; Y68-P70 HydrophobicContact CE1-CG 3.65Å; Y68-K74 WeakPolarHBondContact O-CD 3.34Å; Y68-K74 WeakPolarHBondContact O-CE 3.37Å; Y68-K74 PolarHBondContact O-NZ 2.96Å; Y68-E110 VanDerWaalsContact CE2-OE2 3.31Å; Y68-E110 WeakPolarHBondContact CE2-OE2 3.5Å
69	N	95.5	Very high	95.3	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	100	-172.1	-177.6	-125.8	0	0	0	111.9	M52 S71 G72 K74 T83	M52-N69 PolarHBondContact N-O 2.99Å; M52-N69 PolarHBondContact O-N 3.22Å; N69-S71 PolarHBondContact ND2-O 3.48Å; N69-G72 PolarHBondContact OD1-O 2.84Å; N69-K74 HydrophobicContact CB-CD 4.31Å; N69-T83 WeakPolarHBondContact OD1-CB 3.47Å; N69-T83 PolarHBondContact OD1-N 2.96Å; N69-T83 VanDerWaalsContact OD1-N 3.15Å; N69-T83 PolarHBondContact OD1-OG1 3.48Å
70	P	93.8	Very high	96	Very high	44 Å²	44	60.1 Å²	60.1	29%	0.286	39%	0.385	S	S	.	.	S	Bend	trans	-60.9	-46.5	174.3	-26.3	36	0	0	0	113.1	N50 Y68 I85	N50-P70 WeakPolarHBondContact O-CA 3.39Å; Y68-P70 HydrophobicContact CD1-CG 4.32Å; Y68-P70 HydrophobicContact CE1-CG 3.65Å; P70-I85 WeakPolarHBondContact O-CD1 3.4Å; P70-I85 WeakPolarHBondContact O-CG1 3.41Å
71	S	95.1	Very high	96.5	Very high	71 Å²	71	55.9 Å²	55.9	50%	0.497	34%	0.342	S	S	.	.	S	Bend	trans	-165.1	170.9	179	59.7	0	0	0	0	111.4	N69 T83	N69-S71 PolarHBondContact ND2-O 3.48Å; S71-T83 CarbonylContact C-O 3.54Å; S71-T83 WeakPolarHBondContact CA-O 3.38Å
72	G	96.7	Very high	96.9	Very high	39 Å²	39	56 Å²	56	40%	0.402	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.9	-152.9	176.7	0	0	0	0	0	111.4	N69 T82 T83	N69-G72 PolarHBondContact OD1-O 2.84Å; G72-T82 CarbonylContact O-C 3.57Å; G72-T82 VanDerWaalsContact O-CA 3.3Å; G72-T82 WeakPolarHBondContact O-CA 3.41Å; G72-T83 PolarHBondContact N-O 2.93Å; G72-T83 PolarHBondContact O-N 3.38Å
73	T	98.2	Very high	97	Very high	91 Å²	91	53.3 Å²	53.3	56%	0.558	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.5	-176.5	-61	0	0	0	0	110.8	T80 S81 T82	T73-T80 HydrophobicContact CG2-CG2 3.47Å; T73-T80 VanDerWaalsContact CG2-CG2 3.47Å; T73-S81 CarbonylContact C-O 3.53Å; T73-S81 WeakPolarHBondContact CA-O 3.35Å; T73-T82 WeakPolarHBondContact CG2-OG1 3.49Å; T73-T82 WeakPolarHBondContact OG1-CG2 3.48Å; T73-T82 PolarHBondContact OG1-OG1 3.13Å
74	K	98.2	Very high	97	Very high	90 Å²	90	51.5 Å²	51.5	39%	0.391	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	143.2	168.2	-75.3	-173.9	175.7	-172.3	0	109.3	F67 Y68 N69 T80 S81	F67-K74 HydrophobicContact CD1-CB 4.01Å; F67-K74 HydrophobicContact CE1-CB 4.01Å; Y68-K74 WeakPolarHBondContact O-CD 3.34Å; Y68-K74 WeakPolarHBondContact O-CE 3.37Å; Y68-K74 PolarHBondContact O-NZ 2.96Å; N69-K74 HydrophobicContact CB-CD 4.31Å; K74-T80 CarbonylContact O-C 3.56Å; K74-T80 WeakPolarHBondContact O-CA 3.42Å; K74-S81 PolarHBondContact N-O 3.41Å; K74-S81 PolarHBondContact O-N 3.45Å
75	Q	98.2	Very high	96.9	Very high	138 Å²	138	53 Å²	53	65%	0.645	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.7	179.9	-175.5	173.8	2.4	0	0	110.2	G77 L79	Q75-G77 PolarHBondContact NE2-O 3.34Å; Q75-L79 WeakPolarHBondContact CA-O 3.37Å
76	S	97.5	Very high	96.7	Very high	79 Å²	79	59.8 Å²	59.8	55%	0.552	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.4	105.9	174	-175.3	0	0	0	0	108.6	R78 L79	S76-R78 PolarHBondContact O-N 3.42Å; S76-L79 PolarHBondContact N-O 3.5Å; S76-L79 PolarHBondContact O-N 2.87Å
77	G	97.1	Very high	96.6	Very high	66 Å²	66	64.1 Å²	64.1	68%	0.68	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-121.5	-174.4	0	0	0	0	0	111.9	Q75 L79	Q75-G77 PolarHBondContact NE2-O 3.34Å; G77-L79 VanDerWaalsContact C-N 3.33Å
78	R	97.4	Very high	96.4	Very high	58 Å²	58	69.7 Å²	69.7	22%	0.219	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-12.6	-179.4	-67	-173.2	-60.4	102.6	0.9	114	S76 S95 S96 D101	S76-R78 PolarHBondContact O-N 3.42Å; R78-S95 WeakPolarHBondContact CA-OG 3.03Å; R78-S95 WeakPolarHBondContact CB-O 3.33Å; R78-S95 WeakPolarHBondContact CD-O 3.49Å; R78-S95 PolarHBondContact NH1-O 2.83Å; R78-S95 VanDerWaalsContact NH1-O 3.08Å; R78-S95 PolarHBondContact O-N 2.67Å; R78-S95 PolarHBondContact O-OG 3.15Å; R78-S96 PolarHBondContact NH1-O 3.41Å; R78-D101 IonicContact CZ-OD1 3.78Å; R78-D101 IonicContact CZ-OD2 3.23Å; R78-D101 VanDerWaalsContact CZ-OD2 3.23Å; R78-D101 IonicContact NH1-OD1 3.87Å; R78-D101 IonicContact NH1-OD2 2.69Å; R78-D101 PolarHBondContact NH1-OD2 3.31Å; R78-D101 IonicContact NH2-OD1 2.8Å; R78-D101 PolarHBondContact NH2-OD1 2.79Å; R78-D101 IonicContact NH2-OD2 2.9Å; R78-D101 PolarHBondContact NH2-OD2 3.08Å
79	L	98.2	Very high	96.3	Very high	30 Å²	30	69 Å²	69	16%	0.157	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.3	-175.3	-67.6	74.5	0	0	0	110.8	V66 F67 Q75 S76 G77 H93 I94	V66-L79 HydrophobicContact CG1-CD2 3.5Å; F67-L79 HydrophobicContact CE2-CB 3.78Å; F67-L79 HydrophobicContact CZ-CB 4.18Å; F67-L79 WeakPolarHBondContact CZ-O 3.33Å; Q75-L79 WeakPolarHBondContact CA-O 3.37Å; S76-L79 PolarHBondContact N-O 3.5Å; S76-L79 PolarHBondContact O-N 2.87Å; G77-L79 VanDerWaalsContact C-N 3.33Å; L79-H93 CarbonylContact C-O 3.55Å; L79-H93 VanDerWaalsContact CA-O 3.31Å; L79-H93 WeakPolarHBondContact CA-O 3.18Å; L79-I94 HydrophobicContact CD1-CG2 4.38Å; L79-I94 HydrophobicContact CG-CG1 4.22Å; L79-I94 HydrophobicContact CG-CG2 4.34Å
80	T	98.6	Very high	96.4	Very high	24 Å²	24	69 Å²	69	15%	0.147	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.9	177.8	-59.1	0	0	0	0	109.4	T73 K74 L92 H93	T73-T80 HydrophobicContact CG2-CG2 3.47Å; T73-T80 VanDerWaalsContact CG2-CG2 3.47Å; K74-T80 CarbonylContact O-C 3.56Å; K74-T80 WeakPolarHBondContact O-CA 3.42Å; T80-L92 WeakPolarHBondContact O-CA 3.35Å; T80-H93 PolarHBondContact N-O 3.2Å; T80-H93 PolarHBondContact O-N 2.8Å
81	S	98.4	Very high	96.7	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.1	170.5	179.7	0	0	0	0	110.1	W54 F67 T73 K74 S91	W54-S81 VanDerWaalsContact CD1-OG 3.26Å; W54-S81 PolarHBondContact NE1-OG 2.84Å; F67-S81 VanDerWaalsContact CD2-CB 3.48Å; T73-S81 CarbonylContact C-O 3.53Å; T73-S81 WeakPolarHBondContact CA-O 3.35Å; K74-S81 PolarHBondContact N-O 3.41Å; K74-S81 PolarHBondContact O-N 3.45Å; S81-S91 VanDerWaalsContact CA-O 3.27Å; S81-S91 WeakPolarHBondContact CA-O 3.49Å
82	T	98.2	Very high	96.8	Very high	39 Å²	39	64.5 Å²	64.5	24%	0.239	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124.1	176.2	-63.7	0	0	0	0	109.4	G72 T73 V84 S90 S91	G72-T82 CarbonylContact O-C 3.57Å; G72-T82 VanDerWaalsContact O-CA 3.3Å; G72-T82 WeakPolarHBondContact O-CA 3.41Å; T73-T82 WeakPolarHBondContact CG2-OG1 3.49Å; T73-T82 WeakPolarHBondContact OG1-CG2 3.48Å; T73-T82 PolarHBondContact OG1-OG1 3.13Å; T82-V84 HydrophobicContact CG2-CG2 4.29Å; T82-S90 CarbonylContact O-C 3.53Å; T82-S90 WeakPolarHBondContact O-CA 3.24Å; T82-S90 PolarHBondContact O-OG 2.84Å; T82-S91 PolarHBondContact N-O 3.15Å; T82-S91 PolarHBondContact O-N 3.22Å
83	T	97.2	Very high	96.9	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.012	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.1	177.4	-57.2	0	0	0	0	111	M52 N69 S71 G72 I85 S90	M52-T83 HydrophobicContact CB-CG2 4.11Å; N69-T83 WeakPolarHBondContact OD1-CB 3.47Å; N69-T83 PolarHBondContact OD1-N 2.96Å; N69-T83 VanDerWaalsContact OD1-N 3.15Å; N69-T83 PolarHBondContact OD1-OG1 3.48Å; S71-T83 CarbonylContact C-O 3.54Å; S71-T83 WeakPolarHBondContact CA-O 3.38Å; G72-T83 PolarHBondContact N-O 2.93Å; G72-T83 PolarHBondContact O-N 3.38Å; T83-I85 HydrophobicContact CG2-CG1 4.47Å; T83-S90 WeakPolarHBondContact OG1-CB 3.43Å; T83-S90 PolarHBondContact OG1-OG 3.39Å
84	V	95.8	Very high	96.9	Very high	53 Å²	53	61.3 Å²	61.3	32%	0.321	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	91.6	177	-170.5	0	0	0	0	108.4	T82 K86 E87 R88 R89	T82-V84 HydrophobicContact CG2-CG2 4.29Å; V84-K86 VanDerWaalsContact C-N 3.27Å; V84-K86 PolarHBondContact O-N 2.94Å; V84-E87 HydrophobicContact CB-CB 4.15Å; V84-E87 HydrophobicContact CB-CG 4.38Å; V84-E87 HydrophobicContact CG1-CB 3.94Å; V84-E87 HydrophobicContact CG1-CG 3.7Å; V84-E87 PolarHBondContact O-N 3.11Å; V84-R88 PolarHBondContact O-N 3.22Å; V84-R88 VanDerWaalsContact O-N 3.15Å; V84-R89 PolarHBondContact N-O 3.2Å; V84-R89 PolarHBondContact O-N 3.47Å
85	I	91.9	Very high	96.9	Very high	68 Å²	68	58.7 Å²	58.7	35%	0.349	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-53.9	-43.6	-174.5	-60.1	178.1	0	0	0	111.8	P70 T83 E87 R88	P70-I85 WeakPolarHBondContact O-CD1 3.4Å; P70-I85 WeakPolarHBondContact O-CG1 3.41Å; T83-I85 HydrophobicContact CG2-CG1 4.47Å; I85-E87 VanDerWaalsContact C-N 3.25Å; I85-E87 PolarHBondContact O-N 3.35Å; I85-R88 PolarHBondContact O-N 2.8Å
86	K	92.6	Very high	96.9	Very high	204 Å²	204	55 Å²	55	89%	0.887	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-61.6	-33.8	-178.2	-69.4	-175	179	179.7	0	112.8	V84 R88	V84-K86 VanDerWaalsContact C-N 3.27Å; V84-K86 PolarHBondContact O-N 2.94Å; K86-R88 VanDerWaalsContact C-N 3.31Å
87	E	94.6	Very high	96.9	Very high	134 Å²	134	51.6 Å²	51.6	63%	0.626	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-88.4	-4.1	178.8	-66.3	176	-157.3	0	0	112.6	V84 I85 R89	V84-E87 HydrophobicContact CB-CB 4.15Å; V84-E87 HydrophobicContact CB-CG 4.38Å; V84-E87 HydrophobicContact CG1-CB 3.94Å; V84-E87 HydrophobicContact CG1-CG 3.7Å; V84-E87 PolarHBondContact O-N 3.11Å; I85-E87 VanDerWaalsContact C-N 3.25Å; I85-E87 PolarHBondContact O-N 3.35Å; E87-R89 HydrophobicContact CB-CB 4.3Å; E87-R89 PolarHBondContact O-N 2.92Å
88	R	94.2	Very high	96.9	Very high	131 Å²	131	52.4 Å²	52.4	49%	0.494	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	42.6	-174.8	-56.4	-178.1	-173.4	166.1	3.4	113.4	N44 F45 S46 V84 I85 K86	N44-R88 WeakPolarHBondContact CA-O 3.46Å; F45-R88 WeakPolarHBondContact CD1-O 3.46Å; F45-R88 HydrophobicContact CD2-CB 3.6Å; F45-R88 HydrophobicContact CD2-CG 4.13Å; F45-R88 WeakPolarHBondContact CE1-O 3.3Å; F45-R88 HydrophobicContact CE2-CB 3.54Å; F45-R88 HydrophobicContact CE2-CG 3.92Å; F45-R88 HydrophobicContact CG-CB 4.22Å; F45-R88 WeakPolarHBondContact CG-O 3.16Å; F45-R88 HydrophobicContact CZ-CB 4.09Å; F45-R88 PolarHBondContact N-O 2.86Å; F45-R88 VanDerWaalsContact O-CB 3.24Å; F45-R88 WeakPolarHBondContact O-CB 3.39Å; F45-R88 WeakPolarHBondContact O-CD 3.38Å; S46-R88 PolarHBondContact O-NH1 3.04Å; V84-R88 PolarHBondContact O-N 3.22Å; V84-R88 VanDerWaalsContact O-N 3.15Å; I85-R88 PolarHBondContact O-N 2.8Å; K86-R88 VanDerWaalsContact C-N 3.31Å
89	R	96.2	Very high	96.8	Very high	87 Å²	87	55.1 Å²	55.1	33%	0.328	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	140.7	-174.2	-178.5	169.1	173.5	178.2	-6	111.2	Q42 C43 N44 F45 V84 E87	Q42-R89 VanDerWaalsContact OE1-NH2 3.11Å; C43-R89 CarbonylContact O-C 3.52Å; C43-R89 WeakPolarHBondContact O-CA 3.45Å; N44-R89 VanDerWaalsContact OD1-CG 3.32Å; N44-R89 WeakPolarHBondContact OD1-CG 3.27Å; F45-R89 VanDerWaalsContact CE1-N 3.33Å; V84-R89 PolarHBondContact N-O 3.2Å; V84-R89 PolarHBondContact O-N 3.47Å; E87-R89 HydrophobicContact CB-CB 4.3Å; E87-R89 PolarHBondContact O-N 2.92Å
90	S	97.4	Very high	96.6	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.007	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	152.5	165	-170.6	0	0	0	0	109.8	Q42 C43 M52 W54 T82 T83	Q42-S90 CarbonylContact C-O 3.59Å; Q42-S90 WeakPolarHBondContact CA-O 3.36Å; C43-S90 PolarHBondContact N-O 3.31Å; C43-S90 PolarHBondContact O-N 2.94Å; M52-S90 WeakPolarHBondContact CG-OG 3.22Å; W54-S90 PolarHBondContact NE1-OG 3.06Å; T82-S90 CarbonylContact O-C 3.53Å; T82-S90 WeakPolarHBondContact O-CA 3.24Å; T82-S90 PolarHBondContact O-OG 2.84Å; T83-S90 WeakPolarHBondContact OG1-CB 3.43Å; T83-S90 PolarHBondContact OG1-OG 3.39Å
91	S	98.3	Very high	96.4	Very high	21 Å²	21	58.8 Å²	58.8	15%	0.147	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.7	172.6	59.7	0	0	0	0	110.8	L41 S81 T82	L41-S91 CarbonylContact O-C 3.57Å; L41-S91 WeakPolarHBondContact O-CA 3.5Å; L41-S91 WeakPolarHBondContact O-CB 3.3Å; S81-S91 VanDerWaalsContact CA-O 3.27Å; S81-S91 WeakPolarHBondContact CA-O 3.49Å; T82-S91 PolarHBondContact N-O 3.15Å; T82-S91 PolarHBondContact O-N 3.22Å
92	L	98.7	Very high	96.2	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.1	168	-179.8	67.2	0	0	0	107.8	L41 W54 F67 T80 Y105	L41-L92 HydrophobicContact CB-CB 4.4Å; L41-L92 HydrophobicContact CD1-CD2 4.45Å; L41-L92 PolarHBondContact N-O 2.02Å; L41-L92 PolarHBondContact O-N 2.81Å; W54-L92 HydrophobicContact CB-CD2 4.45Å; W54-L92 HydrophobicContact CD2-CB 3.66Å; W54-L92 HydrophobicContact CD2-CD2 4.09Å; W54-L92 HydrophobicContact CD2-CG 4.34Å; W54-L92 HydrophobicContact CE3-CB 3.75Å; W54-L92 HydrophobicContact CE3-CD2 3.74Å; W54-L92 HydrophobicContact CE3-CG 4.35Å; W54-L92 HydrophobicContact CG-CB 4.27Å; W54-L92 HydrophobicContact CG-CD1 4.45Å; W54-L92 HydrophobicContact CG-CD2 4.41Å; W54-L92 HydrophobicContact CH2-CB 3.9Å; W54-L92 HydrophobicContact CZ2-CB 3.83Å; W54-L92 HydrophobicContact CZ3-CB 3.86Å; W54-L92 HydrophobicContact CZ3-CD2 4.3Å; F67-L92 HydrophobicContact CD2-CD1 3.81Å; F67-L92 HydrophobicContact CE2-CD1 3.92Å; T80-L92 WeakPolarHBondContact O-CA 3.35Å; L92-Y105 HydrophobicContact CD2-CD1 3.47Å; L92-Y105 VanDerWaalsContact CD2-CD1 3.47Å; L92-Y105 HydrophobicContact CD2-CE1 4Å; L92-Y105 HydrophobicContact CD2-CG 4.14Å
93	H	98.6	Very high	96	Very high	56 Å²	56	63.2 Å²	63.2	26%	0.259	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.8	177	175.7	-95.9	0	0	0	109.7	A39 L79 T80	A39-H93 CarbonylContact O-C 3.59Å; A39-H93 VanDerWaalsContact O-CA 3.31Å; A39-H93 WeakPolarHBondContact O-CA 3.31Å; A39-H93 PolarHBondContact O-CD2 3.06Å; L79-H93 CarbonylContact C-O 3.55Å; L79-H93 VanDerWaalsContact CA-O 3.31Å; L79-H93 WeakPolarHBondContact CA-O 3.18Å; T80-H93 PolarHBondContact N-O 3.2Å; T80-H93 PolarHBondContact O-N 2.8Å
94	I	98.5	Very high	96	Very high	6 Å²	6	66.5 Å²	66.5	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	113.2	174.4	-46.4	-179.8	0	0	0	106.9	N38 A39 L79 Y105	N38-I94 CarbonylContact C-O 3.58Å; N38-I94 WeakPolarHBondContact CA-O 3.49Å; A39-I94 HydrophobicContact CB-CB 4.06Å; A39-I94 HydrophobicContact CB-CG1 4.36Å; A39-I94 PolarHBondContact N-O 2.76Å; A39-I94 PolarHBondContact O-N 2.82Å; L79-I94 HydrophobicContact CD1-CG2 4.38Å; L79-I94 HydrophobicContact CG-CG1 4.22Å; L79-I94 HydrophobicContact CG-CG2 4.34Å; I94-Y105 HydrophobicContact CD1-CE1 4.1Å; I94-Y105 HydrophobicContact CD1-CE2 3.97Å
95	S	98.4	Very high	96	Very high	35 Å²	35	65.3 Å²	65.3	25%	0.245	35%	0.345	C	S	.	.	S	Bend	trans	-82.9	145.7	176.3	56	0	0	0	0	111.5	N38 R78 S97	N38-S95 VanDerWaalsContact OD1-CA 3.31Å; N38-S95 WeakPolarHBondContact OD1-CA 3.3Å; R78-S95 WeakPolarHBondContact CA-OG 3.03Å; R78-S95 WeakPolarHBondContact CB-O 3.33Å; R78-S95 WeakPolarHBondContact CD-O 3.49Å; R78-S95 PolarHBondContact NH1-O 2.83Å; R78-S95 VanDerWaalsContact NH1-O 3.08Å; R78-S95 PolarHBondContact O-N 2.67Å; R78-S95 PolarHBondContact O-OG 3.15Å; S95-S97 PolarHBondContact O-N 3.33Å
96	S	98	Very high	96.3	Very high	61 Å²	61	65 Å²	65	43%	0.427	34%	0.344	S	S	.	.	S	Bend	trans	46.1	60.3	175.5	-178.9	0	0	0	0	111.7	N38 R78	N38-S96 PolarHBondContact OD1-N 2.98Å; R78-S96 PolarHBondContact NH1-O 3.41Å
97	S	97.4	Very high	96.5	Very high	7 Å²	7	56 Å²	56	5%	0.049	31%	0.306	C	S	.	.			trans	-51.6	137.8	-174.7	-73.6	0	0	0	0	112.1	E35 G36 E37 S95	E35-S97 WeakPolarHBondContact CA-O 3.39Å; E35-S97 WeakPolarHBondContact CG-O 3.23Å; G36-S97 PolarHBondContact N-O 3.08Å; E37-S97 VanDerWaalsContact O-CB 3.29Å; E37-S97 WeakPolarHBondContact O-CB 3.48Å; E37-S97 PolarHBondContact O-N 3.03Å; E37-S97 PolarHBondContact O-OG 2.83Å; S95-S97 PolarHBondContact O-N 3.33Å
98	Q	97	Very high	96.5	Very high	83 Å²	83	51.2 Å²	51.2	39%	0.388	29%	0.29	S	S	.	.			trans	-109.1	156	176	-65.3	178	8.7	0	0	109.6	T100 D101	Q98-T100 PolarHBondContact O-N 2.98Å; Q98-T100 VanDerWaalsContact O-N 3.11Å; Q98-D101 PolarHBondContact N-OD2 2.92Å; Q98-D101 WeakPolarHBondContact O-CB 3.44Å; Q98-D101 PolarHBondContact O-N 2.89Å
99	I	94.8	Very high	96.3	Very high	116 Å²	116	46.7 Å²	46.7	60%	0.595	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-54.9	-34.1	176.1	-57.8	-58.3	0	0	0	111.6	E35 D101 S102	E35-I99 HydrophobicContact CB-CD1 4.38Å; I99-D101 VanDerWaalsContact C-N 3.25Å; I99-D101 PolarHBondContact O-N 3.31Å; I99-S102 VanDerWaalsContact O-CB 3.23Å; I99-S102 WeakPolarHBondContact O-CB 3.46Å; I99-S102 PolarHBondContact O-N 2.84Å; I99-S102 VanDerWaalsContact O-N 3.17Å; I99-S102 PolarHBondContact O-OG 3.23Å
100	T	93.8	Very high	95.6	Very high	106 Å²	106	49.1 Å²	49.1	65%	0.65	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-69.1	-14.7	177.4	49.6	0	0	0	0	114.8	Q98 S102	Q98-T100 PolarHBondContact O-N 2.98Å; Q98-T100 VanDerWaalsContact O-N 3.11Å; T100-S102 VanDerWaalsContact C-N 3.26Å
101	D	94.7	Very high	95.6	Very high	24 Å²	24	51.5 Å²	51.5	13%	0.128	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-80.1	-10.8	173.2	-58.8	-36.2	0	0	0	112.1	R78 Q98 I99 G103 Y105	R78-D101 IonicContact CZ-OD1 3.78Å; R78-D101 IonicContact CZ-OD2 3.23Å; R78-D101 VanDerWaalsContact CZ-OD2 3.23Å; R78-D101 IonicContact NH1-OD1 3.87Å; R78-D101 IonicContact NH1-OD2 2.69Å; R78-D101 PolarHBondContact NH1-OD2 3.31Å; R78-D101 IonicContact NH2-OD1 2.8Å; R78-D101 PolarHBondContact NH2-OD1 2.79Å; R78-D101 IonicContact NH2-OD2 2.9Å; R78-D101 PolarHBondContact NH2-OD2 3.08Å; Q98-D101 PolarHBondContact N-OD2 2.92Å; Q98-D101 WeakPolarHBondContact O-CB 3.44Å; Q98-D101 PolarHBondContact O-N 2.89Å; I99-D101 VanDerWaalsContact C-N 3.25Å; I99-D101 PolarHBondContact O-N 3.31Å; D101-G103 PolarHBondContact O-N 2.8Å; D101-Y105 WeakPolarHBondContact O-CE2 3.49Å; D101-Y105 PolarHBondContact O-OH 2.91Å
102	S	94.2	Very high	95.4	Very high	83 Å²	83	53.1 Å²	53.1	58%	0.58	31%	0.312	S	S	*	.			trans	-61.8	120.3	-179.4	-57.2	0	0	0	0	110.8	Y56 I99 T100	Y56-S102 PolarHBondContact OH-O 3Å; I99-S102 VanDerWaalsContact O-CB 3.23Å; I99-S102 WeakPolarHBondContact O-CB 3.46Å; I99-S102 PolarHBondContact O-N 2.84Å; I99-S102 VanDerWaalsContact O-N 3.17Å; I99-S102 PolarHBondContact O-OG 3.23Å; T100-S102 VanDerWaalsContact C-N 3.26Å
103	G	94.4	Very high	95.2	Very high	49 Å²	49	56.1 Å²	56.1	51%	0.505	33%	0.329	S	S	.	.	S	Bend	trans	168.3	-169.7	175.5	0	0	0	0	0	112.5	D101	D101-G103 PolarHBondContact O-N 2.8Å
104	T	96.1	Very high	95	Very high	71 Å²	71	56.1 Å²	56.1	44%	0.436	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.8	-178.3	-54.1	0	0	0	0	110	Q57 L106	Q57-T104 PolarHBondContact N-O 2.86Å; T104-L106 HydrophobicContact CG2-CD2 4.03Å; T104-L106 HydrophobicContact CG2-CG 4.19Å
105	Y	97.4	Very high	94.8	Very high	28 Å²	28	59.2 Å²	59.2	11%	0.11	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.3	173.4	-69.6	-96.1	0	0	0	110.1	Q26 L41 F55 Y56 L92 I94 D101	Q26-Y105 PolarHBondContact NE2-O 3.19Å; L41-Y105 VanDerWaalsContact CD1-CB 3.4Å; L41-Y105 HydrophobicContact CD1-CD2 4.19Å; L41-Y105 HydrophobicContact CD1-CG 3.92Å; F55-Y105 CarbonylContact O-C 3.42Å; F55-Y105 VanDerWaalsContact O-CA 3.27Å; F55-Y105 WeakPolarHBondContact O-CA 3.32Å; Y56-Y105 HydrophobicContact CD2-CD1 4.14Å; Y56-Y105 HydrophobicContact CD2-CD2 4.23Å; Y56-Y105 AromaticContact CD2-CE1 3.69Å; Y56-Y105 HydrophobicContact CD2-CE1 3.69Å; Y56-Y105 AromaticContact CD2-CE2 3.78Å; Y56-Y105 HydrophobicContact CD2-CE2 3.78Å; Y56-Y105 HydrophobicContact CD2-CG 4.4Å; Y56-Y105 AromaticContact CD2-CZ 3.49Å; Y56-Y105 VanDerWaalsContact CD2-CZ 3.49Å; Y56-Y105 HydrophobicContact CE2-CE2 4.05Å; Y56-Y105 HydrophobicContact CG-CE1 4.26Å; L92-Y105 HydrophobicContact CD2-CD1 3.47Å; L92-Y105 VanDerWaalsContact CD2-CD1 3.47Å; L92-Y105 HydrophobicContact CD2-CE1 4Å; L92-Y105 HydrophobicContact CD2-CG 4.14Å; I94-Y105 HydrophobicContact CD1-CE1 4.1Å; I94-Y105 HydrophobicContact CD1-CE2 3.97Å; D101-Y105 WeakPolarHBondContact O-CE2 3.49Å; D101-Y105 PolarHBondContact O-OH 2.91Å
106	L	96.9	Very high	94.6	Very high	63 Å²	63	60.8 Å²	60.8	33%	0.33	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	138	-177.9	-60.6	173.2	0	0	0	109.5	F55 L63 T104	F55-L106 HydrophobicContact CB-CB 4.45Å; F55-L106 PolarHBondContact N-O 2.82Å; F55-L106 PolarHBondContact O-N 2.93Å; L63-L106 HydrophobicContact CD2-CD1 3.93Å; T104-L106 HydrophobicContact CG2-CD2 4.03Å; T104-L106 HydrophobicContact CG2-CG 4.19Å
107	C	96.7	Very high	94.3	Very high	13 Å²	13	60.8 Å²	60.8	9%	0.088	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	147.5	167.7	70.4	0	0	0	0	110.2	V24 Q26 C43 M52 Q53 W54	V24-C107 WeakPolarHBondContact CG1-SG 3.05Å; Q26-C107 HydrophobicContact CG-CB 4.44Å; Q26-C107 WeakPolarHBondContact CG-SG 3.31Å; Q26-C107 PolarHBondContact OE1-SG 3.41Å; Q26-C107 VanDerWaalsContact OE1-SG 3.42Å; C43-C107 HydrophobicContact CB-CB 3.58Å; C43-C107 WeakPolarHBondContact CB-SG 3.42Å; C43-C107 WeakPolarHBondContact SG-CB 3.32Å; C43-C107 CovalentContact SG-SG 2.02Å; C43-C107 PolarHBondContact SG-SG 3.49Å; M52-C107 HydrophobicContact SD-CB 3.71Å; Q53-C107 CarbonylContact O-C 3.54Å; Q53-C107 WeakPolarHBondContact O-CA 3.31Å; W54-C107 HydrophobicContact CD2-CB 4.02Å; W54-C107 HydrophobicContact CE3-CB 3.83Å; W54-C107 HydrophobicContact CH2-CB 3.9Å; W54-C107 HydrophobicContact CZ2-CB 4.06Å; W54-C107 HydrophobicContact CZ3-CB 3.78Å
108	A	94.7	Very high	94.1	Very high	35 Å²	35	64.9 Å²	64.9	29%	0.289	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	139.8	173.6	0	0	0	0	0	109.9	Q53 F55	Q53-A108 PolarHBondContact N-O 2.92Å; Q53-A108 PolarHBondContact O-N 3.31Å; F55-A108 HydrophobicContact CD2-CB 4.42Å; F55-A108 HydrophobicContact CE2-CB 3.88Å
109	M	90.5	Very high	93.9	Very high	36 Å²	36	63.4 Å²	63.4	18%	0.177	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	146.8	169	52.6	173.9	44.4	0	0	110.7	Q22 V24 F45 L49	Q22-M109 HydrophobicContact CB-CE 4.46Å; Q22-M109 HydrophobicContact CB-SD 3.52Å; Q22-M109 VanDerWaalsContact CB-SD 3.52Å; Q22-M109 VanDerWaalsContact CD-SD 3.58Å; Q22-M109 HydrophobicContact CG-SD 4.05Å; Q22-M109 PolarHBondContact NE2-SD 3.33Å; V24-M109 HydrophobicContact CG2-CE 3.73Å; V24-M109 HydrophobicContact CG2-CG 4.01Å; V24-M109 HydrophobicContact CG2-SD 4.17Å; F45-M109 HydrophobicContact CB-CE 3.43Å; F45-M109 VanDerWaalsContact CB-CE 3.43Å; F45-M109 HydrophobicContact CD2-CE 4.46Å; F45-M109 HydrophobicContact CG-CE 4.21Å; L49-M109 HydrophobicContact CB-CB 4.1Å; L49-M109 HydrophobicContact CD2-CB 3.74Å; L49-M109 HydrophobicContact CD2-CE 4.35Å
110	E	82.3	Confident	93.8	Very high	137 Å²	137	58.6 Å²	58.6	64%	0.64	36%	0.358	S	S	*	.			trans	-125.6	0	168.6	-170.6	173.8	-177	0	0	111.1	N50 S51 Y68	N50-E110 WeakPolarHBondContact CB-O 3.49Å; N50-E110 PolarHBondContact N-O 3.08Å; S51-E110 PolarHBondContact N-O 2.78Å; S51-E110 PolarHBondContact O-N 3.05Å; Y68-E110 VanDerWaalsContact CE2-OE2 3.31Å; Y68-E110 WeakPolarHBondContact CE2-OE2 3.5Å

Retrieved 110 of 110 residues in 91 ms (Link to these results)

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