X5J4V8_MOUSE Loading...

IgA heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4V8, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 92 aa.

						>X5J4V8_MOUSE|X5J4V8
PELARPGASVKLSCKAVGYSFTSYGISWVKQRTGQGLEWIGEIYPRSGNNYYNENFKGKATLTADTSSSTAYMELRSLSSEDSAVYFCARGG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	P	65.8	Low	86.7	Confident	180 Å²	180	103.9 Å²	103.9	100%	1.169	59%	0.594	S	S	*	*				0	120.9	0	5.9	15.6	0	0	0	110.2
2	E	75.5	Confident	87.5	Confident	120 Å²	120	98.2 Å²	98.2	56%	0.561	56%	0.56	S	S	*	*			trans	-103.3	123.1	178.8	-162.1	163.3	179.9	0	0	108.6	V10 L12	E2-V10 HydrophobicContact CB-CG2 4.31Å; E2-V10 HydrophobicContact CG-CG2 3.56Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.38Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.49Å; E2-L12 WeakPolarHBondContact OE2-CD2 3.44Å
3	L	81.3	Confident	88.2	Confident	176 Å²	176	97.2 Å²	97.2	92%	0.921	56%	0.563	S	S	*	*			trans	-110	116.5	-178.9	-81.2	153.1	0	0	0	107.8
4	A	85.8	Confident	88.8	Confident	51 Å²	51	91.3 Å²	91.3	42%	0.421	53%	0.53	S	S	.	.			trans	-121	149.9	-179.3	0	0	0	0	0	110.7	A8 L78	A4-A8 HydrophobicContact CB-CB 4.47Å; A4-L78 HydrophobicContact CB-CD1 3.46Å; A4-L78 VanDerWaalsContact CB-CD1 3.46Å
5	R	87.2	Confident	89.4	Confident	214 Å²	214	95.1 Å²	95.1	81%	0.808	54%	0.538	S	S	*	.			trans	-74.1	150.1	174.8	-63.1	-178.7	-176.5	-172.1	0.8	109.7	G7 A8	R5-G7 PolarHBondContact O-N 3.25Å; R5-A8 WeakPolarHBondContact O-CB 3.4Å; R5-A8 PolarHBondContact O-N 2.98Å
6	P	88.8	Confident	89.7	Confident	118 Å²	118	89.8 Å²	89.8	77%	0.766	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	139.5	169.5	-24.7	34.1	0	0	0	111.3	A8	P6-A8 PolarHBondContact O-N 3.4Å
7	G	90	Very high	89.8	Confident	55 Å²	55	91.5 Å²	91.5	57%	0.567	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-10.4	-176.5	0	0	0	0	0	115.2	R5 L78	R5-G7 PolarHBondContact O-N 3.25Å; G7-L78 PolarHBondContact N-O 3.03Å
8	A	93.7	Very high	90	Very high	35 Å²	35	91.1 Å²	91.1	29%	0.289	54%	0.541	S	S	.	.			trans	-72.7	168.6	174.3	0	0	0	0	0	111.7	A4 R5 P6 S77 L78	A4-A8 HydrophobicContact CB-CB 4.47Å; R5-A8 WeakPolarHBondContact O-CB 3.4Å; R5-A8 PolarHBondContact O-N 2.98Å; P6-A8 PolarHBondContact O-N 3.4Å; A8-S77 PolarHBondContact O-N 2.93Å; A8-L78 WeakPolarHBondContact O-CB 3.45Å; A8-L78 VanDerWaalsContact O-CG 3.29Å; A8-L78 WeakPolarHBondContact O-CG 3.37Å; A8-L78 PolarHBondContact O-N 3.3Å
9	S	94.4	Very high	89.9	Confident	63 Å²	63	90.4 Å²	90.4	44%	0.441	53%	0.528	S	S	.	.			trans	-106.5	150	168.1	-57.6	0	0	0	0	110.1	L75	S9-L75 CarbonylContact C-O 3.6Å; S9-L75 WeakPolarHBondContact CA-O 3.25Å; S9-L75 WeakPolarHBondContact CB-O 3.36Å
10	V	94.9	Very high	90	Very high	15 Å²	15	88.9 Å²	88.9	9%	0.091	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.9	178.1	70.6	0	0	0	0	109.5	E2 E74 L75 L78	E2-V10 HydrophobicContact CB-CG2 4.31Å; E2-V10 HydrophobicContact CG-CG2 3.56Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.38Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.49Å; V10-E74 CarbonylContact O-C 3.56Å; V10-E74 VanDerWaalsContact O-CA 3.31Å; V10-E74 WeakPolarHBondContact O-CA 3.34Å; V10-L75 HydrophobicContact CG1-CB 3.88Å; V10-L75 HydrophobicContact CG1-CD1 4.28Å; V10-L75 PolarHBondContact N-O 3.02Å; V10-L75 PolarHBondContact O-N 3.07Å; V10-L78 HydrophobicContact CB-CD1 3.89Å; V10-L78 HydrophobicContact CG1-CD1 3.77Å; V10-L78 HydrophobicContact CG1-CD2 4.07Å; V10-L78 HydrophobicContact CG1-CG 4.35Å
11	K	96.1	Very high	90.2	Very high	116 Å²	116	84.9 Å²	84.9	50%	0.504	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	105.9	-179.5	-173.2	178	179.7	180	0	110.6	Y72 M73	K11-Y72 HydrophobicContact CD-CD1 4.46Å; K11-Y72 VanDerWaalsContact CE-CD1 3.48Å; K11-Y72 HydrophobicContact CG-CD1 4.45Å; K11-M73 WeakPolarHBondContact CA-O 3.41Å
12	L	96.3	Very high	91.6	Very high	35 Å²	35	78.9 Å²	78.9	18%	0.183	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	147.4	175.4	-58	178.5	0	0	0	110.3	E2 W28 Y72 M73 Y86	E2-L12 WeakPolarHBondContact OE2-CD2 3.44Å; L12-W28 HydrophobicContact CB-CH2 4.11Å; L12-W28 HydrophobicContact CB-CZ3 3.93Å; L12-Y72 WeakPolarHBondContact O-CA 3.35Å; L12-M73 HydrophobicContact CD1-CE 3.64Å; L12-M73 PolarHBondContact N-O 2.79Å; L12-M73 PolarHBondContact O-N 3.33Å; L12-Y86 HydrophobicContact CD1-CD1 4.31Å; L12-Y86 HydrophobicContact CD1-CD2 4.05Å; L12-Y86 HydrophobicContact CD1-CG 3.73Å
13	S	97.2	Very high	92.5	Very high	85 Å²	85	76.8 Å²	76.8	59%	0.594	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	146.1	177.2	66.1	0	0	0	0	111.2	A71	S13-A71 CarbonylContact C-O 3.58Å; S13-A71 WeakPolarHBondContact CA-O 3.47Å
14	C	96.7	Very high	93	Very high	15 Å²	15	71.7 Å²	71.7	10%	0.101	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	104.7	179.1	177.8	0	0	0	0	109.2	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.69Å; C14-W28 HydrophobicContact CB-CZ2 3.83Å; C14-T70 CarbonylContact O-C 3.54Å; C14-T70 WeakPolarHBondContact O-CA 3.46Å; C14-A71 HydrophobicContact CB-CB 4.38Å; C14-A71 PolarHBondContact N-O 3.24Å; C14-A71 PolarHBondContact O-N 2.82Å; C14-C88 HydrophobicContact CB-CB 3.49Å; C14-C88 VanDerWaalsContact CB-CB 3.49Å; C14-C88 WeakPolarHBondContact CB-SG 3.37Å; C14-C88 WeakPolarHBondContact SG-CB 3.44Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.6Å
15	K	96.6	Very high	93.5	Very high	149 Å²	149	69.5 Å²	69.5	65%	0.648	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	124.8	-179	-173	172.6	-175.7	176.3	0	110.6	V17	K15-V17 HydrophobicContact CG-CG2 4.41Å
16	A	94.2	Very high	94	Very high	9 Å²	9	59.3 Å²	59.3	7%	0.074	37%	0.371	C	S	.	.			trans	-83.4	136.2	173.6	0	0	0	0	0	111	Y19 F21 S69	A16-Y19 HydrophobicContact CB-CE1 3.82Å; A16-Y19 HydrophobicContact CB-CE2 3.88Å; A16-Y19 VanDerWaalsContact CB-OH 3.24Å; A16-Y19 WeakPolarHBondContact CB-OH 3.27Å; A16-F21 HydrophobicContact CB-CB 4.08Å; A16-F21 HydrophobicContact CB-CD2 3.41Å; A16-F21 VanDerWaalsContact CB-CD2 3.41Å; A16-F21 HydrophobicContact CB-CE2 4.16Å; A16-F21 HydrophobicContact CB-CG 4.09Å; A16-S69 PolarHBondContact N-O 3.32Å
17	V	93	Very high	94.3	Very high	119 Å²	119	54.6 Å²	54.6	72%	0.721	34%	0.34	S	S	*	.			trans	-138.1	136	177.6	-175.7	0	0	0	0	108.7	K15 Y19	K15-V17 HydrophobicContact CG-CG2 4.41Å; V17-Y19 WeakPolarHBondContact O-CD1 3.28Å
18	G	91.7	Very high	94.7	Very high	85 Å²	85	52.2 Å²	52.2	88%	0.876	31%	0.314	S	S	*	.	S	Bend	trans	85.1	10.5	173.8	0	0	0	0	0	116
19	Y	88.9	Confident	94.9	Very high	77 Å²	77	51.6 Å²	51.6	30%	0.302	31%	0.307	S	S	.	.	S	Bend	trans	-152.3	166	173.9	63.5	-88.6	0	0	0	112.2	A16 V17 F21 Y24 R90	A16-Y19 HydrophobicContact CB-CE1 3.82Å; A16-Y19 HydrophobicContact CB-CE2 3.88Å; A16-Y19 VanDerWaalsContact CB-OH 3.24Å; A16-Y19 WeakPolarHBondContact CB-OH 3.27Å; V17-Y19 WeakPolarHBondContact O-CD1 3.28Å; Y19-F21 PolarHBondContact O-N 3.33Å; Y19-Y24 AromaticContact CD2-CD2 3.63Å; Y19-Y24 HydrophobicContact CD2-CD2 3.63Å; Y19-Y24 AromaticContact CD2-CE2 3.96Å; Y19-Y24 HydrophobicContact CD2-CE2 3.96Å; Y19-Y24 HydrophobicContact CE2-CD2 4.02Å; Y19-R90 HydrophobicContact CE2-CG 4.07Å
20	S	92.6	Very high	94.9	Very high	61 Å²	61	48.7 Å²	48.7	43%	0.427	29%	0.286	S	S	.	.			trans	-71.5	97.8	174.4	179.3	0	0	0	0	110.5	T22 S23 Y24	S20-T22 PolarHBondContact O-N 2.84Å; S20-S23 WeakPolarHBondContact CB-OG 3.19Å; S20-S23 WeakPolarHBondContact O-CB 3.34Å; S20-S23 PolarHBondContact O-N 2.92Å; S20-S23 PolarHBondContact OG-OG 2.98Å; S20-Y24 WeakPolarHBondContact O-CD2 3.34Å
21	F	94	Very high	94.9	Very high	5 Å²	5	51.7 Å²	51.7	2%	0.022	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-54.2	-37.5	-176.7	176.3	-116.1	0	0	0	113.5	A16 Y19 S23 I26 P45 A64 A71	A16-F21 HydrophobicContact CB-CB 4.08Å; A16-F21 HydrophobicContact CB-CD2 3.41Å; A16-F21 VanDerWaalsContact CB-CD2 3.41Å; A16-F21 HydrophobicContact CB-CE2 4.16Å; A16-F21 HydrophobicContact CB-CG 4.09Å; Y19-F21 PolarHBondContact O-N 3.33Å; F21-S23 PolarHBondContact O-N 3Å; F21-I26 HydrophobicContact CD2-CD1 4.03Å; F21-I26 HydrophobicContact CD2-CG1 4.3Å; F21-I26 HydrophobicContact CE2-CD1 3.78Å; F21-I26 HydrophobicContact CE2-CG1 3.62Å; F21-I26 HydrophobicContact CZ-CG1 4.29Å; F21-P45 HydrophobicContact CD1-CB 3.82Å; F21-P45 HydrophobicContact CD1-CG 4.04Å; F21-P45 HydrophobicContact CD2-CG 4.34Å; F21-P45 HydrophobicContact CE1-CB 3.47Å; F21-P45 VanDerWaalsContact CE1-CB 3.47Å; F21-P45 HydrophobicContact CE1-CG 3.63Å; F21-P45 HydrophobicContact CE2-CG 3.98Å; F21-P45 HydrophobicContact CG-CG 4.4Å; F21-P45 HydrophobicContact CZ-CB 3.96Å; F21-P45 HydrophobicContact CZ-CG 3.58Å; F21-A64 HydrophobicContact CE1-CB 4.1Å; F21-A64 HydrophobicContact CZ-CB 4.08Å; F21-A71 HydrophobicContact CE2-CB 4.21Å; F21-A71 HydrophobicContact CZ-CB 3.98Å
22	T	94.9	Very high	94.8	Very high	54 Å²	54	49 Å²	49	33%	0.331	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-73.8	-12.2	-179.1	54.6	0	0	0	0	113.6	S20 R46 T66	S20-T22 PolarHBondContact O-N 2.84Å; T22-R46 VanDerWaalsContact O-CB 3.23Å; T22-R46 WeakPolarHBondContact O-CB 2.97Å; T22-T66 HydrophobicContact CG2-CG2 3.76Å
23	S	93.3	Very high	94.3	Very high	75 Å²	75	54.5 Å²	54.5	52%	0.524	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-85.5	-8.5	-178.6	-60.4	0	0	0	0	113.9	S20 F21	S20-S23 WeakPolarHBondContact CB-OG 3.19Å; S20-S23 WeakPolarHBondContact O-CB 3.34Å; S20-S23 PolarHBondContact O-N 2.92Å; S20-S23 PolarHBondContact OG-OG 2.98Å; F21-S23 PolarHBondContact O-N 3Å
24	Y	93.4	Very high	93.9	Very high	70 Å²	70	54.6 Å²	54.6	28%	0.275	34%	0.335	S	S	.	.	S	Bend	trans	-130.8	147.5	-172.9	-61.5	-77.3	0	0	0	112.2	Y19 S20 P45 R90 G91	Y19-Y24 AromaticContact CD2-CD2 3.63Å; Y19-Y24 HydrophobicContact CD2-CD2 3.63Å; Y19-Y24 AromaticContact CD2-CE2 3.96Å; Y19-Y24 HydrophobicContact CD2-CE2 3.96Å; Y19-Y24 HydrophobicContact CE2-CD2 4.02Å; S20-Y24 WeakPolarHBondContact O-CD2 3.34Å; Y24-P45 WeakPolarHBondContact O-CD 3.39Å; Y24-R90 HydrophobicContact CD1-CG 4.03Å; Y24-R90 HydrophobicContact CD2-CG 4.14Å; Y24-R90 HydrophobicContact CG-CG 3.65Å; Y24-G91 VanDerWaalsContact CD1-O 3.28Å; Y24-G91 WeakPolarHBondContact CD1-O 3.38Å
25	G	95.3	Very high	93.4	Very high	4 Å²	4	59.2 Å²	59.2	4%	0.041	36%	0.355	C	S	.	.			trans	-65.6	147.7	161.9	0	0	0	0	0	110.5	I43 G91	G25-I43 CarbonylContact C-O 3.57Å; G25-I43 WeakPolarHBondContact CA-O 3.03Å; G25-G91 PolarHBondContact O-N 3.38Å
26	I	96.9	Very high	93.1	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.7	172.5	-51	-65.2	0	0	0	107.8	F21 E42 I43 P45 A71 C88	F21-I26 HydrophobicContact CD2-CD1 4.03Å; F21-I26 HydrophobicContact CD2-CG1 4.3Å; F21-I26 HydrophobicContact CE2-CD1 3.78Å; F21-I26 HydrophobicContact CE2-CG1 3.62Å; F21-I26 HydrophobicContact CZ-CG1 4.29Å; I26-E42 WeakPolarHBondContact O-CA 3.15Å; I26-I43 HydrophobicContact CB-CG2 4.02Å; I26-I43 PolarHBondContact N-O 3.49Å; I26-I43 PolarHBondContact O-N 2.84Å; I26-P45 HydrophobicContact CG1-CG 4.03Å; I26-A71 HydrophobicContact CB-CB 4.2Å; I26-A71 HydrophobicContact CG1-CB 4.32Å; I26-A71 HydrophobicContact CG2-CB 3.83Å; I26-C88 HydrophobicContact CG2-CB 4.3Å
27	S	97.1	Very high	93.1	Very high	18 Å²	18	60.1 Å²	60.1	13%	0.126	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	139.6	179.1	-83.8	0	0	0	0	110.9	W39 G41 E42 C88 A89	S27-W39 PolarHBondContact OG-NE1 3.15Å; S27-G41 CarbonylContact C-O 3.56Å; S27-G41 WeakPolarHBondContact CA-O 3.3Å; S27-E42 PolarHBondContact OG-OE1 2.81Å; S27-C88 CarbonylContact O-C 3.38Å; S27-C88 VanDerWaalsContact O-CA 3.3Å; S27-C88 WeakPolarHBondContact O-CA 3.33Å; S27-A89 PolarHBondContact N-O 2.61Å; S27-A89 PolarHBondContact O-N 3.41Å
28	W	97.6	Very high	93.2	Very high	6 Å²	6	56.7 Å²	56.7	2%	0.023	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133	174.7	-69.9	88.2	0	0	0	110.1	L12 C14 I40 G41 L62 A71 M73 F87 C88	L12-W28 HydrophobicContact CB-CH2 4.11Å; L12-W28 HydrophobicContact CB-CZ3 3.93Å; C14-W28 HydrophobicContact CB-CH2 3.69Å; C14-W28 HydrophobicContact CB-CZ2 3.83Å; W28-I40 HydrophobicContact CB-CB 4.18Å; W28-I40 HydrophobicContact CB-CD1 4.3Å; W28-I40 WeakPolarHBondContact O-CB 3.46Å; W28-I40 PolarHBondContact O-N 3.44Å; W28-G41 PolarHBondContact N-O 2.85Å; W28-L62 HydrophobicContact CG-CD2 4.05Å; W28-A71 HydrophobicContact CZ2-CB 4.16Å; W28-M73 HydrophobicContact CB-SD 3.97Å; W28-M73 HydrophobicContact CD2-CB 3.71Å; W28-M73 HydrophobicContact CD2-CE 4.39Å; W28-M73 HydrophobicContact CD2-SD 4.15Å; W28-M73 HydrophobicContact CE3-CB 3.87Å; W28-M73 HydrophobicContact CE3-CE 3.81Å; W28-M73 HydrophobicContact CE3-SD 4.17Å; W28-M73 HydrophobicContact CG-CB 4.28Å; W28-M73 HydrophobicContact CG-SD 4.09Å; W28-M73 HydrophobicContact CH2-CB 4.05Å; W28-M73 HydrophobicContact CZ2-CB 3.92Å; W28-M73 HydrophobicContact CZ3-CB 4.04Å; W28-M73 HydrophobicContact CZ3-CE 4.34Å; W28-F87 WeakPolarHBondContact CA-O 3.47Å; W28-C88 HydrophobicContact CD2-CB 4.33Å; W28-C88 HydrophobicContact CE3-CB 4.17Å; W28-C88 HydrophobicContact CH2-CB 4.31Å; W28-C88 HydrophobicContact CZ2-CB 4.44Å; W28-C88 HydrophobicContact CZ3-CB 4.17Å
29	V	96.8	Very high	93.4	Very high	22 Å²	22	57.1 Å²	57.1	13%	0.133	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.4	-173.7	-174.5	0	0	0	0	109.6	L37 E38 Y86 F87	V29-L37 HydrophobicContact CG1-CB 3.77Å; V29-L37 HydrophobicContact CG1-CD2 3.89Å; V29-L37 HydrophobicContact CG1-CG 4.28Å; V29-E38 WeakPolarHBondContact CA-O 3.45Å; V29-Y86 WeakPolarHBondContact O-CA 3.29Å; V29-F87 PolarHBondContact N-O 3.32Å; V29-F87 PolarHBondContact O-N 3.42Å
30	K	95.8	Very high	93.8	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.009	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137.5	173.8	-175.6	179.9	-178	178.9	0	109.6	E38 I40 F56 E81 D82 A84 Y86	K30-E38 HydrophobicContact CB-CB 4.42Å; K30-E38 PolarHBondContact N-O 2.02Å; K30-E38 PolarHBondContact O-N 3.08Å; K30-I40 HydrophobicContact CB-CD1 4.03Å; K30-I40 HydrophobicContact CB-CG1 4.16Å; K30-F56 HydrophobicContact CD-CE1 4.01Å; K30-F56 HydrophobicContact CD-CZ 3.94Å; K30-E81 VanDerWaalsContact CE-O 3.28Å; K30-E81 WeakPolarHBondContact CE-O 3.33Å; K30-E81 PolarHBondContact NZ-O 3.04Å; K30-D82 IonicContact NZ-OD1 2.87Å; K30-D82 PolarHBondContact NZ-OD1 3.12Å; K30-A84 HydrophobicContact CD-CB 4.16Å; K30-A84 HydrophobicContact CG-CB 3.51Å; K30-Y86 HydrophobicContact CB-CD1 4.16Å; K30-Y86 HydrophobicContact CB-CE1 3.9Å; K30-Y86 HydrophobicContact CD-CE1 4.03Å; K30-Y86 HydrophobicContact CG-CD1 4.31Å; K30-Y86 HydrophobicContact CG-CE1 3.76Å
31	Q	95.3	Very high	94	Very high	77 Å²	77	50.6 Å²	50.6	36%	0.36	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	117.4	172.7	-169.6	179.9	38.6	0	0	109.9	L37 A84 V85 F87	Q31-L37 HydrophobicContact CB-CD2 3.75Å; Q31-L37 HydrophobicContact CG-CD2 3.82Å; Q31-A84 WeakPolarHBondContact O-CB 3.44Å; Q31-V85 PolarHBondContact N-O 2.87Å; Q31-V85 PolarHBondContact O-N 3Å; Q31-F87 HydrophobicContact CB-CD2 4.32Å; Q31-F87 HydrophobicContact CB-CE2 3.77Å; Q31-F87 VanDerWaalsContact OE1-CE2 3.29Å
32	R	92.3	Very high	94.2	Very high	60 Å²	60	51.6 Å²	51.6	23%	0.226	30%	0.301	C	S	.	.			trans	-96.8	143.9	170	-58.7	-170.2	-139.3	-172.5	-4.3	109.9	G34 Q35 E38 E81 A84	R32-G34 PolarHBondContact O-N 3.12Å; R32-Q35 HydrophobicContact CB-CB 4.08Å; R32-Q35 HydrophobicContact CB-CG 4.25Å; R32-Q35 PolarHBondContact O-N 2.71Å; R32-E38 IonicContact NH2-OE2 3.99Å; R32-E81 PolarHBondContact NE-O 3.46Å; R32-E81 PolarHBondContact NH1-O 3.44Å; R32-A84 HydrophobicContact CG-CB 3.97Å
33	T	87.3	Confident	94.3	Very high	150 Å²	150	49.3 Å²	49.3	92%	0.92	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	125.4	175.9	-50.8	0	0	0	0	110.1	Q35	T33-Q35 VanDerWaalsContact C-N 3.26Å; T33-Q35 PolarHBondContact O-N 2.88Å
34	G	88	Confident	94.4	Very high	87 Å²	87	50 Å²	50	90%	0.897	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	1.7	-177.8	0	0	0	0	0	115.3	R32	R32-G34 PolarHBondContact O-N 3.12Å
35	Q	87.4	Confident	94.5	Very high	112 Å²	112	47.2 Å²	47.2	52%	0.523	27%	0.269	S	S	.	.	S	Bend	trans	-116.9	163.2	171.5	-59.7	-176	-20	0	0	110.7	R32 T33	R32-Q35 HydrophobicContact CB-CB 4.08Å; R32-Q35 HydrophobicContact CB-CG 4.25Å; R32-Q35 PolarHBondContact O-N 2.71Å; T33-Q35 VanDerWaalsContact C-N 3.26Å; T33-Q35 PolarHBondContact O-N 2.88Å
36	G	90	Very high	94.5	Very high	59 Å²	59	57.2 Å²	57.2	61%	0.608	31%	0.306	S	S	*	.			trans	-68.9	178.5	174.8	0	0	0	0	0	113.3
37	L	93.7	Very high	94.4	Very high	118 Å²	118	60.5 Å²	60.5	62%	0.618	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	129.7	168.9	-66.3	175.9	0	0	0	109.7	V29 Q31	V29-L37 HydrophobicContact CG1-CB 3.77Å; V29-L37 HydrophobicContact CG1-CD2 3.89Å; V29-L37 HydrophobicContact CG1-CG 4.28Å; Q31-L37 HydrophobicContact CB-CD2 3.75Å; Q31-L37 HydrophobicContact CG-CD2 3.82Å
38	E	95.4	Very high	94.2	Very high	47 Å²	47	61.9 Å²	61.9	22%	0.22	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.6	176.1	-166	-179.3	-171.8	0	0	109	V29 K30 R32 N55 F56	V29-E38 WeakPolarHBondContact CA-O 3.45Å; K30-E38 HydrophobicContact CB-CB 4.42Å; K30-E38 PolarHBondContact N-O 2.02Å; K30-E38 PolarHBondContact O-N 3.08Å; R32-E38 IonicContact NH2-OE2 3.99Å; E38-N55 PolarHBondContact OE1-ND2 3.06Å; E38-N55 VanDerWaalsContact OE1-ND2 3.12Å; E38-F56 VanDerWaalsContact CD-CE2 3.4Å; E38-F56 VanDerWaalsContact CD-CZ 3.49Å; E38-F56 HydrophobicContact CG-CE2 3.73Å; E38-F56 HydrophobicContact CG-CZ 4.06Å; E38-F56 WeakPolarHBondContact OE1-CE2 3.39Å; E38-F56 WeakPolarHBondContact OE2-CZ 3.48Å
39	W	96.1	Very high	94	Very high	95 Å²	95	65.5 Å²	65.5	36%	0.36	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	129.8	177.5	-179.1	82.4	0	0	0	110.2	S27 G41 E42 N53	S27-W39 PolarHBondContact OG-NE1 3.15Å; W39-G41 PolarHBondContact NE1-O 2.88Å; W39-E42 HydrophobicContact CZ2-CB 3.81Å; W39-N53 HydrophobicContact CE3-CB 3.78Å; W39-N53 HydrophobicContact CZ3-CB 3.97Å; W39-N53 VanDerWaalsContact CZ3-N 3.32Å; W39-N53 WeakPolarHBondContact O-CB 3.28Å; W39-N53 PolarHBondContact O-ND2 3.45Å
40	I	97.1	Very high	94	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-46.8	-177	-57.1	175.9	0	0	0	110.1	W28 K30 N53 F56 A60 M73 Y86	W28-I40 HydrophobicContact CB-CB 4.18Å; W28-I40 HydrophobicContact CB-CD1 4.3Å; W28-I40 WeakPolarHBondContact O-CB 3.46Å; W28-I40 PolarHBondContact O-N 3.44Å; K30-I40 HydrophobicContact CB-CD1 4.03Å; K30-I40 HydrophobicContact CB-CG1 4.16Å; I40-N53 PolarHBondContact O-N 3.47Å; I40-F56 HydrophobicContact CB-CD1 4.44Å; I40-F56 HydrophobicContact CB-CD2 4.33Å; I40-F56 HydrophobicContact CB-CG 4.19Å; I40-F56 HydrophobicContact CG1-CD1 4.16Å; I40-F56 HydrophobicContact CG1-CD2 4.36Å; I40-F56 HydrophobicContact CG1-CE1 4.05Å; I40-F56 HydrophobicContact CG1-CE2 4.24Å; I40-F56 HydrophobicContact CG1-CG 4.31Å; I40-F56 HydrophobicContact CG1-CZ 4.08Å; I40-F56 HydrophobicContact CG2-CB 3.7Å; I40-F56 HydrophobicContact CG2-CD1 3.84Å; I40-F56 HydrophobicContact CG2-CD2 4.28Å; I40-F56 HydrophobicContact CG2-CG 3.67Å; I40-A60 HydrophobicContact CG2-CB 3.72Å; I40-M73 HydrophobicContact CD1-CE 3.77Å; I40-M73 HydrophobicContact CD1-SD 3.59Å; I40-M73 VanDerWaalsContact CD1-SD 3.59Å; I40-M73 HydrophobicContact CG2-SD 3.87Å; I40-Y86 HydrophobicContact CD1-CD1 3.72Å; I40-Y86 HydrophobicContact CD1-CE1 3.73Å
41	G	96.8	Very high	94	Very high	0 Å²	0	73 Å²	73	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.3	174.6	-173.1	0	0	0	0	0	112.5	S27 W28 W39 Y51	S27-G41 CarbonylContact C-O 3.56Å; S27-G41 WeakPolarHBondContact CA-O 3.3Å; W28-G41 PolarHBondContact N-O 2.85Å; W39-G41 PolarHBondContact NE1-O 2.88Å; G41-Y51 CarbonylContact C-O 3.54Å; G41-Y51 WeakPolarHBondContact CA-O 3.44Å
42	E	97.1	Very high	94.1	Very high	26 Å²	26	72.3 Å²	72.3	12%	0.121	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.5	178.7	179.1	166.7	-112.7	0	0	110.5	I26 S27 W39 Y44 N50 Y51	I26-E42 WeakPolarHBondContact O-CA 3.15Å; S27-E42 PolarHBondContact OG-OE1 2.81Å; W39-E42 HydrophobicContact CZ2-CB 3.81Å; E42-Y44 HydrophobicContact CG-CD2 4.4Å; E42-Y44 HydrophobicContact CG-CE2 3.92Å; E42-Y44 VanDerWaalsContact OE2-CE2 3.25Å; E42-Y44 WeakPolarHBondContact OE2-CE2 3.45Å; E42-Y44 VanDerWaalsContact OE2-CZ 3.29Å; E42-Y44 PolarHBondContact OE2-OH 2.77Å; E42-N50 CarbonylContact O-C 3.57Å; E42-N50 WeakPolarHBondContact O-CA 3.4Å; E42-Y51 PolarHBondContact N-O 2.82Å; E42-Y51 PolarHBondContact O-N 3.34Å
43	I	96.9	Very high	94.2	Very high	6 Å²	6	71.4 Å²	71.4	3%	0.031	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.5	171.8	-179.8	163.8	0	0	0	110.5	G25 I26 P45 N49 N50 L62 A64 A71	G25-I43 CarbonylContact C-O 3.57Å; G25-I43 WeakPolarHBondContact CA-O 3.03Å; I26-I43 HydrophobicContact CB-CG2 4.02Å; I26-I43 PolarHBondContact N-O 3.49Å; I26-I43 PolarHBondContact O-N 2.84Å; I43-P45 WeakPolarHBondContact O-CD 3.45Å; I43-N49 WeakPolarHBondContact CA-O 2.98Å; I43-N50 VanDerWaalsContact CB-OD1 3.24Å; I43-N50 WeakPolarHBondContact CB-OD1 2.96Å; I43-N50 VanDerWaalsContact CD1-OD1 3.29Å; I43-N50 WeakPolarHBondContact CD1-OD1 2.96Å; I43-N50 WeakPolarHBondContact CG1-OD1 3.24Å; I43-L62 HydrophobicContact CB-CB 4.16Å; I43-L62 HydrophobicContact CG2-CB 4.49Å; I43-A64 HydrophobicContact CD1-CB 3.66Å; I43-A64 HydrophobicContact CG1-CB 4.31Å; I43-A71 HydrophobicContact CG2-CB 4.45Å
44	Y	96.6	Very high	94.6	Very high	90 Å²	90	70.3 Å²	70.3	35%	0.353	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	104.2	170.7	-73.7	-95.2	0	0	0	109.5	E42 R46 S47 G48 N49 Y51	E42-Y44 HydrophobicContact CG-CD2 4.4Å; E42-Y44 HydrophobicContact CG-CE2 3.92Å; E42-Y44 VanDerWaalsContact OE2-CE2 3.25Å; E42-Y44 WeakPolarHBondContact OE2-CE2 3.45Å; E42-Y44 VanDerWaalsContact OE2-CZ 3.29Å; E42-Y44 PolarHBondContact OE2-OH 2.77Å; Y44-R46 PolarHBondContact O-N 3.37Å; Y44-R46 VanDerWaalsContact O-N 3.12Å; Y44-S47 WeakPolarHBondContact CB-OG 3.2Å; Y44-S47 PolarHBondContact O-N 2.8Å; Y44-G48 WeakPolarHBondContact O-CA 3.37Å; Y44-G48 PolarHBondContact O-N 3.28Å; Y44-N49 PolarHBondContact N-O 3.01Å; Y44-Y51 AromaticContact CD2-CD2 3.97Å; Y44-Y51 HydrophobicContact CD2-CD2 3.97Å; Y44-Y51 AromaticContact CD2-CE2 3.68Å; Y44-Y51 HydrophobicContact CD2-CE2 3.68Å; Y44-Y51 AromaticContact CE2-CD2 3.69Å; Y44-Y51 HydrophobicContact CE2-CD2 3.69Å; Y44-Y51 AromaticContact CE2-CE2 3.49Å; Y44-Y51 HydrophobicContact CE2-CE2 3.49Å; Y44-Y51 VanDerWaalsContact CE2-CE2 3.49Å
45	P	95.9	Very high	94.7	Very high	12 Å²	12	71.6 Å²	71.6	8%	0.078	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.7	-170.4	-23.2	35.1	0	0	0	114.3	F21 Y24 I26 I43 A64 T66	F21-P45 HydrophobicContact CD1-CB 3.82Å; F21-P45 HydrophobicContact CD1-CG 4.04Å; F21-P45 HydrophobicContact CD2-CG 4.34Å; F21-P45 HydrophobicContact CE1-CB 3.47Å; F21-P45 VanDerWaalsContact CE1-CB 3.47Å; F21-P45 HydrophobicContact CE1-CG 3.63Å; F21-P45 HydrophobicContact CE2-CG 3.98Å; F21-P45 HydrophobicContact CG-CG 4.4Å; F21-P45 HydrophobicContact CZ-CB 3.96Å; F21-P45 HydrophobicContact CZ-CG 3.58Å; Y24-P45 WeakPolarHBondContact O-CD 3.39Å; I26-P45 HydrophobicContact CG1-CG 4.03Å; I43-P45 WeakPolarHBondContact O-CD 3.45Å; P45-A64 HydrophobicContact CB-CB 3.97Å; P45-A64 HydrophobicContact CG-CB 4.29Å; P45-T66 HydrophobicContact CB-CG2 4.19Å; P45-T66 WeakPolarHBondContact O-CG2 3.16Å
46	R	94.6	Very high	95.1	Very high	214 Å²	214	66.6 Å²	66.6	81%	0.808	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-41	177.6	179.1	174.1	-178.6	170	1.3	113.6	T22 Y44	T22-R46 VanDerWaalsContact O-CB 3.23Å; T22-R46 WeakPolarHBondContact O-CB 2.97Å; Y44-R46 PolarHBondContact O-N 3.37Å; Y44-R46 VanDerWaalsContact O-N 3.12Å
47	S	94.4	Very high	95.2	Very high	69 Å²	69	69.7 Å²	69.7	48%	0.483	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-20	-177.2	56	0	0	0	0	113.1	Y44 N49	Y44-S47 WeakPolarHBondContact CB-OG 3.2Å; Y44-S47 PolarHBondContact O-N 2.8Å; S47-N49 PolarHBondContact O-N 3.41Å; S47-N49 WeakPolarHBondContact OG-CB 3.48Å; S47-N49 PolarHBondContact OG-N 2.84Å
48	G	92.4	Very high	95.1	Very high	47 Å²	47	67.5 Å²	67.5	49%	0.485	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	7.3	-170.3	0	0	0	0	0	113.5	Y44	Y44-G48 WeakPolarHBondContact O-CA 3.37Å; Y44-G48 PolarHBondContact O-N 3.28Å
49	N	95.1	Very high	95	Very high	82 Å²	82	67.7 Å²	67.7	44%	0.439	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.2	179.3	-69.7	-8.3	0	0	0	110.4	I43 Y44 S47 Y51	I43-N49 WeakPolarHBondContact CA-O 2.98Å; Y44-N49 PolarHBondContact N-O 3.01Å; S47-N49 PolarHBondContact O-N 3.41Å; S47-N49 WeakPolarHBondContact OG-CB 3.48Å; S47-N49 PolarHBondContact OG-N 2.84Å; N49-Y51 HydrophobicContact CB-CE2 4.27Å
50	N	95.8	Very high	95.1	Very high	58 Å²	58	63.3 Å²	63.3	31%	0.31	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136.6	177.4	-71.4	-25.3	0	0	0	110.5	E42 I43 Y52 L62	E42-N50 CarbonylContact O-C 3.57Å; E42-N50 WeakPolarHBondContact O-CA 3.4Å; I43-N50 VanDerWaalsContact CB-OD1 3.24Å; I43-N50 WeakPolarHBondContact CB-OD1 2.96Å; I43-N50 VanDerWaalsContact CD1-OD1 3.29Å; I43-N50 WeakPolarHBondContact CD1-OD1 2.96Å; I43-N50 WeakPolarHBondContact CG1-OD1 3.24Å; N50-Y52 HydrophobicContact CB-CD2 4.25Å; N50-Y52 HydrophobicContact CB-CE2 3.47Å; N50-Y52 VanDerWaalsContact CB-CE2 3.47Å; N50-Y52 PolarHBondContact ND2-OH 2.98Å; N50-L62 PolarHBondContact ND2-O 2.94Å
51	Y	95.7	Very high	95.1	Very high	123 Å²	123	65.2 Å²	65.2	48%	0.482	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.6	169.5	-60.6	-88.4	0	0	0	108.2	G41 E42 Y44 N49	G41-Y51 CarbonylContact C-O 3.54Å; G41-Y51 WeakPolarHBondContact CA-O 3.44Å; E42-Y51 PolarHBondContact N-O 2.82Å; E42-Y51 PolarHBondContact O-N 3.34Å; Y44-Y51 AromaticContact CD2-CD2 3.97Å; Y44-Y51 HydrophobicContact CD2-CD2 3.97Å; Y44-Y51 AromaticContact CD2-CE2 3.68Å; Y44-Y51 HydrophobicContact CD2-CE2 3.68Å; Y44-Y51 AromaticContact CE2-CD2 3.69Å; Y44-Y51 HydrophobicContact CE2-CD2 3.69Å; Y44-Y51 AromaticContact CE2-CE2 3.49Å; Y44-Y51 HydrophobicContact CE2-CE2 3.49Å; Y44-Y51 VanDerWaalsContact CE2-CE2 3.49Å; N49-Y51 HydrophobicContact CB-CE2 4.27Å
52	Y	96.9	Very high	95.1	Very high	63 Å²	63	65.3 Å²	65.3	25%	0.247	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.2	-177.1	-68.1	-87.3	0	0	0	110.1	N50 A60 L62	N50-Y52 HydrophobicContact CB-CD2 4.25Å; N50-Y52 HydrophobicContact CB-CE2 3.47Å; N50-Y52 VanDerWaalsContact CB-CE2 3.47Å; N50-Y52 PolarHBondContact ND2-OH 2.98Å; Y52-A60 HydrophobicContact CE1-CB 4.4Å; Y52-A60 WeakPolarHBondContact CE1-O 3.45Å; Y52-L62 HydrophobicContact CE1-CD1 4.13Å; Y52-L62 HydrophobicContact CE1-CG 3.73Å; Y52-L62 PolarHBondContact OH-N 2.82Å
53	N	95.6	Very high	95.2	Very high	42 Å²	42	67.1 Å²	67.1	23%	0.225	35%	0.35	C	S	.	.			trans	-71.8	136.9	156.6	-178	-21.1	0	0	0	108.5	W39 I40 N55 F56 K57	W39-N53 HydrophobicContact CE3-CB 3.78Å; W39-N53 HydrophobicContact CZ3-CB 3.97Å; W39-N53 VanDerWaalsContact CZ3-N 3.32Å; W39-N53 WeakPolarHBondContact O-CB 3.28Å; W39-N53 PolarHBondContact O-ND2 3.45Å; I40-N53 PolarHBondContact O-N 3.47Å; N53-N55 PolarHBondContact O-N 2.88Å; N53-N55 VanDerWaalsContact O-N 3.14Å; N53-N55 PolarHBondContact OD1-N 3.16Å; N53-N55 VanDerWaalsContact OD1-N 3.08Å; N53-F56 HydrophobicContact CB-CD2 4.03Å; N53-F56 PolarHBondContact O-N 2.61Å; N53-K57 PolarHBondContact O-N 3.14Å; N53-K57 VanDerWaalsContact O-N 3.16Å
54	E	94.2	Very high	95.2	Very high	127 Å²	127	68.6 Å²	68.6	59%	0.593	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-56.7	-30.9	-179.4	-67.1	-61.5	137.9	0	0	112.4	F56 K57	E54-F56 PolarHBondContact O-N 2.9Å; E54-K57 PolarHBondContact O-N 3.37Å; E54-K57 IonicContact OE1-NZ 3.05Å; E54-K57 PolarHBondContact OE1-NZ 2.94Å; E54-K57 WeakPolarHBondContact OE2-CD 3.45Å; E54-K57 IonicContact OE2-NZ 3.44Å; E54-K57 PolarHBondContact OE2-NZ 3.22Å
55	N	91.8	Very high	95.2	Very high	113 Å²	113	67 Å²	67	60%	0.604	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-61.9	-26.2	175.3	-70.3	-10.3	0	0	0	113.9	E38 N53	E38-N55 PolarHBondContact OE1-ND2 3.06Å; E38-N55 VanDerWaalsContact OE1-ND2 3.12Å; N53-N55 PolarHBondContact O-N 2.88Å; N53-N55 VanDerWaalsContact O-N 3.14Å; N53-N55 PolarHBondContact OD1-N 3.16Å; N53-N55 VanDerWaalsContact OD1-N 3.08Å
56	F	94.1	Very high	95.2	Very high	7 Å²	7	70 Å²	70	3%	0.031	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-110.4	-3.6	-175.4	-65.3	-87.8	0	0	0	113.1	K30 E38 I40 N53 E54 G58 K59 A60	K30-F56 HydrophobicContact CD-CE1 4.01Å; K30-F56 HydrophobicContact CD-CZ 3.94Å; E38-F56 VanDerWaalsContact CD-CE2 3.4Å; E38-F56 VanDerWaalsContact CD-CZ 3.49Å; E38-F56 HydrophobicContact CG-CE2 3.73Å; E38-F56 HydrophobicContact CG-CZ 4.06Å; E38-F56 WeakPolarHBondContact OE1-CE2 3.39Å; E38-F56 WeakPolarHBondContact OE2-CZ 3.48Å; I40-F56 HydrophobicContact CB-CD1 4.44Å; I40-F56 HydrophobicContact CB-CD2 4.33Å; I40-F56 HydrophobicContact CB-CG 4.19Å; I40-F56 HydrophobicContact CG1-CD1 4.16Å; I40-F56 HydrophobicContact CG1-CD2 4.36Å; I40-F56 HydrophobicContact CG1-CE1 4.05Å; I40-F56 HydrophobicContact CG1-CE2 4.24Å; I40-F56 HydrophobicContact CG1-CG 4.31Å; I40-F56 HydrophobicContact CG1-CZ 4.08Å; I40-F56 HydrophobicContact CG2-CB 3.7Å; I40-F56 HydrophobicContact CG2-CD1 3.84Å; I40-F56 HydrophobicContact CG2-CD2 4.28Å; I40-F56 HydrophobicContact CG2-CG 3.67Å; N53-F56 HydrophobicContact CB-CD2 4.03Å; N53-F56 PolarHBondContact O-N 2.61Å; E54-F56 PolarHBondContact O-N 2.9Å; F56-G58 PolarHBondContact O-N 2.83Å; F56-K59 PolarHBondContact O-N 2.86Å; F56-A60 HydrophobicContact CB-CB 4.25Å; F56-A60 PolarHBondContact O-N 2.77Å
57	K	92.7	Very high	95.2	Very high	125 Å²	125	64.9 Å²	64.9	54%	0.543	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-62.9	124.3	177.7	-162.6	175.2	-171.9	171.9	0	109.6	N53 E54 K59	N53-K57 PolarHBondContact O-N 3.14Å; N53-K57 VanDerWaalsContact O-N 3.16Å; E54-K57 PolarHBondContact O-N 3.37Å; E54-K57 IonicContact OE1-NZ 3.05Å; E54-K57 PolarHBondContact OE1-NZ 2.94Å; E54-K57 WeakPolarHBondContact OE2-CD 3.45Å; E54-K57 IonicContact OE2-NZ 3.44Å; E54-K57 PolarHBondContact OE2-NZ 3.22Å; K57-K59 PolarHBondContact O-N 2.84Å
58	G	91.4	Very high	95.3	Very high	72 Å²	72	63.5 Å²	63.5	74%	0.742	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-16.8	-174.6	0	0	0	0	0	115	F56	F56-G58 PolarHBondContact O-N 2.83Å
59	K	94.5	Very high	95.5	Very high	50 Å²	50	63.1 Å²	63.1	22%	0.217	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-42.3	174.3	-169.1	163.2	-170	175.5	0	112.7	F56 K57 R76 D82	F56-K59 PolarHBondContact O-N 2.86Å; K57-K59 PolarHBondContact O-N 2.84Å; K59-R76 PolarHBondContact O-N 3.37Å; K59-D82 VanDerWaalsContact CE-CG 3.46Å; K59-D82 VanDerWaalsContact CE-OD1 3.27Å; K59-D82 WeakPolarHBondContact CE-OD1 3.45Å; K59-D82 WeakPolarHBondContact CE-OD2 3.12Å; K59-D82 IonicContact NZ-OD1 2.61Å; K59-D82 PolarHBondContact NZ-OD1 3.21Å; K59-D82 IonicContact NZ-OD2 2.83Å; K59-D82 PolarHBondContact NZ-OD2 2.93Å
60	A	96.9	Very high	95.6	Very high	3 Å²	3	59.6 Å²	59.6	3%	0.025	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	141	176.4	0	0	0	0	0	110.9	I40 Y52 F56 M73 E74 L75	I40-A60 HydrophobicContact CG2-CB 3.72Å; Y52-A60 HydrophobicContact CE1-CB 4.4Å; Y52-A60 WeakPolarHBondContact CE1-O 3.45Å; F56-A60 HydrophobicContact CB-CB 4.25Å; F56-A60 PolarHBondContact O-N 2.77Å; A60-M73 HydrophobicContact CB-CG 4.41Å; A60-M73 HydrophobicContact CB-SD 4.36Å; A60-E74 CarbonylContact C-O 3.51Å; A60-E74 WeakPolarHBondContact CA-O 3.34Å; A60-L75 HydrophobicContact CB-CD2 3.89Å
61	T	97.6	Very high	95.7	Very high	41 Å²	41	56.9 Å²	56.9	25%	0.252	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119	168.5	-57	0	0	0	0	108.9	T63 M73 E74	T61-T63 HydrophobicContact CG2-CG2 4.42Å; T61-M73 WeakPolarHBondContact O-CA 3.35Å; T61-E74 PolarHBondContact N-O 2.99Å; T61-E74 PolarHBondContact O-N 2.99Å
62	L	97.8	Very high	95.8	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.3	179	-52.3	-175.2	0	0	0	110.6	W28 I43 N50 Y52 Y72 M73	W28-L62 HydrophobicContact CG-CD2 4.05Å; I43-L62 HydrophobicContact CB-CB 4.16Å; I43-L62 HydrophobicContact CG2-CB 4.49Å; N50-L62 PolarHBondContact ND2-O 2.94Å; Y52-L62 HydrophobicContact CE1-CD1 4.13Å; Y52-L62 HydrophobicContact CE1-CG 3.73Å; Y52-L62 PolarHBondContact OH-N 2.82Å; L62-Y72 WeakPolarHBondContact CA-O 3.46Å; L62-M73 HydrophobicContact CD2-CB 3.79Å; L62-M73 HydrophobicContact CD2-CG 3.64Å; L62-M73 HydrophobicContact CD2-SD 4.06Å
63	T	97.7	Very high	95.8	Very high	64 Å²	64	50.6 Å²	50.6	39%	0.393	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.6	175.9	55.6	0	0	0	0	110.6	T61 A71 Y72	T61-T63 HydrophobicContact CG2-CG2 4.42Å; T63-A71 CarbonylContact O-C 3.52Å; T63-Y72 PolarHBondContact N-O 3.33Å; T63-Y72 PolarHBondContact O-N 2.84Å
64	A	97.3	Very high	95.9	Very high	36 Å²	36	51.4 Å²	51.4	30%	0.298	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139.6	177.4	0	0	0	0	0	110.1	F21 I43 P45	F21-A64 HydrophobicContact CE1-CB 4.1Å; F21-A64 HydrophobicContact CZ-CB 4.08Å; I43-A64 HydrophobicContact CD1-CB 3.66Å; I43-A64 HydrophobicContact CG1-CB 4.31Å; P45-A64 HydrophobicContact CB-CB 3.97Å; P45-A64 HydrophobicContact CG-CB 4.29Å
65	D	96.7	Very high	96	Very high	56 Å²	56	45.3 Å²	45.3	30%	0.299	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	108.1	169.3	175	7.2	0	0	0	108.5	S67 S68 S69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.3Å; D65-S67 WeakPolarHBondContact OD1-CB 3.31Å; D65-S67 PolarHBondContact OD1-N 2.88Å; D65-S67 PolarHBondContact OD1-OG 2.92Å; D65-S67 PolarHBondContact OD2-OG 2.89Å; D65-S68 WeakPolarHBondContact CB-OG 2.99Å; D65-S68 PolarHBondContact OD1-N 3.38Å; D65-S68 WeakPolarHBondContact OD2-CB 3.44Å; D65-S68 PolarHBondContact OD2-OG 2.81Å; D65-S69 WeakPolarHBondContact O-CA 3.39Å; D65-S69 PolarHBondContact O-N 3.02Å; D65-T70 PolarHBondContact N-O 2.91Å; D65-T70 PolarHBondContact O-N 2.81Å; D65-Y72 HydrophobicContact CB-CE2 4.01Å
66	T	95.6	Very high	96.2	Very high	76 Å²	76	45.2 Å²	45.2	47%	0.466	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-23.1	-178.3	55.8	0	0	0	0	112.5	T22 P45	T22-T66 HydrophobicContact CG2-CG2 3.76Å; P45-T66 HydrophobicContact CB-CG2 4.19Å; P45-T66 WeakPolarHBondContact O-CG2 3.16Å
67	S	94.9	Very high	96.1	Very high	106 Å²	106	49.1 Å²	49.1	74%	0.741	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-38.8	178.2	74.2	0	0	0	0	111.8	D65	D65-S67 VanDerWaalsContact C-N 3.3Å; D65-S67 WeakPolarHBondContact OD1-CB 3.31Å; D65-S67 PolarHBondContact OD1-N 2.88Å; D65-S67 PolarHBondContact OD1-OG 2.92Å; D65-S67 PolarHBondContact OD2-OG 2.89Å
68	S	96.4	Very high	96.2	Very high	41 Å²	41	44.2 Å²	44.2	29%	0.287	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	1.2	177.2	66.6	0	0	0	0	113.8	D65 T70	D65-S68 WeakPolarHBondContact CB-OG 2.99Å; D65-S68 PolarHBondContact OD1-N 3.38Å; D65-S68 WeakPolarHBondContact OD2-CB 3.44Å; D65-S68 PolarHBondContact OD2-OG 2.81Å; S68-T70 PolarHBondContact O-N 2.95Å; S68-T70 PolarHBondContact O-OG1 2.77Å; S68-T70 PolarHBondContact OG-OG1 2.83Å
69	S	96.7	Very high	96.2	Very high	38 Å²	38	43 Å²	43	27%	0.266	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	42.8	-174.6	-63.1	0	0	0	0	112.6	A16 D65	A16-S69 PolarHBondContact N-O 3.32Å; D65-S69 WeakPolarHBondContact O-CA 3.39Å; D65-S69 PolarHBondContact O-N 3.02Å
70	T	97.8	Very high	96	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.1	-174.2	-55.3	0	0	0	0	111	C14 D65 S68 Y72	C14-T70 CarbonylContact O-C 3.54Å; C14-T70 WeakPolarHBondContact O-CA 3.46Å; D65-T70 PolarHBondContact N-O 2.91Å; D65-T70 PolarHBondContact O-N 2.81Å; S68-T70 PolarHBondContact O-N 2.95Å; S68-T70 PolarHBondContact O-OG1 2.77Å; S68-T70 PolarHBondContact OG-OG1 2.83Å; T70-Y72 HydrophobicContact CG2-CD1 4.29Å; T70-Y72 HydrophobicContact CG2-CD2 4.42Å; T70-Y72 HydrophobicContact CG2-CE1 3.68Å; T70-Y72 HydrophobicContact CG2-CE2 3.81Å
71	A	97.6	Very high	95.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	149.2	167.9	0	0	0	0	0	110	S13 C14 F21 I26 W28 I43 T63	S13-A71 CarbonylContact C-O 3.58Å; S13-A71 WeakPolarHBondContact CA-O 3.47Å; C14-A71 HydrophobicContact CB-CB 4.38Å; C14-A71 PolarHBondContact N-O 3.24Å; C14-A71 PolarHBondContact O-N 2.82Å; F21-A71 HydrophobicContact CE2-CB 4.21Å; F21-A71 HydrophobicContact CZ-CB 3.98Å; I26-A71 HydrophobicContact CB-CB 4.2Å; I26-A71 HydrophobicContact CG1-CB 4.32Å; I26-A71 HydrophobicContact CG2-CB 3.83Å; W28-A71 HydrophobicContact CZ2-CB 4.16Å; I43-A71 HydrophobicContact CG2-CB 4.45Å; T63-A71 CarbonylContact O-C 3.52Å
72	Y	97.9	Very high	95.3	Very high	54 Å²	54	49.8 Å²	49.8	21%	0.212	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.1	177.1	-54.9	-88.8	0	0	0	110.9	K11 L12 L62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.46Å; K11-Y72 VanDerWaalsContact CE-CD1 3.48Å; K11-Y72 HydrophobicContact CG-CD1 4.45Å; L12-Y72 WeakPolarHBondContact O-CA 3.35Å; L62-Y72 WeakPolarHBondContact CA-O 3.46Å; T63-Y72 PolarHBondContact N-O 3.33Å; T63-Y72 PolarHBondContact O-N 2.84Å; D65-Y72 HydrophobicContact CB-CE2 4.01Å; T70-Y72 HydrophobicContact CG2-CD1 4.29Å; T70-Y72 HydrophobicContact CG2-CD2 4.42Å; T70-Y72 HydrophobicContact CG2-CE1 3.68Å; T70-Y72 HydrophobicContact CG2-CE2 3.81Å
73	M	97.8	Very high	95.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	120.4	168.1	177.7	174.9	70.4	0	0	108.9	K11 L12 W28 I40 A60 T61 L62 L75 Y86	K11-M73 WeakPolarHBondContact CA-O 3.41Å; L12-M73 HydrophobicContact CD1-CE 3.64Å; L12-M73 PolarHBondContact N-O 2.79Å; L12-M73 PolarHBondContact O-N 3.33Å; W28-M73 HydrophobicContact CB-SD 3.97Å; W28-M73 HydrophobicContact CD2-CB 3.71Å; W28-M73 HydrophobicContact CD2-CE 4.39Å; W28-M73 HydrophobicContact CD2-SD 4.15Å; W28-M73 HydrophobicContact CE3-CB 3.87Å; W28-M73 HydrophobicContact CE3-CE 3.81Å; W28-M73 HydrophobicContact CE3-SD 4.17Å; W28-M73 HydrophobicContact CG-CB 4.28Å; W28-M73 HydrophobicContact CG-SD 4.09Å; W28-M73 HydrophobicContact CH2-CB 4.05Å; W28-M73 HydrophobicContact CZ2-CB 3.92Å; W28-M73 HydrophobicContact CZ3-CB 4.04Å; W28-M73 HydrophobicContact CZ3-CE 4.34Å; I40-M73 HydrophobicContact CD1-CE 3.77Å; I40-M73 HydrophobicContact CD1-SD 3.59Å; I40-M73 VanDerWaalsContact CD1-SD 3.59Å; I40-M73 HydrophobicContact CG2-SD 3.87Å; A60-M73 HydrophobicContact CB-CG 4.41Å; A60-M73 HydrophobicContact CB-SD 4.36Å; T61-M73 WeakPolarHBondContact O-CA 3.35Å; L62-M73 HydrophobicContact CD2-CB 3.79Å; L62-M73 HydrophobicContact CD2-CG 3.64Å; L62-M73 HydrophobicContact CD2-SD 4.06Å; M73-L75 HydrophobicContact CE-CD1 3.9Å; M73-L75 HydrophobicContact CE-CD2 4.35Å; M73-L75 HydrophobicContact CE-CG 4.03Å; M73-L75 HydrophobicContact CG-CG 4.36Å; M73-L75 HydrophobicContact SD-CD2 4.23Å; M73-L75 HydrophobicContact SD-CG 4.38Å; M73-Y86 HydrophobicContact CE-CD1 3.57Å; M73-Y86 HydrophobicContact CE-CE1 3.99Å; M73-Y86 HydrophobicContact CE-CG 4.25Å
74	E	97.3	Very high	94.9	Very high	59 Å²	59	53 Å²	53	28%	0.276	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121.6	168.3	-174.6	-175.4	-147.6	0	0	109.1	V10 A60 T61 R76	V10-E74 CarbonylContact O-C 3.56Å; V10-E74 VanDerWaalsContact O-CA 3.31Å; V10-E74 WeakPolarHBondContact O-CA 3.34Å; A60-E74 CarbonylContact C-O 3.51Å; A60-E74 WeakPolarHBondContact CA-O 3.34Å; T61-E74 PolarHBondContact N-O 2.99Å; T61-E74 PolarHBondContact O-N 2.99Å; E74-R76 HydrophobicContact CG-CG 4.25Å; E74-R76 IonicContact OE2-CZ 3.38Å; E74-R76 IonicContact OE2-NE 3.04Å; E74-R76 PolarHBondContact OE2-NE 3.29Å; E74-R76 IonicContact OE2-NH2 2.82Å; E74-R76 PolarHBondContact OE2-NH2 3.05Å
75	L	95.9	Very high	94.8	Very high	0 Å²	0	55 Å²	55	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.6	169.5	-68	167.1	0	0	0	108.6	S9 V10 A60 M73 L78 Y86	S9-L75 CarbonylContact C-O 3.6Å; S9-L75 WeakPolarHBondContact CA-O 3.25Å; S9-L75 WeakPolarHBondContact CB-O 3.36Å; V10-L75 HydrophobicContact CG1-CB 3.88Å; V10-L75 HydrophobicContact CG1-CD1 4.28Å; V10-L75 PolarHBondContact N-O 3.02Å; V10-L75 PolarHBondContact O-N 3.07Å; A60-L75 HydrophobicContact CB-CD2 3.89Å; M73-L75 HydrophobicContact CE-CD1 3.9Å; M73-L75 HydrophobicContact CE-CD2 4.35Å; M73-L75 HydrophobicContact CE-CG 4.03Å; M73-L75 HydrophobicContact CG-CG 4.36Å; M73-L75 HydrophobicContact SD-CD2 4.23Å; M73-L75 HydrophobicContact SD-CG 4.38Å; L75-L78 HydrophobicContact CB-CD2 3.95Å; L75-L78 HydrophobicContact CD1-CD2 4.46Å; L75-Y86 HydrophobicContact CD1-CD1 4.36Å; L75-Y86 HydrophobicContact CD1-CE1 3.61Å; L75-Y86 HydrophobicContact CD1-CE2 4.16Å; L75-Y86 VanDerWaalsContact CD1-CZ 3.48Å; L75-Y86 WeakPolarHBondContact CD1-OH 3.34Å
76	R	94.9	Very high	94.8	Very high	111 Å²	111	54.6 Å²	54.6	42%	0.419	32%	0.323	S	S	.	.			trans	-108.7	156.2	-177.5	-60.2	-179.4	179	176.4	0.6	111.2	K59 E74 L78	K59-R76 PolarHBondContact O-N 3.37Å; E74-R76 HydrophobicContact CG-CG 4.25Å; E74-R76 IonicContact OE2-CZ 3.38Å; E74-R76 IonicContact OE2-NE 3.04Å; E74-R76 PolarHBondContact OE2-NE 3.29Å; E74-R76 IonicContact OE2-NH2 2.82Å; E74-R76 PolarHBondContact OE2-NH2 3.05Å; R76-L78 VanDerWaalsContact C-N 3.35Å; R76-L78 PolarHBondContact O-N 2.99Å
77	S	93.8	Very high	94.8	Very high	89 Å²	89	55.3 Å²	55.3	62%	0.622	32%	0.32	S	S	*	.	S	Bend	trans	52.1	52.4	173.8	-55.3	0	0	0	0	112.2	A8 S79	A8-S77 PolarHBondContact O-N 2.93Å; S77-S79 PolarHBondContact O-N 2.86Å
78	L	93.6	Very high	94.9	Very high	22 Å²	22	52.7 Å²	52.7	12%	0.115	30%	0.301	C	S	.	.			trans	-57.8	137.3	-173.6	-73.6	171.5	0	0	0	112.6	A4 G7 A8 V10 L75 R76 D82	A4-L78 HydrophobicContact CB-CD1 3.46Å; A4-L78 VanDerWaalsContact CB-CD1 3.46Å; G7-L78 PolarHBondContact N-O 3.03Å; A8-L78 WeakPolarHBondContact O-CB 3.45Å; A8-L78 VanDerWaalsContact O-CG 3.29Å; A8-L78 WeakPolarHBondContact O-CG 3.37Å; A8-L78 PolarHBondContact O-N 3.3Å; V10-L78 HydrophobicContact CB-CD1 3.89Å; V10-L78 HydrophobicContact CG1-CD1 3.77Å; V10-L78 HydrophobicContact CG1-CD2 4.07Å; V10-L78 HydrophobicContact CG1-CG 4.35Å; L75-L78 HydrophobicContact CB-CD2 3.95Å; L75-L78 HydrophobicContact CD1-CD2 4.46Å; R76-L78 VanDerWaalsContact C-N 3.35Å; R76-L78 PolarHBondContact O-N 2.99Å; L78-D82 WeakPolarHBondContact CA-OD2 3.19Å; L78-D82 HydrophobicContact CD2-CB 3.66Å
79	S	92.3	Very high	94.8	Very high	46 Å²	46	53.1 Å²	53.1	32%	0.322	31%	0.307	S	S	.	.			trans	-121.1	172.5	172.5	71.8	0	0	0	0	111	S77 E81 D82	S77-S79 PolarHBondContact O-N 2.86Å; S79-E81 PolarHBondContact O-N 3.2Å; S79-E81 VanDerWaalsContact O-N 3.15Å; S79-E81 PolarHBondContact OG-N 2.82Å; S79-D82 PolarHBondContact N-OD2 3.01Å; S79-D82 WeakPolarHBondContact O-CB 3.23Å; S79-D82 PolarHBondContact O-N 2.81Å; S79-D82 PolarHBondContact OG-OD2 3.32Å
80	S	89.7	Confident	94.6	Very high	110 Å²	110	57.2 Å²	57.2	77%	0.769	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-56.9	-27.8	175.3	51.5	0	0	0	0	112.8	D82 S83	S80-D82 PolarHBondContact O-N 2.82Å; S80-S83 WeakPolarHBondContact O-CB 3.24Å; S80-S83 PolarHBondContact O-N 2.76Å
81	E	88.8	Confident	93.8	Very high	116 Å²	116	57.4 Å²	57.4	54%	0.542	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-68	-21	177.5	-60.5	-170.9	138.1	0	0	113.2	K30 R32 S79 S83	K30-E81 VanDerWaalsContact CE-O 3.28Å; K30-E81 WeakPolarHBondContact CE-O 3.33Å; K30-E81 PolarHBondContact NZ-O 3.04Å; R32-E81 PolarHBondContact NE-O 3.46Å; R32-E81 PolarHBondContact NH1-O 3.44Å; S79-E81 PolarHBondContact O-N 3.2Å; S79-E81 VanDerWaalsContact O-N 3.15Å; S79-E81 PolarHBondContact OG-N 2.82Å; E81-S83 VanDerWaalsContact C-N 3.3Å
82	D	91.7	Very high	92.1	Very high	10 Å²	10	63.7 Å²	63.7	5%	0.053	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-84	-5.3	177.6	-56.2	-48	0	0	0	113.3	K30 K59 L78 S79 S80 A84 Y86	K30-D82 IonicContact NZ-OD1 2.87Å; K30-D82 PolarHBondContact NZ-OD1 3.12Å; K59-D82 VanDerWaalsContact CE-CG 3.46Å; K59-D82 VanDerWaalsContact CE-OD1 3.27Å; K59-D82 WeakPolarHBondContact CE-OD1 3.45Å; K59-D82 WeakPolarHBondContact CE-OD2 3.12Å; K59-D82 IonicContact NZ-OD1 2.61Å; K59-D82 PolarHBondContact NZ-OD1 3.21Å; K59-D82 IonicContact NZ-OD2 2.83Å; K59-D82 PolarHBondContact NZ-OD2 2.93Å; L78-D82 WeakPolarHBondContact CA-OD2 3.19Å; L78-D82 HydrophobicContact CD2-CB 3.66Å; S79-D82 PolarHBondContact N-OD2 3.01Å; S79-D82 WeakPolarHBondContact O-CB 3.23Å; S79-D82 PolarHBondContact O-N 2.81Å; S79-D82 PolarHBondContact OG-OD2 3.32Å; S80-D82 PolarHBondContact O-N 2.82Å; D82-A84 PolarHBondContact O-N 3Å; D82-Y86 WeakPolarHBondContact O-CE2 3.5Å; D82-Y86 PolarHBondContact O-OH 3.37Å
83	S	92.4	Very high	91.8	Very high	102 Å²	102	64.2 Å²	64.2	71%	0.713	39%	0.394	S	S	*	.			trans	-68.8	102.4	172.8	-166.5	0	0	0	0	109.9	S80 E81	S80-S83 WeakPolarHBondContact O-CB 3.24Å; S80-S83 PolarHBondContact O-N 2.76Å; E81-S83 VanDerWaalsContact C-N 3.3Å
84	A	94.1	Very high	91.5	Very high	32 Å²	32	67.6 Å²	67.6	26%	0.264	42%	0.415	S	S	.	.	S	Bend	trans	-159.8	169.1	-171.6	0	0	0	0	0	110.9	K30 Q31 R32 D82 Y86	K30-A84 HydrophobicContact CD-CB 4.16Å; K30-A84 HydrophobicContact CG-CB 3.51Å; Q31-A84 WeakPolarHBondContact O-CB 3.44Å; R32-A84 HydrophobicContact CG-CB 3.97Å; D82-A84 PolarHBondContact O-N 3Å; A84-Y86 HydrophobicContact CB-CD2 4.48Å; A84-Y86 HydrophobicContact CB-CE2 3.93Å; A84-Y86 WeakPolarHBondContact O-CD2 3.29Å
85	V	95.2	Very high	91.1	Very high	77 Å²	77	68.1 Å²	68.1	47%	0.467	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	135.3	163.9	-174.2	0	0	0	0	108.3	Q31 F87	Q31-V85 PolarHBondContact N-O 2.87Å; Q31-V85 PolarHBondContact O-N 3Å; V85-F87 HydrophobicContact CB-CE2 4.01Å; V85-F87 HydrophobicContact CB-CZ 4.21Å; V85-F87 HydrophobicContact CG1-CD2 4.27Å; V85-F87 HydrophobicContact CG1-CE1 3.97Å; V85-F87 HydrophobicContact CG1-CE2 3.55Å; V85-F87 HydrophobicContact CG1-CZ 3.38Å
86	Y	96.4	Very high	90.8	Very high	49 Å²	49	72.1 Å²	72.1	19%	0.192	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.6	179.4	-69.8	-88.8	0	0	0	109.7	L12 V29 K30 I40 M73 L75 D82 A84	L12-Y86 HydrophobicContact CD1-CD1 4.31Å; L12-Y86 HydrophobicContact CD1-CD2 4.05Å; L12-Y86 HydrophobicContact CD1-CG 3.73Å; V29-Y86 WeakPolarHBondContact O-CA 3.29Å; K30-Y86 HydrophobicContact CB-CD1 4.16Å; K30-Y86 HydrophobicContact CB-CE1 3.9Å; K30-Y86 HydrophobicContact CD-CE1 4.03Å; K30-Y86 HydrophobicContact CG-CD1 4.31Å; K30-Y86 HydrophobicContact CG-CE1 3.76Å; I40-Y86 HydrophobicContact CD1-CD1 3.72Å; I40-Y86 HydrophobicContact CD1-CE1 3.73Å; M73-Y86 HydrophobicContact CE-CD1 3.57Å; M73-Y86 HydrophobicContact CE-CE1 3.99Å; M73-Y86 HydrophobicContact CE-CG 4.25Å; L75-Y86 HydrophobicContact CD1-CD1 4.36Å; L75-Y86 HydrophobicContact CD1-CE1 3.61Å; L75-Y86 HydrophobicContact CD1-CE2 4.16Å; L75-Y86 VanDerWaalsContact CD1-CZ 3.48Å; L75-Y86 WeakPolarHBondContact CD1-OH 3.34Å; D82-Y86 WeakPolarHBondContact O-CE2 3.5Å; D82-Y86 PolarHBondContact O-OH 3.37Å; A84-Y86 HydrophobicContact CB-CD2 4.48Å; A84-Y86 HydrophobicContact CB-CE2 3.93Å; A84-Y86 WeakPolarHBondContact O-CD2 3.29Å
87	F	96.3	Very high	90.6	Very high	91 Å²	91	69.6 Å²	69.6	40%	0.399	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	144.3	178.5	-59.7	-83.4	0	0	0	109.7	W28 V29 Q31 V85	W28-F87 WeakPolarHBondContact CA-O 3.47Å; V29-F87 PolarHBondContact N-O 3.32Å; V29-F87 PolarHBondContact O-N 3.42Å; Q31-F87 HydrophobicContact CB-CD2 4.32Å; Q31-F87 HydrophobicContact CB-CE2 3.77Å; Q31-F87 VanDerWaalsContact OE1-CE2 3.29Å; V85-F87 HydrophobicContact CB-CE2 4.01Å; V85-F87 HydrophobicContact CB-CZ 4.21Å; V85-F87 HydrophobicContact CG1-CD2 4.27Å; V85-F87 HydrophobicContact CG1-CE1 3.97Å; V85-F87 HydrophobicContact CG1-CE2 3.55Å; V85-F87 HydrophobicContact CG1-CZ 3.38Å
88	C	96.1	Very high	90.4	Very high	51 Å²	51	68.3 Å²	68.3	35%	0.345	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.6	159.6	62.9	0	0	0	0	108.9	C14 I26 S27 W28	C14-C88 HydrophobicContact CB-CB 3.49Å; C14-C88 VanDerWaalsContact CB-CB 3.49Å; C14-C88 WeakPolarHBondContact CB-SG 3.37Å; C14-C88 WeakPolarHBondContact SG-CB 3.44Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.6Å; I26-C88 HydrophobicContact CG2-CB 4.3Å; S27-C88 CarbonylContact O-C 3.38Å; S27-C88 VanDerWaalsContact O-CA 3.3Å; S27-C88 WeakPolarHBondContact O-CA 3.33Å; W28-C88 HydrophobicContact CD2-CB 4.33Å; W28-C88 HydrophobicContact CE3-CB 4.17Å; W28-C88 HydrophobicContact CH2-CB 4.31Å; W28-C88 HydrophobicContact CZ2-CB 4.44Å; W28-C88 HydrophobicContact CZ3-CB 4.17Å
89	A	95	Very high	90.2	Very high	49 Å²	49	71.6 Å²	71.6	41%	0.405	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.6	178.2	0	0	0	0	0	109.9	S27 G91	S27-A89 PolarHBondContact N-O 2.61Å; S27-A89 PolarHBondContact O-N 3.41Å; A89-G91 PolarHBondContact O-N 2.93Å
90	R	93.2	Very high	90	Very high	124 Å²	124	73.6 Å²	73.6	47%	0.468	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	120.7	168.8	-176.1	-179.6	66.8	94.9	-0.9	108.4	Y19 Y24	Y19-R90 HydrophobicContact CE2-CG 4.07Å; Y24-R90 HydrophobicContact CD1-CG 4.03Å; Y24-R90 HydrophobicContact CD2-CG 4.14Å; Y24-R90 HydrophobicContact CG-CG 3.65Å
91	G	79.2	Confident	90	Very high	14 Å²	14	70.6 Å²	70.6	14%	0.144	45%	0.446	C	S	.	.			trans	-63.4	145.1	169	0	0	0	0	0	110.8	Y24 G25 A89	Y24-G91 VanDerWaalsContact CD1-O 3.28Å; Y24-G91 WeakPolarHBondContact CD1-O 3.38Å; G25-G91 PolarHBondContact O-N 3.38Å; A89-G91 PolarHBondContact O-N 2.93Å
92	G	61.9	Low	90.1	Very high	132 Å²	132	66.5 Å²	66.5	100%	1.361	44%	0.437	S	S	*	.			trans	-70.3	0	-178.8	0	0	0	0	0	113.3

Retrieved 92 of 92 residues in 23.8 ms (Link to these results)

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