X5J5S7_MOUSE Loading...

IgA heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J5S7, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 87 aa.

						>X5J5S7_MOUSE|X5J5S7
TELVKPGASVKLSCKASGYTFTSYWMHWVKQRPRQGLEWIGNINPSNGGTNYNEKFKSKPTLTVDKSSSTAYMQLSSLTSEDSAVYY
					

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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	T	67.3	Low	88.2	Confident	188 Å²	188	102.5 Å²	102.5	100%	1.153	59%	0.586	S	S	*	*				0	125.5	0	-49.3	0	0	0	0	108.2
2	E	79.9	Confident	88.9	Confident	127 Å²	127	97.3 Å²	97.3	59%	0.593	55%	0.554	S	S	*	*			trans	-105	127.1	178.6	-164.3	175.1	167.5	0	0	109	V4 V10	E2-V4 HydrophobicContact CG-CG1 4.08Å; E2-V10 VanDerWaalsContact OE1-CG2 3.3Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.46Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.28Å
3	L	86.6	Confident	89.6	Confident	168 Å²	168	96.2 Å²	96.2	88%	0.88	56%	0.556	S	S	*	*			trans	-107	117.3	178.5	-76.1	161.5	0	0	0	108
4	V	88.7	Confident	90.1	Very high	63 Å²	63	91.9 Å²	91.9	38%	0.382	53%	0.534	S	S	.	.			trans	-123.2	148.1	-176.2	-65.7	0	0	0	0	110.2	E2 A8 L78	E2-V4 HydrophobicContact CG-CG1 4.08Å; V4-A8 HydrophobicContact CB-CB 4.34Å; V4-L78 HydrophobicContact CB-CD1 4.43Å; V4-L78 HydrophobicContact CG2-CD1 3.5Å; V4-L78 VanDerWaalsContact CG2-CD1 3.5Å
5	K	88.8	Confident	90.6	Very high	174 Å²	174	96.2 Å²	96.2	76%	0.757	54%	0.544	S	S	*	.			trans	-69.8	147.7	175.9	-65.1	-179.3	-178.5	178.9	0	109.8	G7 A8	K5-G7 PolarHBondContact O-N 3.17Å; K5-A8 WeakPolarHBondContact O-CB 3.37Å; K5-A8 PolarHBondContact O-N 2.98Å
6	P	90.1	Very high	91	Very high	123 Å²	123	90.8 Å²	90.8	80%	0.799	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	139.9	169.8	-25.2	34.4	0	0	0	111.5	A8	P6-A8 PolarHBondContact O-N 3.22Å
7	G	90.4	Very high	91.4	Very high	52 Å²	52	91.5 Å²	91.5	54%	0.536	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-9.2	-176.3	0	0	0	0	0	115	K5 L78	K5-G7 PolarHBondContact O-N 3.17Å; G7-L78 PolarHBondContact N-O 2.97Å
8	A	93.4	Very high	91.6	Very high	33 Å²	33	91.4 Å²	91.4	27%	0.273	55%	0.549	S	S	.	.			trans	-69.4	165.7	173.7	0	0	0	0	0	111.6	V4 K5 P6 S77 L78	V4-A8 HydrophobicContact CB-CB 4.34Å; K5-A8 WeakPolarHBondContact O-CB 3.37Å; K5-A8 PolarHBondContact O-N 2.98Å; P6-A8 PolarHBondContact O-N 3.22Å; A8-S77 PolarHBondContact O-N 2.95Å; A8-L78 WeakPolarHBondContact O-CB 3.37Å; A8-L78 WeakPolarHBondContact O-CG 3.36Å; A8-L78 PolarHBondContact O-N 2.6Å
9	S	94.4	Very high	91.8	Very high	67 Å²	67	92 Å²	92	47%	0.469	54%	0.541	S	S	.	.			trans	-110.1	146.7	170.3	-58.3	0	0	0	0	109.9	L75 S76	S9-L75 CarbonylContact C-O 3.59Å; S9-L75 WeakPolarHBondContact CA-O 3.48Å; S9-L75 WeakPolarHBondContact CB-O 3.41Å; S9-S76 WeakPolarHBondContact OG-CA 3.17Å
10	V	94.9	Very high	92	Very high	15 Å²	15	91.9 Å²	91.9	9%	0.091	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.4	174.2	71.2	0	0	0	0	110	E2 L12 Q74 L75 L78	E2-V10 VanDerWaalsContact OE1-CG2 3.3Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.46Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.28Å; V10-L12 HydrophobicContact CG2-CD2 4.24Å; V10-Q74 CarbonylContact O-C 3.57Å; V10-Q74 WeakPolarHBondContact O-CA 3.42Å; V10-L75 HydrophobicContact CG1-CB 4.02Å; V10-L75 HydrophobicContact CG1-CD1 4.11Å; V10-L75 HydrophobicContact CG1-CG 4.48Å; V10-L75 PolarHBondContact N-O 2.81Å; V10-L75 PolarHBondContact O-N 3.09Å; V10-L78 HydrophobicContact CB-CD1 4.01Å; V10-L78 HydrophobicContact CG1-CD1 3.72Å
11	K	96.1	Very high	92.2	Very high	118 Å²	118	87.9 Å²	87.9	51%	0.513	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	108.7	174.4	-172.7	178.9	-177.8	-177.7	0	109.4	Y72	K11-Y72 HydrophobicContact CD-CD1 4.32Å; K11-Y72 VanDerWaalsContact CE-CD1 3.42Å; K11-Y72 VanDerWaalsContact CE-CG 3.49Å; K11-Y72 HydrophobicContact CG-CD1 4.32Å
12	L	96.5	Very high	93.7	Very high	39 Å²	39	81.6 Å²	81.6	20%	0.204	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	147.1	173.8	-55.3	178.7	0	0	0	109.7	V10 W28 Y72 M73 L75 Y86	V10-L12 HydrophobicContact CG2-CD2 4.24Å; L12-W28 HydrophobicContact CB-CH2 4.1Å; L12-W28 HydrophobicContact CB-CZ3 3.94Å; L12-W28 HydrophobicContact CD1-CZ3 4.43Å; L12-Y72 CarbonylContact O-C 3.57Å; L12-Y72 WeakPolarHBondContact O-CA 3.4Å; L12-Y72 WeakPolarHBondContact O-CB 3.46Å; L12-M73 HydrophobicContact CD1-CE 3.7Å; L12-M73 PolarHBondContact N-O 2.93Å; L12-M73 PolarHBondContact O-N 3.17Å; L12-L75 HydrophobicContact CD1-CD1 4.41Å; L12-Y86 HydrophobicContact CD1-CD1 4.08Å; L12-Y86 HydrophobicContact CD1-CD2 4.07Å; L12-Y86 HydrophobicContact CD1-CG 3.68Å
13	S	97.4	Very high	94.5	Very high	83 Å²	83	79.2 Å²	79.2	58%	0.58	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.4	179.3	63.2	0	0	0	0	111	A71	S13-A71 CarbonylContact C-O 3.58Å; S13-A71 WeakPolarHBondContact CA-O 3.37Å
14	C	97.3	Very high	94.9	Very high	37 Å²	37	78.2 Å²	78.2	25%	0.25	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	109.9	175	179.1	0	0	0	0	108.8	W28 T70 A71	C14-W28 HydrophobicContact CB-CH2 3.95Å; C14-W28 HydrophobicContact CB-CZ2 4.24Å; C14-T70 CarbonylContact O-C 3.44Å; C14-T70 WeakPolarHBondContact O-CA 3.33Å; C14-A71 PolarHBondContact N-O 2.95Å; C14-A71 PolarHBondContact O-N 3.48Å
15	K	97.7	Very high	95.3	Very high	156 Å²	156	80.8 Å²	80.8	68%	0.678	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	120.8	179	-175	175.4	-178.1	178.4	0	110	S68 T70	K15-S68 WeakPolarHBondContact CE-O 3.11Å; K15-T70 HydrophobicContact CB-CG2 4.42Å
16	A	96.8	Very high	95.7	Very high	10 Å²	10	73.5 Å²	73.5	8%	0.083	43%	0.434	C	S	.	.			trans	-82.4	149.7	175.9	0	0	0	0	0	111.6	Y19 F21 S69	A16-Y19 HydrophobicContact CB-CE1 4.01Å; A16-Y19 HydrophobicContact CB-CE2 4.16Å; A16-Y19 VanDerWaalsContact CB-OH 3.23Å; A16-Y19 WeakPolarHBondContact CB-OH 3.43Å; A16-F21 HydrophobicContact CB-CB 4.41Å; A16-F21 HydrophobicContact CB-CD2 3.41Å; A16-F21 VanDerWaalsContact CB-CD2 3.41Å; A16-F21 HydrophobicContact CB-CE2 4Å; A16-F21 HydrophobicContact CB-CG 4.24Å; A16-S69 PolarHBondContact N-O 2.84Å
17	S	96.8	Very high	96.1	Very high	102 Å²	102	71.8 Å²	71.8	71%	0.713	42%	0.415	S	S	*	.			trans	-152.2	157.1	172.2	62.2	0	0	0	0	110.4	Y19	S17-Y19 VanDerWaalsContact O-CD1 3.24Å; S17-Y19 WeakPolarHBondContact O-CD1 3.39Å
18	G	96.4	Very high	96.4	Very high	90 Å²	90	69.7 Å²	69.7	93%	0.928	39%	0.391	S	S	*	.	S	Bend	trans	82.7	4.1	177.1	0	0	0	0	0	115.8
19	Y	94.2	Very high	96.6	Very high	103 Å²	103	69.5 Å²	69.5	40%	0.404	39%	0.386	S	S	.	.	S	Bend	trans	-155.8	168	176.1	62.8	-89.5	0	0	0	111.6	A16 S17 F21 Y24	A16-Y19 HydrophobicContact CB-CE1 4.01Å; A16-Y19 HydrophobicContact CB-CE2 4.16Å; A16-Y19 VanDerWaalsContact CB-OH 3.23Å; A16-Y19 WeakPolarHBondContact CB-OH 3.43Å; S17-Y19 VanDerWaalsContact O-CD1 3.24Å; S17-Y19 WeakPolarHBondContact O-CD1 3.39Å; Y19-F21 PolarHBondContact O-N 2.82Å; Y19-F21 VanDerWaalsContact O-N 3.09Å; Y19-Y24 AromaticContact CD2-CD2 3.49Å; Y19-Y24 HydrophobicContact CD2-CD2 3.49Å; Y19-Y24 VanDerWaalsContact CD2-CD2 3.49Å; Y19-Y24 AromaticContact CD2-CE2 3.9Å; Y19-Y24 HydrophobicContact CD2-CE2 3.9Å; Y19-Y24 AromaticContact CE2-CD2 3.78Å; Y19-Y24 HydrophobicContact CE2-CD2 3.78Å; Y19-Y24 HydrophobicContact CE2-CG 4.46Å; Y19-Y24 HydrophobicContact CG-CD2 4.35Å; Y19-Y24 HydrophobicContact CG-CE2 4.39Å
20	T	96.6	Very high	96.7	Very high	90 Å²	90	66.6 Å²	66.6	55%	0.552	37%	0.365	S	S	*	.			trans	-69.9	102	172.4	-57.1	0	0	0	0	110	T22 S23	T20-T22 WeakPolarHBondContact CG2-OG1 3.49Å; T20-T22 PolarHBondContact O-N 2.74Å; T20-T22 VanDerWaalsContact O-N 3.09Å; T20-S23 WeakPolarHBondContact CB-OG 3.43Å; T20-S23 WeakPolarHBondContact CG2-OG 3.44Å; T20-S23 VanDerWaalsContact O-CB 3.32Å; T20-S23 WeakPolarHBondContact O-CB 3.26Å; T20-S23 PolarHBondContact O-N 3.15Å
21	F	96.6	Very high	96.7	Very high	8 Å²	8	69.1 Å²	69.1	4%	0.035	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-51.6	-36.6	-174.5	176.2	-123.3	0	0	0	114	A16 Y19 S23 M26 P45 V64 A71	A16-F21 HydrophobicContact CB-CB 4.41Å; A16-F21 HydrophobicContact CB-CD2 3.41Å; A16-F21 VanDerWaalsContact CB-CD2 3.41Å; A16-F21 HydrophobicContact CB-CE2 4Å; A16-F21 HydrophobicContact CB-CG 4.24Å; Y19-F21 PolarHBondContact O-N 2.82Å; Y19-F21 VanDerWaalsContact O-N 3.09Å; F21-S23 VanDerWaalsContact C-N 3.25Å; F21-S23 PolarHBondContact O-N 3.49Å; F21-M26 HydrophobicContact CE2-CE 4.11Å; F21-P45 HydrophobicContact CD1-CB 3.87Å; F21-P45 HydrophobicContact CD2-CG 4.39Å; F21-P45 HydrophobicContact CE1-CB 3.55Å; F21-P45 HydrophobicContact CE1-CG 4.19Å; F21-P45 HydrophobicContact CE2-CB 4.25Å; F21-P45 HydrophobicContact CE2-CG 3.99Å; F21-P45 HydrophobicContact CG-CB 4.37Å; F21-P45 HydrophobicContact CZ-CB 3.76Å; F21-P45 HydrophobicContact CZ-CG 3.89Å; F21-V64 HydrophobicContact CE1-CB 4.39Å; F21-V64 HydrophobicContact CE1-CG1 4.45Å; F21-V64 HydrophobicContact CZ-CG1 4.16Å; F21-A71 HydrophobicContact CZ-CB 4.17Å
22	T	97.3	Very high	96.6	Very high	55 Å²	55	65.8 Å²	65.8	34%	0.337	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-74.9	-8.9	-179.5	53.3	0	0	0	0	114.6	T20 K66	T20-T22 WeakPolarHBondContact CG2-OG1 3.49Å; T20-T22 PolarHBondContact O-N 2.74Å; T20-T22 VanDerWaalsContact O-N 3.09Å; T22-K66 HydrophobicContact CG2-CD 4.32Å
23	S	96.7	Very high	96.5	Very high	77 Å²	77	69.2 Å²	69.2	54%	0.538	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-84.1	-13.1	-179	-60.5	0	0	0	0	114	T20 F21	T20-S23 WeakPolarHBondContact CB-OG 3.43Å; T20-S23 WeakPolarHBondContact CG2-OG 3.44Å; T20-S23 VanDerWaalsContact O-CB 3.32Å; T20-S23 WeakPolarHBondContact O-CB 3.26Å; T20-S23 PolarHBondContact O-N 3.15Å; F21-S23 VanDerWaalsContact C-N 3.25Å; F21-S23 PolarHBondContact O-N 3.49Å
24	Y	95.2	Very high	96.2	Very high	147 Å²	147	77.8 Å²	77.8	58%	0.576	41%	0.405	S	S	*	.	S	Bend	trans	-129.8	143.9	-174.4	-62.1	-83.2	0	0	0	111.7	Y19 P45	Y19-Y24 AromaticContact CD2-CD2 3.49Å; Y19-Y24 HydrophobicContact CD2-CD2 3.49Å; Y19-Y24 VanDerWaalsContact CD2-CD2 3.49Å; Y19-Y24 AromaticContact CD2-CE2 3.9Å; Y19-Y24 HydrophobicContact CD2-CE2 3.9Å; Y19-Y24 AromaticContact CE2-CD2 3.78Å; Y19-Y24 HydrophobicContact CE2-CD2 3.78Å; Y19-Y24 HydrophobicContact CE2-CG 4.46Å; Y19-Y24 HydrophobicContact CG-CD2 4.35Å; Y19-Y24 HydrophobicContact CG-CE2 4.39Å; Y24-P45 WeakPolarHBondContact O-CD 3.17Å; Y24-P45 VanDerWaalsContact O-CG 3.28Å; Y24-P45 WeakPolarHBondContact O-CG 3.47Å
25	W	97.4	Very high	95.8	Very high	117 Å²	117	80.1 Å²	80.1	44%	0.443	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-73.6	138.2	172.8	-70.8	60.7	0	0	0	109.8	N42 N44 N51	W25-N42 HydrophobicContact CE3-CB 4.09Å; W25-N42 VanDerWaalsContact CE3-CG 3.43Å; W25-N42 WeakPolarHBondContact CZ3-OD1 3.19Å; W25-N44 HydrophobicContact CD2-CB 3.9Å; W25-N44 HydrophobicContact CE3-CB 4Å; W25-N44 HydrophobicContact CH2-CB 4.1Å; W25-N44 HydrophobicContact CZ2-CB 3.97Å; W25-N44 HydrophobicContact CZ3-CB 4.07Å; W25-N51 WeakPolarHBondContact CZ3-ND2 3.18Å
26	M	97.6	Very high	95.6	Very high	21 Å²	21	75.2 Å²	75.2	10%	0.103	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.5	172.4	-173.3	60.6	64.8	0	0	109.1	F21 N42 I43 A71	F21-M26 HydrophobicContact CE2-CE 4.11Å; M26-N42 CarbonylContact O-C 3.51Å; M26-N42 WeakPolarHBondContact O-CA 3.02Å; M26-N42 VanDerWaalsContact O-CB 3.3Å; M26-N42 WeakPolarHBondContact O-CB 3.43Å; M26-I43 HydrophobicContact CB-CG2 3.94Å; M26-I43 PolarHBondContact N-O 3.21Å; M26-I43 PolarHBondContact O-N 3.24Å; M26-A71 HydrophobicContact CB-CB 4.14Å; M26-A71 HydrophobicContact CG-CB 3.7Å
27	H	97.8	Very high	95.6	Very high	88 Å²	88	80.2 Å²	80.2	41%	0.407	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.2	177.3	-69.2	-109.7	0	0	0	109.8	W39 N42	H27-W39 AromaticContact ND1-CD1 3.94Å; H27-W39 AromaticContact ND1-NE1 3.29Å; H27-W39 PolarHBondContact ND1-NE1 2.89Å; H27-N42 PolarHBondContact CE1-ND2 3.35Å
28	W	98.1	Very high	95.5	Very high	7 Å²	7	77 Å²	77	3%	0.027	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.1	172.7	-67.2	90.1	0	0	0	109.5	L12 C14 I40 G41 L62 A71 M73 Y87	L12-W28 HydrophobicContact CB-CH2 4.1Å; L12-W28 HydrophobicContact CB-CZ3 3.94Å; L12-W28 HydrophobicContact CD1-CZ3 4.43Å; C14-W28 HydrophobicContact CB-CH2 3.95Å; C14-W28 HydrophobicContact CB-CZ2 4.24Å; W28-I40 HydrophobicContact CB-CB 4.28Å; W28-I40 WeakPolarHBondContact O-CB 3.41Å; W28-I40 PolarHBondContact O-N 3.47Å; W28-G41 PolarHBondContact N-O 2.65Å; W28-L62 HydrophobicContact CG-CD2 4.08Å; W28-A71 HydrophobicContact CZ2-CB 4.21Å; W28-M73 HydrophobicContact CB-CE 4.23Å; W28-M73 HydrophobicContact CB-SD 3.92Å; W28-M73 HydrophobicContact CD2-CB 3.74Å; W28-M73 HydrophobicContact CD2-CE 4.01Å; W28-M73 HydrophobicContact CD2-SD 4.09Å; W28-M73 HydrophobicContact CE3-CB 3.9Å; W28-M73 HydrophobicContact CE3-CE 3.52Å; W28-M73 HydrophobicContact CE3-SD 4.23Å; W28-M73 HydrophobicContact CG-CB 4.34Å; W28-M73 HydrophobicContact CG-CE 4.34Å; W28-M73 HydrophobicContact CG-SD 3.98Å; W28-M73 HydrophobicContact CH2-CB 3.96Å; W28-M73 HydrophobicContact CZ2-CB 3.83Å; W28-M73 HydrophobicContact CZ3-CB 4Å; W28-M73 HydrophobicContact CZ3-CE 4.16Å; W28-Y87 CarbonylContact C-O 3.59Å; W28-Y87 WeakPolarHBondContact CA-O 3.13Å
29	V	97.3	Very high	95.6	Very high	30 Å²	30	76.7 Å²	76.7	18%	0.182	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	143.5	-176.6	-174.5	0	0	0	0	108.6	L37 E38 Y86 Y87	V29-L37 HydrophobicContact CG1-CB 3.69Å; V29-L37 HydrophobicContact CG1-CD2 3.65Å; V29-L37 HydrophobicContact CG1-CG 4.18Å; V29-E38 WeakPolarHBondContact CA-O 3.12Å; V29-E38 WeakPolarHBondContact CG1-O 3.36Å; V29-Y86 WeakPolarHBondContact O-CA 3.29Å; V29-Y87 PolarHBondContact N-O 2.86Å; V29-Y87 PolarHBondContact O-N 2.63Å
30	K	95.4	Very high	95.7	Very high	6 Å²	6	72 Å²	72	3%	0.026	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	151.1	169.7	68.2	178.7	-164.9	178.4	0	112.1	E38 I40 F56 A84 V85 Y86	K30-E38 WeakPolarHBondContact CE-OE2 3.33Å; K30-E38 HydrophobicContact CG-CB 4.03Å; K30-E38 PolarHBondContact N-O 2.82Å; K30-E38 PolarHBondContact O-N 2.92Å; K30-I40 HydrophobicContact CB-CD1 3.94Å; K30-I40 HydrophobicContact CD-CD1 4.29Å; K30-I40 HydrophobicContact CG-CD1 4.12Å; K30-I40 HydrophobicContact CG-CG1 4.24Å; K30-F56 HydrophobicContact CD-CE1 4.43Å; K30-F56 HydrophobicContact CD-CZ 4.49Å; K30-F56 VanDerWaalsContact CE-CZ 3.43Å; K30-A84 HydrophobicContact CB-CB 4.01Å; K30-V85 CarbonylContact C-O 3.53Å; K30-V85 WeakPolarHBondContact CA-O 3.31Å; K30-Y86 HydrophobicContact CB-CD1 3.84Å; K30-Y86 HydrophobicContact CB-CE1 3.74Å; K30-Y86 HydrophobicContact CD-CE1 4.3Å
31	Q	96.2	Very high	95.8	Very high	68 Å²	68	67.7 Å²	67.7	32%	0.318	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	117.7	176.5	-167.5	180	22.8	0	0	109.9	L37 A84 V85 Y87	Q31-L37 HydrophobicContact CB-CD2 3.95Å; Q31-L37 HydrophobicContact CG-CD2 4.25Å; Q31-A84 WeakPolarHBondContact O-CA 3.35Å; Q31-A84 WeakPolarHBondContact O-CB 3.4Å; Q31-V85 PolarHBondContact N-O 2.59Å; Q31-V85 PolarHBondContact O-N 2.94Å; Q31-Y87 HydrophobicContact CB-CE2 3.86Å; Q31-Y87 PolarHBondContact OE1-OH 2.7Å
32	R	94.1	Very high	95.8	Very high	47 Å²	47	68 Å²	68	18%	0.177	33%	0.333	C	S	.	.			trans	-88.9	155.3	170.4	-60.6	-165.7	-171.5	129.7	-13.5	110.6	R34 Q35 E38 E81 A84	R32-R34 PolarHBondContact O-N 2.86Å; R32-Q35 HydrophobicContact CB-CB 4.01Å; R32-Q35 HydrophobicContact CB-CG 4.06Å; R32-Q35 PolarHBondContact O-N 2.64Å; R32-E38 IonicContact NH1-OE2 3.99Å; R32-E81 PolarHBondContact NE-O 3.47Å; R32-E81 PolarHBondContact NH2-O 2.92Å; R32-A84 HydrophobicContact CG-CB 4.12Å
33	P	92.9	Very high	95.9	Very high	112 Å²	112	65.6 Å²	65.6	73%	0.727	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	128.6	172.1	-25.1	34.2	0	0	0	110.6	Q35	P33-Q35 PolarHBondContact O-N 2.97Å
34	R	91	Very high	96	Very high	262 Å²	262	62.8 Å²	62.8	99%	0.989	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	10.2	-179.2	-49.8	176.2	174.8	159.4	-2.1	115.5	R32	R32-R34 PolarHBondContact O-N 2.86Å
35	Q	90.4	Very high	96.1	Very high	86 Å²	86	55.8 Å²	55.8	40%	0.402	27%	0.269	S	S	.	.			trans	-109	155.4	170.7	-62.2	-175.6	-0.5	0	0	110.2	R32 P33	R32-Q35 HydrophobicContact CB-CB 4.01Å; R32-Q35 HydrophobicContact CB-CG 4.06Å; R32-Q35 PolarHBondContact O-N 2.64Å; P33-Q35 PolarHBondContact O-N 2.97Å
36	G	93.1	Very high	96.1	Very high	54 Å²	54	52.6 Å²	52.6	56%	0.557	27%	0.265	S	S	*	.			trans	-68.5	178.3	171.5	0	0	0	0	0	112.4	E38	G36-E38 PolarHBondContact O-N 2.86Å
37	L	95.8	Very high	96	Very high	115 Å²	115	57 Å²	57	60%	0.602	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.9	171.5	-71.9	171.1	0	0	0	110	V29 Q31 Y87	V29-L37 HydrophobicContact CG1-CB 3.69Å; V29-L37 HydrophobicContact CG1-CD2 3.65Å; V29-L37 HydrophobicContact CG1-CG 4.18Å; Q31-L37 HydrophobicContact CB-CD2 3.95Å; Q31-L37 HydrophobicContact CG-CD2 4.25Å; L37-Y87 HydrophobicContact CD2-CD2 3.99Å; L37-Y87 HydrophobicContact CD2-CE2 3.96Å
38	E	96.1	Very high	96	Very high	33 Å²	33	54.4 Å²	54.4	15%	0.154	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	115.1	175.1	-61.4	-171.6	96.9	0	0	109.6	V29 K30 R32 G36 I40 K55 F56	V29-E38 WeakPolarHBondContact CA-O 3.12Å; V29-E38 WeakPolarHBondContact CG1-O 3.36Å; K30-E38 WeakPolarHBondContact CE-OE2 3.33Å; K30-E38 HydrophobicContact CG-CB 4.03Å; K30-E38 PolarHBondContact N-O 2.82Å; K30-E38 PolarHBondContact O-N 2.92Å; R32-E38 IonicContact NH1-OE2 3.99Å; G36-E38 PolarHBondContact O-N 2.86Å; E38-I40 PolarHBondContact O-N 2.67Å; E38-K55 IonicContact OE1-NZ 2.65Å; E38-K55 PolarHBondContact OE1-NZ 3.45Å; E38-F56 HydrophobicContact CB-CE2 4.08Å; E38-F56 HydrophobicContact CB-CZ 4.05Å
39	W	97.3	Very high	95.9	Very high	84 Å²	84	55.6 Å²	55.6	32%	0.318	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	127.1	176.9	179.8	70.5	0	0	0	110.9	H27 G41 N42 N51 N53	H27-W39 AromaticContact ND1-CD1 3.94Å; H27-W39 AromaticContact ND1-NE1 3.29Å; H27-W39 PolarHBondContact ND1-NE1 2.89Å; W39-G41 PolarHBondContact NE1-O 3.05Å; W39-N42 HydrophobicContact CZ2-CB 4.2Å; W39-N51 HydrophobicContact CH2-CB 4.19Å; W39-N53 HydrophobicContact CE3-CB 3.73Å; W39-N53 HydrophobicContact CZ3-CB 3.84Å; W39-N53 VanDerWaalsContact O-CB 3.26Å; W39-N53 WeakPolarHBondContact O-CB 3.46Å; W39-N53 PolarHBondContact O-ND2 2.9Å
40	I	97.3	Very high	96	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-48.3	-179.2	-64.9	169.9	0	0	0	110.8	W28 K30 E38 N53 F56 P60 M73 Y86	W28-I40 HydrophobicContact CB-CB 4.28Å; W28-I40 WeakPolarHBondContact O-CB 3.41Å; W28-I40 PolarHBondContact O-N 3.47Å; K30-I40 HydrophobicContact CB-CD1 3.94Å; K30-I40 HydrophobicContact CD-CD1 4.29Å; K30-I40 HydrophobicContact CG-CD1 4.12Å; K30-I40 HydrophobicContact CG-CG1 4.24Å; E38-I40 PolarHBondContact O-N 2.67Å; I40-N53 WeakPolarHBondContact O-CB 3.28Å; I40-N53 PolarHBondContact O-N 3.08Å; I40-F56 HydrophobicContact CB-CD2 4.49Å; I40-F56 HydrophobicContact CG1-CD2 4.22Å; I40-F56 HydrophobicContact CG2-CB 4.23Å; I40-P60 HydrophobicContact CG2-CB 4.04Å; I40-P60 HydrophobicContact CG2-CG 3.68Å; I40-M73 HydrophobicContact CD1-CE 3.92Å; I40-M73 HydrophobicContact CD1-SD 4.03Å; I40-M73 HydrophobicContact CG2-SD 4.07Å; I40-Y86 HydrophobicContact CD1-CD1 3.87Å; I40-Y86 HydrophobicContact CD1-CE1 3.77Å
41	G	97.8	Very high	96.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.9	178.3	-171.2	0	0	0	0	0	112.1	W28 W39 N51	W28-G41 PolarHBondContact N-O 2.65Å; W39-G41 PolarHBondContact NE1-O 3.05Å; G41-N51 CarbonylContact C-O 3.5Å; G41-N51 WeakPolarHBondContact CA-O 3.3Å
42	N	98.1	Very high	96.1	Very high	16 Å²	16	59.7 Å²	59.7	9%	0.086	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.9	171	62	34.2	0	0	0	111.3	W25 M26 H27 W39 T50 N51	W25-N42 HydrophobicContact CE3-CB 4.09Å; W25-N42 VanDerWaalsContact CE3-CG 3.43Å; W25-N42 WeakPolarHBondContact CZ3-OD1 3.19Å; M26-N42 CarbonylContact O-C 3.51Å; M26-N42 WeakPolarHBondContact O-CA 3.02Å; M26-N42 VanDerWaalsContact O-CB 3.3Å; M26-N42 WeakPolarHBondContact O-CB 3.43Å; H27-N42 PolarHBondContact CE1-ND2 3.35Å; W39-N42 HydrophobicContact CZ2-CB 4.2Å; N42-T50 VanDerWaalsContact O-CA 3.31Å; N42-T50 WeakPolarHBondContact O-CA 2.79Å; N42-N51 PolarHBondContact N-O 3.08Å; N42-N51 PolarHBondContact O-N 2.89Å; N42-N51 WeakPolarHBondContact OD1-CB 3.45Å; N42-N51 PolarHBondContact OD1-ND2 2.86Å
43	I	98.4	Very high	96.2	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.015	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.6	173.6	-174.9	157.8	0	0	0	109.2	M26 P45 G49 T50 L62 V64	M26-I43 HydrophobicContact CB-CG2 3.94Å; M26-I43 PolarHBondContact N-O 3.21Å; M26-I43 PolarHBondContact O-N 3.24Å; I43-P45 VanDerWaalsContact O-CD 3.27Å; I43-P45 WeakPolarHBondContact O-CD 3.3Å; I43-G49 CarbonylContact C-O 3.59Å; I43-G49 WeakPolarHBondContact CA-O 3.24Å; I43-T50 HydrophobicContact CB-CG2 4.01Å; I43-T50 HydrophobicContact CD1-CG2 3.72Å; I43-T50 HydrophobicContact CG1-CG2 3.82Å; I43-L62 HydrophobicContact CB-CB 4.14Å; I43-L62 HydrophobicContact CB-CD1 4.35Å; I43-L62 HydrophobicContact CD1-CB 4.07Å; I43-L62 HydrophobicContact CG2-CB 4.47Å; I43-V64 HydrophobicContact CD1-CB 4.47Å; I43-V64 HydrophobicContact CD1-CG1 3.76Å; I43-V64 HydrophobicContact CD1-CG2 4.26Å; I43-V64 HydrophobicContact CG1-CG1 3.89Å; I43-V64 HydrophobicContact CG2-CG1 3.85Å
44	N	98.1	Very high	96.3	Very high	18 Å²	18	61.1 Å²	61.1	10%	0.096	32%	0.322	C	S	.	.			trans	-83.8	110.5	171.2	-179	-13.7	0	0	0	108.8	W25 S46 N47 G48 G49	W25-N44 HydrophobicContact CD2-CB 3.9Å; W25-N44 HydrophobicContact CE3-CB 4Å; W25-N44 HydrophobicContact CH2-CB 4.1Å; W25-N44 HydrophobicContact CZ2-CB 3.97Å; W25-N44 HydrophobicContact CZ3-CB 4.07Å; N44-S46 VanDerWaalsContact CG-OG 3.22Å; N44-S46 PolarHBondContact ND2-OG 3.33Å; N44-S46 PolarHBondContact O-N 3.04Å; N44-S46 WeakPolarHBondContact OD1-CB 3.37Å; N44-S46 PolarHBondContact OD1-N 3.35Å; N44-S46 PolarHBondContact OD1-OG 3.29Å; N44-N47 WeakPolarHBondContact CB-OD1 3.23Å; N44-N47 PolarHBondContact ND2-OD1 2.82Å; N44-N47 PolarHBondContact O-N 3.47Å; N44-G48 VanDerWaalsContact O-CA 3.31Å; N44-G48 WeakPolarHBondContact O-CA 3.42Å; N44-G48 PolarHBondContact O-N 2.92Å; N44-G49 PolarHBondContact N-O 3.07Å
45	P	97.8	Very high	96.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.4	-176.7	-16.9	32.1	0	0	0	113.8	F21 Y24 I43 V64 K66	F21-P45 HydrophobicContact CD1-CB 3.87Å; F21-P45 HydrophobicContact CD2-CG 4.39Å; F21-P45 HydrophobicContact CE1-CB 3.55Å; F21-P45 HydrophobicContact CE1-CG 4.19Å; F21-P45 HydrophobicContact CE2-CB 4.25Å; F21-P45 HydrophobicContact CE2-CG 3.99Å; F21-P45 HydrophobicContact CG-CB 4.37Å; F21-P45 HydrophobicContact CZ-CB 3.76Å; F21-P45 HydrophobicContact CZ-CG 3.89Å; Y24-P45 WeakPolarHBondContact O-CD 3.17Å; Y24-P45 VanDerWaalsContact O-CG 3.28Å; Y24-P45 WeakPolarHBondContact O-CG 3.47Å; I43-P45 VanDerWaalsContact O-CD 3.27Å; I43-P45 WeakPolarHBondContact O-CD 3.3Å; P45-V64 HydrophobicContact CB-CG1 4.08Å; P45-V64 HydrophobicContact CG-CG1 4.35Å; P45-K66 WeakPolarHBondContact O-CE 3.38Å
46	S	97.4	Very high	96.2	Very high	51 Å²	51	51.9 Å²	51.9	36%	0.357	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-41.4	177.6	69.3	0	0	0	0	112.8	N44 K66	N44-S46 VanDerWaalsContact CG-OG 3.22Å; N44-S46 PolarHBondContact ND2-OG 3.33Å; N44-S46 PolarHBondContact O-N 3.04Å; N44-S46 WeakPolarHBondContact OD1-CB 3.37Å; N44-S46 PolarHBondContact OD1-N 3.35Å; N44-S46 PolarHBondContact OD1-OG 3.29Å; S46-K66 PolarHBondContact O-NZ 3.44Å
47	N	96.6	Very high	95.9	Very high	114 Å²	114	54.5 Å²	54.5	61%	0.61	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	-3.9	-172.1	66.1	11	0	0	0	114.4	N44 G49	N44-N47 WeakPolarHBondContact CB-OD1 3.23Å; N44-N47 PolarHBondContact ND2-OD1 2.82Å; N44-N47 PolarHBondContact O-N 3.47Å; N47-G49 VanDerWaalsContact C-N 3.27Å; N47-G49 PolarHBondContact O-N 3.01Å; N47-G49 PolarHBondContact OD1-N 3.45Å
48	G	96.4	Very high	95.6	Very high	33 Å²	33	54.3 Å²	54.3	34%	0.34	29%	0.292	S	S	.	.			trans	77.1	7.1	-179.4	0	0	0	0	0	114.5	N44 T50	N44-G48 VanDerWaalsContact O-CA 3.31Å; N44-G48 WeakPolarHBondContact O-CA 3.42Å; N44-G48 PolarHBondContact O-N 2.92Å; G48-T50 PolarHBondContact O-N 2.87Å
49	G	97.8	Very high	95.3	Very high	31 Å²	31	55.2 Å²	55.2	32%	0.32	30%	0.296	S	S	.	.			trans	-60.8	133.9	176.2	0	0	0	0	0	111.1	I43 N44 N47	I43-G49 CarbonylContact C-O 3.59Å; I43-G49 WeakPolarHBondContact CA-O 3.24Å; N44-G49 PolarHBondContact N-O 3.07Å; N47-G49 VanDerWaalsContact C-N 3.27Å; N47-G49 PolarHBondContact O-N 3.01Å; N47-G49 PolarHBondContact OD1-N 3.45Å
50	T	97.9	Very high	95.2	Very high	53 Å²	53	51.6 Å²	51.6	33%	0.325	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.9	-177.3	51.3	0	0	0	0	111.4	N42 I43 G48 Y52 L62	N42-T50 VanDerWaalsContact O-CA 3.31Å; N42-T50 WeakPolarHBondContact O-CA 2.79Å; I43-T50 HydrophobicContact CB-CG2 4.01Å; I43-T50 HydrophobicContact CD1-CG2 3.72Å; I43-T50 HydrophobicContact CG1-CG2 3.82Å; G48-T50 PolarHBondContact O-N 2.87Å; T50-Y52 WeakPolarHBondContact OG1-CE2 2.95Å; T50-L62 HydrophobicContact CG2-CB 3.96Å
51	N	97.3	Very high	95.2	Very high	81 Å²	81	54.9 Å²	54.9	43%	0.433	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	145.1	165	-58.4	-67.3	0	0	0	109.2	W25 W39 G41 N42	W25-N51 WeakPolarHBondContact CZ3-ND2 3.18Å; W39-N51 HydrophobicContact CH2-CB 4.19Å; G41-N51 CarbonylContact C-O 3.5Å; G41-N51 WeakPolarHBondContact CA-O 3.3Å; N42-N51 PolarHBondContact N-O 3.08Å; N42-N51 PolarHBondContact O-N 2.89Å; N42-N51 WeakPolarHBondContact OD1-CB 3.45Å; N42-N51 PolarHBondContact OD1-ND2 2.86Å
52	Y	97.4	Very high	95.2	Very high	57 Å²	57	55.3 Å²	55.3	22%	0.224	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.3	179.8	-63.5	-86.8	0	0	0	109.9	T50 K57 P60 L62	T50-Y52 WeakPolarHBondContact OG1-CE2 2.95Å; Y52-K57 HydrophobicContact CG-CG 4.4Å; Y52-P60 HydrophobicContact CD1-CG 4.02Å; Y52-P60 HydrophobicContact CE1-CB 4.48Å; Y52-P60 HydrophobicContact CE1-CG 4.06Å; Y52-P60 WeakPolarHBondContact CE1-O 3.37Å; Y52-L62 HydrophobicContact CE1-CD1 4.05Å; Y52-L62 HydrophobicContact CE1-CG 3.78Å; Y52-L62 PolarHBondContact OH-N 2.95Å
53	N	95.8	Very high	95.2	Very high	51 Å²	51	57.5 Å²	57.5	27%	0.273	32%	0.319	S	S	.	.			trans	-70.5	128.9	161.1	-173.6	-27.3	0	0	0	108.5	W39 I40 K55 F56 K57	W39-N53 HydrophobicContact CE3-CB 3.73Å; W39-N53 HydrophobicContact CZ3-CB 3.84Å; W39-N53 VanDerWaalsContact O-CB 3.26Å; W39-N53 WeakPolarHBondContact O-CB 3.46Å; W39-N53 PolarHBondContact O-ND2 2.9Å; I40-N53 WeakPolarHBondContact O-CB 3.28Å; I40-N53 PolarHBondContact O-N 3.08Å; N53-K55 PolarHBondContact O-N 3.16Å; N53-K55 VanDerWaalsContact O-N 3.08Å; N53-K55 WeakPolarHBondContact OD1-CB 3.42Å; N53-K55 PolarHBondContact OD1-N 2.86Å; N53-K55 VanDerWaalsContact OD1-N 3.08Å; N53-F56 HydrophobicContact CB-CD2 3.93Å; N53-F56 PolarHBondContact O-N 2.76Å; N53-K57 PolarHBondContact O-N 3Å; N53-K57 VanDerWaalsContact O-N 3.08Å
54	E	94.2	Very high	95.2	Very high	138 Å²	138	59.1 Å²	59.1	65%	0.645	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-30.6	-179.3	-69	-60.6	153.3	0	0	112.5	F56 K57	E54-F56 PolarHBondContact O-N 2.88Å; E54-K57 IonicContact OE1-NZ 2.76Å; E54-K57 PolarHBondContact OE1-NZ 3.08Å; E54-K57 WeakPolarHBondContact OE2-CD 3.35Å; E54-K57 IonicContact OE2-NZ 3.26Å; E54-K57 PolarHBondContact OE2-NZ 3.26Å
55	K	91	Very high	95.2	Very high	130 Å²	130	60.7 Å²	60.7	57%	0.565	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-30.3	175.1	-175.7	175.7	177.9	-179	0	113.5	E38 N53	E38-K55 IonicContact OE1-NZ 2.65Å; E38-K55 PolarHBondContact OE1-NZ 3.45Å; N53-K55 PolarHBondContact O-N 3.16Å; N53-K55 VanDerWaalsContact O-N 3.08Å; N53-K55 WeakPolarHBondContact OD1-CB 3.42Å; N53-K55 PolarHBondContact OD1-N 2.86Å; N53-K55 VanDerWaalsContact OD1-N 3.08Å
56	F	89	Confident	95.1	Very high	24 Å²	24	66 Å²	66	11%	0.105	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-10.5	-171.1	-58	-59.1	0	0	0	113.9	K30 E38 I40 N53 E54 S58 K59 P60	K30-F56 HydrophobicContact CD-CE1 4.43Å; K30-F56 HydrophobicContact CD-CZ 4.49Å; K30-F56 VanDerWaalsContact CE-CZ 3.43Å; E38-F56 HydrophobicContact CB-CE2 4.08Å; E38-F56 HydrophobicContact CB-CZ 4.05Å; I40-F56 HydrophobicContact CB-CD2 4.49Å; I40-F56 HydrophobicContact CG1-CD2 4.22Å; I40-F56 HydrophobicContact CG2-CB 4.23Å; N53-F56 HydrophobicContact CB-CD2 3.93Å; N53-F56 PolarHBondContact O-N 2.76Å; E54-F56 PolarHBondContact O-N 2.88Å; F56-S58 PolarHBondContact O-N 2.85Å; F56-K59 PolarHBondContact O-N 2.81Å; F56-K59 VanDerWaalsContact O-N 3.16Å; F56-P60 WeakPolarHBondContact O-CD 3.46Å
57	K	87.4	Confident	95	Very high	108 Å²	108	68.8 Å²	68.8	47%	0.47	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-23.4	-168	-167.2	172.5	-175.5	176.6	0	116.8	Y52 N53 E54	Y52-K57 HydrophobicContact CG-CG 4.4Å; N53-K57 PolarHBondContact O-N 3Å; N53-K57 VanDerWaalsContact O-N 3.08Å; E54-K57 IonicContact OE1-NZ 2.76Å; E54-K57 PolarHBondContact OE1-NZ 3.08Å; E54-K57 WeakPolarHBondContact OE2-CD 3.35Å; E54-K57 IonicContact OE2-NZ 3.26Å; E54-K57 PolarHBondContact OE2-NZ 3.26Å
58	S	88.4	Confident	95.1	Very high	112 Å²	112	65 Å²	65	78%	0.783	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.1	-176.6	58.2	0	0	0	0	115.5	F56	F56-S58 PolarHBondContact O-N 2.85Å
59	K	90.1	Very high	95.1	Very high	52 Å²	52	65.3 Å²	65.3	23%	0.226	36%	0.36	C	S	.	.	S	Bend	trans	-106.5	-49.8	-171.3	-67	-172.7	177.6	-176.4	0	116	F56 S76 D82	F56-K59 PolarHBondContact O-N 2.81Å; F56-K59 VanDerWaalsContact O-N 3.16Å; K59-S76 PolarHBondContact O-OG 2.83Å; K59-D82 IonicContact NZ-OD1 3.05Å; K59-D82 PolarHBondContact NZ-OD1 3.38Å; K59-D82 IonicContact NZ-OD2 2.67Å; K59-D82 PolarHBondContact NZ-OD2 3.1Å
60	P	95.5	Very high	95.1	Very high	7 Å²	7	64.3 Å²	64.3	5%	0.045	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.6	-173.7	31.4	-30.1	0	0	0	110.8	I40 Y52 F56 M73 Q74 L75	I40-P60 HydrophobicContact CG2-CB 4.04Å; I40-P60 HydrophobicContact CG2-CG 3.68Å; Y52-P60 HydrophobicContact CD1-CG 4.02Å; Y52-P60 HydrophobicContact CE1-CB 4.48Å; Y52-P60 HydrophobicContact CE1-CG 4.06Å; Y52-P60 WeakPolarHBondContact CE1-O 3.37Å; F56-P60 WeakPolarHBondContact O-CD 3.46Å; P60-M73 HydrophobicContact CB-CG 4.06Å; P60-M73 HydrophobicContact CB-SD 3.96Å; P60-Q74 CarbonylContact C-O 3.53Å; P60-Q74 WeakPolarHBondContact CA-O 3.15Å; P60-L75 HydrophobicContact CB-CD2 3.84Å
61	T	97.4	Very high	95.2	Very high	73 Å²	73	61.8 Å²	61.8	45%	0.448	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	119.2	165.3	-59.3	0	0	0	0	108.5	T63 Q74	T61-T63 HydrophobicContact CG2-CG2 4.37Å; T61-Q74 PolarHBondContact N-O 2.92Å; T61-Q74 PolarHBondContact O-N 3.33Å
62	L	98.1	Very high	95.2	Very high	10 Å²	10	60.2 Å²	60.2	5%	0.052	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132.8	179.2	-52.9	-175.6	0	0	0	110.7	W28 I43 T50 Y52 Y72 M73	W28-L62 HydrophobicContact CG-CD2 4.08Å; I43-L62 HydrophobicContact CB-CB 4.14Å; I43-L62 HydrophobicContact CB-CD1 4.35Å; I43-L62 HydrophobicContact CD1-CB 4.07Å; I43-L62 HydrophobicContact CG2-CB 4.47Å; T50-L62 HydrophobicContact CG2-CB 3.96Å; Y52-L62 HydrophobicContact CE1-CD1 4.05Å; Y52-L62 HydrophobicContact CE1-CG 3.78Å; Y52-L62 PolarHBondContact OH-N 2.95Å; L62-Y72 WeakPolarHBondContact CA-O 3.08Å; L62-M73 HydrophobicContact CD2-CB 3.72Å; L62-M73 HydrophobicContact CD2-CG 3.66Å; L62-M73 HydrophobicContact CD2-SD 3.93Å
63	T	98.1	Very high	95.2	Very high	61 Å²	61	57.5 Å²	57.5	37%	0.374	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	161.7	176.4	57.9	0	0	0	0	111	T61 Y72	T61-T63 HydrophobicContact CG2-CG2 4.37Å; T63-Y72 PolarHBondContact N-O 2.93Å; T63-Y72 PolarHBondContact O-N 2.8Å
64	V	97.9	Very high	95.3	Very high	38 Å²	38	59.4 Å²	59.4	23%	0.23	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.2	176	-70.6	0	0	0	0	110.6	F21 I43 P45 T70 A71	F21-V64 HydrophobicContact CE1-CB 4.39Å; F21-V64 HydrophobicContact CE1-CG1 4.45Å; F21-V64 HydrophobicContact CZ-CG1 4.16Å; I43-V64 HydrophobicContact CD1-CB 4.47Å; I43-V64 HydrophobicContact CD1-CG1 3.76Å; I43-V64 HydrophobicContact CD1-CG2 4.26Å; I43-V64 HydrophobicContact CG1-CG1 3.89Å; I43-V64 HydrophobicContact CG2-CG1 3.85Å; P45-V64 HydrophobicContact CB-CG1 4.08Å; P45-V64 HydrophobicContact CG-CG1 4.35Å; V64-T70 WeakPolarHBondContact CA-O 3.22Å; V64-A71 HydrophobicContact CG1-CB 4.17Å
65	D	97.4	Very high	95.3	Very high	51 Å²	51	53.2 Å²	53.2	27%	0.273	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	106.8	164.8	174.1	9.1	0	0	0	108.4	S67 S68 S69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.29Å; D65-S67 PolarHBondContact O-N 2.86Å; D65-S67 WeakPolarHBondContact OD1-CB 3.27Å; D65-S67 PolarHBondContact OD1-N 2.91Å; D65-S67 PolarHBondContact OD1-OG 2.89Å; D65-S67 PolarHBondContact OD2-OG 2.91Å; D65-S68 WeakPolarHBondContact CB-OG 3.36Å; D65-S68 PolarHBondContact OD1-N 3.01Å; D65-S68 VanDerWaalsContact OD2-CB 3.29Å; D65-S68 WeakPolarHBondContact OD2-CB 3.31Å; D65-S68 PolarHBondContact OD2-OG 3.36Å; D65-S69 PolarHBondContact O-N 3.04Å; D65-S69 VanDerWaalsContact O-N 3.1Å; D65-T70 PolarHBondContact N-O 3.09Å; D65-T70 PolarHBondContact O-N 3.18Å; D65-Y72 HydrophobicContact CB-CE2 3.91Å
66	K	96.1	Very high	95.5	Very high	111 Å²	111	49 Å²	49	48%	0.483	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-29.6	-178.3	-54.9	-176.2	-160.6	-179.8	0	111.8	T22 P45 S46 S69	T22-K66 HydrophobicContact CG2-CD 4.32Å; P45-K66 WeakPolarHBondContact O-CE 3.38Å; S46-K66 PolarHBondContact O-NZ 3.44Å; K66-S69 PolarHBondContact O-N 3.42Å
67	S	95.8	Very high	95.7	Very high	110 Å²	110	51.5 Å²	51.5	77%	0.769	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-38.2	-177.2	73	0	0	0	0	111.7	D65	D65-S67 VanDerWaalsContact C-N 3.29Å; D65-S67 PolarHBondContact O-N 2.86Å; D65-S67 WeakPolarHBondContact OD1-CB 3.27Å; D65-S67 PolarHBondContact OD1-N 2.91Å; D65-S67 PolarHBondContact OD1-OG 2.89Å; D65-S67 PolarHBondContact OD2-OG 2.91Å
68	S	97.3	Very high	95.9	Very high	35 Å²	35	47 Å²	47	25%	0.245	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-1.5	177	66.5	0	0	0	0	113.9	K15 D65 T70	K15-S68 WeakPolarHBondContact CE-O 3.11Å; D65-S68 WeakPolarHBondContact CB-OG 3.36Å; D65-S68 PolarHBondContact OD1-N 3.01Å; D65-S68 VanDerWaalsContact OD2-CB 3.29Å; D65-S68 WeakPolarHBondContact OD2-CB 3.31Å; D65-S68 PolarHBondContact OD2-OG 3.36Å; S68-T70 VanDerWaalsContact C-N 3.27Å; S68-T70 PolarHBondContact O-N 3.24Å; S68-T70 PolarHBondContact O-OG1 2.84Å; S68-T70 WeakPolarHBondContact OG-CB 3.33Å; S68-T70 PolarHBondContact OG-OG1 2.99Å
69	S	97.6	Very high	96.1	Very high	39 Å²	39	44.6 Å²	44.6	27%	0.273	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	43	-172	-61.5	0	0	0	0	112.9	A16 D65 K66	A16-S69 PolarHBondContact N-O 2.84Å; D65-S69 PolarHBondContact O-N 3.04Å; D65-S69 VanDerWaalsContact O-N 3.1Å; K66-S69 PolarHBondContact O-N 3.42Å
70	T	98.3	Very high	96.1	Very high	9 Å²	9	47.4 Å²	47.4	6%	0.055	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.8	-174.5	-49	0	0	0	0	111.1	C14 K15 V64 D65 S68 Y72	C14-T70 CarbonylContact O-C 3.44Å; C14-T70 WeakPolarHBondContact O-CA 3.33Å; K15-T70 HydrophobicContact CB-CG2 4.42Å; V64-T70 WeakPolarHBondContact CA-O 3.22Å; D65-T70 PolarHBondContact N-O 3.09Å; D65-T70 PolarHBondContact O-N 3.18Å; S68-T70 VanDerWaalsContact C-N 3.27Å; S68-T70 PolarHBondContact O-N 3.24Å; S68-T70 PolarHBondContact O-OG1 2.84Å; S68-T70 WeakPolarHBondContact OG-CB 3.33Å; S68-T70 PolarHBondContact OG-OG1 2.99Å; T70-Y72 HydrophobicContact CG2-CD1 4.25Å; T70-Y72 HydrophobicContact CG2-CD2 4.38Å; T70-Y72 HydrophobicContact CG2-CE1 3.65Å; T70-Y72 HydrophobicContact CG2-CE2 3.79Å
71	A	98.2	Very high	95.8	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	148.3	166.6	0	0	0	0	0	109.9	S13 C14 F21 M26 W28 V64	S13-A71 CarbonylContact C-O 3.58Å; S13-A71 WeakPolarHBondContact CA-O 3.37Å; C14-A71 PolarHBondContact N-O 2.95Å; C14-A71 PolarHBondContact O-N 3.48Å; F21-A71 HydrophobicContact CZ-CB 4.17Å; M26-A71 HydrophobicContact CB-CB 4.14Å; M26-A71 HydrophobicContact CG-CB 3.7Å; W28-A71 HydrophobicContact CZ2-CB 4.21Å; V64-A71 HydrophobicContact CG1-CB 4.17Å
72	Y	98.3	Very high	95.5	Very high	49 Å²	49	50.4 Å²	50.4	19%	0.192	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.9	177.7	-54.3	-89.8	0	0	0	111.4	K11 L12 L62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.32Å; K11-Y72 VanDerWaalsContact CE-CD1 3.42Å; K11-Y72 VanDerWaalsContact CE-CG 3.49Å; K11-Y72 HydrophobicContact CG-CD1 4.32Å; L12-Y72 CarbonylContact O-C 3.57Å; L12-Y72 WeakPolarHBondContact O-CA 3.4Å; L12-Y72 WeakPolarHBondContact O-CB 3.46Å; L62-Y72 WeakPolarHBondContact CA-O 3.08Å; T63-Y72 PolarHBondContact N-O 2.93Å; T63-Y72 PolarHBondContact O-N 2.8Å; D65-Y72 HydrophobicContact CB-CE2 3.91Å; T70-Y72 HydrophobicContact CG2-CD1 4.25Å; T70-Y72 HydrophobicContact CG2-CD2 4.38Å; T70-Y72 HydrophobicContact CG2-CE1 3.65Å; T70-Y72 HydrophobicContact CG2-CE2 3.79Å
73	M	97.8	Very high	95.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	116.8	167.1	177.3	165.9	66	0	0	108.8	L12 W28 I40 P60 L62 L75 Y86	L12-M73 HydrophobicContact CD1-CE 3.7Å; L12-M73 PolarHBondContact N-O 2.93Å; L12-M73 PolarHBondContact O-N 3.17Å; W28-M73 HydrophobicContact CB-CE 4.23Å; W28-M73 HydrophobicContact CB-SD 3.92Å; W28-M73 HydrophobicContact CD2-CB 3.74Å; W28-M73 HydrophobicContact CD2-CE 4.01Å; W28-M73 HydrophobicContact CD2-SD 4.09Å; W28-M73 HydrophobicContact CE3-CB 3.9Å; W28-M73 HydrophobicContact CE3-CE 3.52Å; W28-M73 HydrophobicContact CE3-SD 4.23Å; W28-M73 HydrophobicContact CG-CB 4.34Å; W28-M73 HydrophobicContact CG-CE 4.34Å; W28-M73 HydrophobicContact CG-SD 3.98Å; W28-M73 HydrophobicContact CH2-CB 3.96Å; W28-M73 HydrophobicContact CZ2-CB 3.83Å; W28-M73 HydrophobicContact CZ3-CB 4Å; W28-M73 HydrophobicContact CZ3-CE 4.16Å; I40-M73 HydrophobicContact CD1-CE 3.92Å; I40-M73 HydrophobicContact CD1-SD 4.03Å; I40-M73 HydrophobicContact CG2-SD 4.07Å; P60-M73 HydrophobicContact CB-CG 4.06Å; P60-M73 HydrophobicContact CB-SD 3.96Å; L62-M73 HydrophobicContact CD2-CB 3.72Å; L62-M73 HydrophobicContact CD2-CG 3.66Å; L62-M73 HydrophobicContact CD2-SD 3.93Å; M73-L75 HydrophobicContact CE-CD1 4.38Å; M73-L75 HydrophobicContact CE-CD2 4.5Å; M73-L75 HydrophobicContact CG-CD2 4.24Å; M73-L75 HydrophobicContact CG-CG 4.26Å; M73-L75 HydrophobicContact SD-CD2 4.17Å; M73-Y86 HydrophobicContact CE-CD1 3.46Å; M73-Y86 VanDerWaalsContact CE-CD1 3.46Å; M73-Y86 HydrophobicContact CE-CE1 3.93Å; M73-Y86 HydrophobicContact CE-CG 4.31Å
74	Q	97.1	Very high	95.1	Very high	90 Å²	90	52.6 Å²	52.6	42%	0.421	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.1	172	-177.4	172.5	-5.1	0	0	109.1	V10 P60 T61	V10-Q74 CarbonylContact O-C 3.57Å; V10-Q74 WeakPolarHBondContact O-CA 3.42Å; P60-Q74 CarbonylContact C-O 3.53Å; P60-Q74 WeakPolarHBondContact CA-O 3.15Å; T61-Q74 PolarHBondContact N-O 2.92Å; T61-Q74 PolarHBondContact O-N 3.33Å
75	L	95.4	Very high	95	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.042	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.8	172.6	-60.9	166	0	0	0	108.2	S9 V10 L12 P60 M73 L78 Y86	S9-L75 CarbonylContact C-O 3.59Å; S9-L75 WeakPolarHBondContact CA-O 3.48Å; S9-L75 WeakPolarHBondContact CB-O 3.41Å; V10-L75 HydrophobicContact CG1-CB 4.02Å; V10-L75 HydrophobicContact CG1-CD1 4.11Å; V10-L75 HydrophobicContact CG1-CG 4.48Å; V10-L75 PolarHBondContact N-O 2.81Å; V10-L75 PolarHBondContact O-N 3.09Å; L12-L75 HydrophobicContact CD1-CD1 4.41Å; P60-L75 HydrophobicContact CB-CD2 3.84Å; M73-L75 HydrophobicContact CE-CD1 4.38Å; M73-L75 HydrophobicContact CE-CD2 4.5Å; M73-L75 HydrophobicContact CG-CD2 4.24Å; M73-L75 HydrophobicContact CG-CG 4.26Å; M73-L75 HydrophobicContact SD-CD2 4.17Å; L75-L78 HydrophobicContact CB-CD2 3.65Å; L75-L78 HydrophobicContact CB-CG 4.47Å; L75-L78 HydrophobicContact CD1-CD2 4.16Å; L75-Y86 HydrophobicContact CD1-CE1 3.74Å; L75-Y86 HydrophobicContact CD1-CE2 4.31Å
76	S	93.8	Very high	94.9	Very high	41 Å²	41	54.7 Å²	54.7	29%	0.287	32%	0.322	S	S	.	.			trans	-110.7	156.2	178.8	57.5	0	0	0	0	111.5	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.17Å; K59-S76 PolarHBondContact O-OG 2.83Å; S76-L78 PolarHBondContact O-N 3.25Å
77	S	92.9	Very high	94.9	Very high	77 Å²	77	55.8 Å²	55.8	54%	0.538	32%	0.324	S	S	.	.	S	Bend	trans	52.3	51.4	174.2	-57.4	0	0	0	0	113.1	A8	A8-S77 PolarHBondContact O-N 2.95Å
78	L	92.6	Very high	94.9	Very high	13 Å²	13	53.1 Å²	53.1	7%	0.068	30%	0.302	C	S	.	.			trans	-63.3	138.6	-173	-69.2	170.2	0	0	0	112.6	V4 G7 A8 V10 L75 S76 D82	V4-L78 HydrophobicContact CB-CD1 4.43Å; V4-L78 HydrophobicContact CG2-CD1 3.5Å; V4-L78 VanDerWaalsContact CG2-CD1 3.5Å; G7-L78 PolarHBondContact N-O 2.97Å; A8-L78 WeakPolarHBondContact O-CB 3.37Å; A8-L78 WeakPolarHBondContact O-CG 3.36Å; A8-L78 PolarHBondContact O-N 2.6Å; V10-L78 HydrophobicContact CB-CD1 4.01Å; V10-L78 HydrophobicContact CG1-CD1 3.72Å; L75-L78 HydrophobicContact CB-CD2 3.65Å; L75-L78 HydrophobicContact CB-CG 4.47Å; L75-L78 HydrophobicContact CD1-CD2 4.16Å; S76-L78 PolarHBondContact O-N 3.25Å; L78-D82 WeakPolarHBondContact CA-OD2 3.5Å; L78-D82 HydrophobicContact CD2-CB 3.65Å
79	T	92.5	Very high	94.8	Very high	63 Å²	63	54.1 Å²	54.1	39%	0.387	31%	0.305	S	S	.	.			trans	-118	172.3	172.6	69.3	0	0	0	0	110.8	E81 D82	T79-E81 PolarHBondContact O-N 2.84Å; T79-E81 VanDerWaalsContact O-N 3.15Å; T79-E81 PolarHBondContact OG1-N 3.37Å; T79-D82 PolarHBondContact N-OD2 3.19Å; T79-D82 WeakPolarHBondContact O-CB 3.32Å; T79-D82 PolarHBondContact O-N 3.45Å; T79-D82 PolarHBondContact OG1-OD2 3.45Å
80	S	90.2	Very high	94.6	Very high	110 Å²	110	54.9 Å²	54.9	77%	0.769	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-57	-27.9	175.1	51.8	0	0	0	0	112.8	D82 S83	S80-D82 PolarHBondContact O-N 2.8Å; S80-S83 VanDerWaalsContact O-CB 3.28Å; S80-S83 WeakPolarHBondContact O-CB 3.49Å; S80-S83 PolarHBondContact O-N 3.41Å
81	E	88.5	Confident	94.4	Very high	126 Å²	126	57.6 Å²	57.6	59%	0.589	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-69	-19.3	176.3	-63.8	-173.5	179.9	0	0	113.7	R32 T79 S83	R32-E81 PolarHBondContact NE-O 3.47Å; R32-E81 PolarHBondContact NH2-O 2.92Å; T79-E81 PolarHBondContact O-N 2.84Å; T79-E81 VanDerWaalsContact O-N 3.15Å; T79-E81 PolarHBondContact OG1-N 3.37Å; E81-S83 VanDerWaalsContact C-N 3.26Å
82	D	91.6	Very high	94.1	Very high	17 Å²	17	61.2 Å²	61.2	9%	0.091	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-86.2	-1.9	177.3	-56.2	-45.6	0	0	0	111.7	K59 L78 T79 S80 A84 Y86	K59-D82 IonicContact NZ-OD1 3.05Å; K59-D82 PolarHBondContact NZ-OD1 3.38Å; K59-D82 IonicContact NZ-OD2 2.67Å; K59-D82 PolarHBondContact NZ-OD2 3.1Å; L78-D82 WeakPolarHBondContact CA-OD2 3.5Å; L78-D82 HydrophobicContact CD2-CB 3.65Å; T79-D82 PolarHBondContact N-OD2 3.19Å; T79-D82 WeakPolarHBondContact O-CB 3.32Å; T79-D82 PolarHBondContact O-N 3.45Å; T79-D82 PolarHBondContact OG1-OD2 3.45Å; S80-D82 PolarHBondContact O-N 2.8Å; D82-A84 PolarHBondContact O-N 3.47Å; D82-A84 VanDerWaalsContact O-N 3.17Å; D82-Y86 WeakPolarHBondContact O-CE2 3.4Å; D82-Y86 PolarHBondContact O-OH 3.41Å
83	S	93.2	Very high	93.9	Very high	91 Å²	91	62 Å²	62	64%	0.636	35%	0.351	S	S	*	.			trans	-69.6	109.7	172.2	-166.8	0	0	0	0	110.3	S80 E81	S80-S83 VanDerWaalsContact O-CB 3.28Å; S80-S83 WeakPolarHBondContact O-CB 3.49Å; S80-S83 PolarHBondContact O-N 3.41Å; E81-S83 VanDerWaalsContact C-N 3.26Å
84	A	94.4	Very high	93.6	Very high	27 Å²	27	66.4 Å²	66.4	22%	0.223	38%	0.376	C	S	.	.	S	Bend	trans	-160.7	167.4	-176	0	0	0	0	0	110.2	K30 Q31 R32 D82 Y86	K30-A84 HydrophobicContact CB-CB 4.01Å; Q31-A84 WeakPolarHBondContact O-CA 3.35Å; Q31-A84 WeakPolarHBondContact O-CB 3.4Å; R32-A84 HydrophobicContact CG-CB 4.12Å; D82-A84 PolarHBondContact O-N 3.47Å; D82-A84 VanDerWaalsContact O-N 3.17Å; A84-Y86 HydrophobicContact CB-CD2 4.49Å; A84-Y86 HydrophobicContact CB-CE2 4Å; A84-Y86 WeakPolarHBondContact O-CD2 3.5Å
85	V	96.2	Very high	93.3	Very high	79 Å²	79	64.6 Å²	64.6	48%	0.479	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133.7	159.5	-176	0	0	0	0	107.8	K30 Q31 Y87	K30-V85 CarbonylContact C-O 3.53Å; K30-V85 WeakPolarHBondContact CA-O 3.31Å; Q31-V85 PolarHBondContact N-O 2.59Å; Q31-V85 PolarHBondContact O-N 2.94Å; V85-Y87 HydrophobicContact CB-CE2 4.12Å; V85-Y87 HydrophobicContact CG1-CD2 4.39Å; V85-Y87 HydrophobicContact CG1-CE1 3.95Å; V85-Y87 HydrophobicContact CG1-CE2 3.72Å; V85-Y87 VanDerWaalsContact CG1-CZ 3.48Å
86	Y	96.3	Very high	93.1	Very high	53 Å²	53	69.3 Å²	69.3	21%	0.208	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	136.5	177.7	-68.5	-92.5	0	0	0	109.5	L12 V29 K30 I40 M73 L75 D82 A84	L12-Y86 HydrophobicContact CD1-CD1 4.08Å; L12-Y86 HydrophobicContact CD1-CD2 4.07Å; L12-Y86 HydrophobicContact CD1-CG 3.68Å; V29-Y86 WeakPolarHBondContact O-CA 3.29Å; K30-Y86 HydrophobicContact CB-CD1 3.84Å; K30-Y86 HydrophobicContact CB-CE1 3.74Å; K30-Y86 HydrophobicContact CD-CE1 4.3Å; I40-Y86 HydrophobicContact CD1-CD1 3.87Å; I40-Y86 HydrophobicContact CD1-CE1 3.77Å; M73-Y86 HydrophobicContact CE-CD1 3.46Å; M73-Y86 VanDerWaalsContact CE-CD1 3.46Å; M73-Y86 HydrophobicContact CE-CE1 3.93Å; M73-Y86 HydrophobicContact CE-CG 4.31Å; L75-Y86 HydrophobicContact CD1-CE1 3.74Å; L75-Y86 HydrophobicContact CD1-CE2 4.31Å; D82-Y86 WeakPolarHBondContact O-CE2 3.4Å; D82-Y86 PolarHBondContact O-OH 3.41Å; A84-Y86 HydrophobicContact CB-CD2 4.49Å; A84-Y86 HydrophobicContact CB-CE2 4Å; A84-Y86 WeakPolarHBondContact O-CD2 3.5Å
87	Y	95.7	Very high	93.1	Very high	135 Å²	135	71.9 Å²	71.9	53%	0.529	41%	0.411	S	S	.	.			trans	-121.9	0	178.1	-55.9	-84.7	0	0	0	109.7	W28 V29 Q31 L37 V85	W28-Y87 CarbonylContact C-O 3.59Å; W28-Y87 WeakPolarHBondContact CA-O 3.13Å; V29-Y87 PolarHBondContact N-O 2.86Å; V29-Y87 PolarHBondContact O-N 2.63Å; Q31-Y87 HydrophobicContact CB-CE2 3.86Å; Q31-Y87 PolarHBondContact OE1-OH 2.7Å; L37-Y87 HydrophobicContact CD2-CD2 3.99Å; L37-Y87 HydrophobicContact CD2-CE2 3.96Å; V85-Y87 HydrophobicContact CB-CE2 4.12Å; V85-Y87 HydrophobicContact CG1-CD2 4.39Å; V85-Y87 HydrophobicContact CG1-CE1 3.95Å; V85-Y87 HydrophobicContact CG1-CE2 3.72Å; V85-Y87 VanDerWaalsContact CG1-CZ 3.48Å

Retrieved 87 of 87 residues in 24.8 ms (Link to these results)

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