X5J4Q6_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4Q6, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 109 aa.

						>X5J4Q6_MOUSE|X5J4Q6
LSCKASGYTFTSYGISWVKQRTGQGLEWIGEIYPRSGNTYYNEKFKGKATLTADKSSSTAYMELRSLTSEDSAVYFCARSGYYGSSTRNYAMDYWGQGTSVTVSSESQS
					

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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	L	97.6	Very high	94.6	Very high	62 Å²	62	66.6 Å²	66.6	33%	0.325	42%	0.419	S	S	.	.				0	145.2	0	-63.1	111.8	0	0	0	109.5	W17 Y61 M62 L64 Y75 T99 V101	L1-W17 HydrophobicContact CB-CH2 3.94Å; L1-W17 HydrophobicContact CB-CZ3 3.71Å; L1-Y61 VanDerWaalsContact O-CA 3.31Å; L1-Y61 WeakPolarHBondContact O-CA 3.27Å; L1-M62 HydrophobicContact CD1-CE 3.65Å; L1-M62 PolarHBondContact N-O 3.25Å; L1-M62 PolarHBondContact O-N 3.3Å; L1-L64 HydrophobicContact CD1-CD1 3.76Å; L1-L64 HydrophobicContact CD1-CG 4.3Å; L1-Y75 HydrophobicContact CD1-CG 4.45Å; L1-Y75 HydrophobicContact CD2-CG 4.38Å; L1-T99 HydrophobicContact CD2-CG2 3.71Å; L1-V101 HydrophobicContact CD2-CG2 4.13Å
2	S	97.9	Very high	94.3	Very high	84 Å²	84	67.7 Å²	67.7	59%	0.587	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	149.3	176.5	58	0	0	0	0	110.7	A60	S2-A60 CarbonylContact C-O 3.58Å; S2-A60 WeakPolarHBondContact CA-O 3.49Å
3	C	97.6	Very high	94	Very high	17 Å²	17	68.3 Å²	68.3	12%	0.115	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	103.8	179.4	179.9	0	0	0	0	108.8	W17 T59 A60 C77	C3-W17 HydrophobicContact CB-CH2 3.77Å; C3-W17 HydrophobicContact CB-CZ2 3.96Å; C3-T59 CarbonylContact O-C 3.59Å; C3-T59 WeakPolarHBondContact O-CA 3.31Å; C3-A60 PolarHBondContact N-O 3.32Å; C3-A60 PolarHBondContact O-N 2.94Å; C3-C77 HydrophobicContact CB-CB 3.44Å; C3-C77 VanDerWaalsContact CB-CB 3.44Å; C3-C77 WeakPolarHBondContact CB-SG 3.26Å; C3-C77 WeakPolarHBondContact SG-CB 3.39Å; C3-C77 CovalentContact SG-SG 2.02Å; C3-C77 PolarHBondContact SG-SG 2.89Å
4	K	97.3	Very high	94	Very high	158 Å²	158	63.5 Å²	63.5	69%	0.687	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	122.9	179.3	-172.3	176.2	-177.4	178.5	0	110	T59	K4-T59 HydrophobicContact CB-CG2 4.49Å
5	A	94.6	Very high	94.1	Very high	13 Å²	13	59.3 Å²	59.3	11%	0.107	37%	0.365	C	S	.	.			trans	-74.9	147.3	175.1	0	0	0	0	0	111.4	Y8 F10 S58	A5-Y8 HydrophobicContact CB-CE1 3.89Å; A5-Y8 HydrophobicContact CB-CE2 4.01Å; A5-Y8 VanDerWaalsContact CB-CZ 3.48Å; A5-Y8 VanDerWaalsContact CB-OH 3.31Å; A5-Y8 WeakPolarHBondContact CB-OH 3.44Å; A5-F10 HydrophobicContact CB-CB 4.16Å; A5-F10 HydrophobicContact CB-CD2 3.41Å; A5-F10 VanDerWaalsContact CB-CD2 3.41Å; A5-F10 HydrophobicContact CB-CE2 4.12Å; A5-F10 HydrophobicContact CB-CG 4.13Å; A5-S58 PolarHBondContact N-O 3.46Å
6	S	92.8	Very high	94.3	Very high	102 Å²	102	55.7 Å²	55.7	71%	0.713	34%	0.342	S	S	*	.			trans	-146.6	146.1	174	62.1	0	0	0	0	110.1	Y8	S6-Y8 VanDerWaalsContact C-N 3.34Å; S6-Y8 WeakPolarHBondContact O-CD1 3.46Å; S6-Y8 PolarHBondContact O-N 2.96Å
7	G	91.3	Very high	94.5	Very high	93 Å²	93	52.6 Å²	52.6	96%	0.959	32%	0.323	S	S	*	.	S	Bend	trans	77.2	9.1	175.9	0	0	0	0	0	116.2
8	Y	89	Confident	94.6	Very high	59 Å²	59	49.9 Å²	49.9	23%	0.231	31%	0.306	C	S	.	.	S	Bend	trans	-154.4	164.1	174.2	64.1	-87.4	0	0	0	112.5	A5 S6 F10 Y13 I15 R79	A5-Y8 HydrophobicContact CB-CE1 3.89Å; A5-Y8 HydrophobicContact CB-CE2 4.01Å; A5-Y8 VanDerWaalsContact CB-CZ 3.48Å; A5-Y8 VanDerWaalsContact CB-OH 3.31Å; A5-Y8 WeakPolarHBondContact CB-OH 3.44Å; S6-Y8 VanDerWaalsContact C-N 3.34Å; S6-Y8 WeakPolarHBondContact O-CD1 3.46Å; S6-Y8 PolarHBondContact O-N 2.96Å; Y8-F10 PolarHBondContact O-N 2.8Å; Y8-Y13 AromaticContact CD2-CD2 3.53Å; Y8-Y13 HydrophobicContact CD2-CD2 3.53Å; Y8-Y13 HydrophobicContact CD2-CE2 4.01Å; Y8-Y13 HydrophobicContact CD2-CG 4.42Å; Y8-Y13 AromaticContact CE2-CD2 3.99Å; Y8-Y13 HydrophobicContact CE2-CD2 3.99Å; Y8-Y13 HydrophobicContact CE2-CG 4.5Å; Y8-Y13 HydrophobicContact CG-CD2 4.42Å; Y8-I15 WeakPolarHBondContact OH-CD1 3.25Å; Y8-R79 HydrophobicContact CE2-CG 4.08Å
9	T	93.3	Very high	94.7	Very high	90 Å²	90	47.3 Å²	47.3	55%	0.552	29%	0.29	S	S	*	.			trans	-69.8	101.1	172.9	-54.4	0	0	0	0	110	T11 S12	T9-T11 PolarHBondContact O-N 2.97Å; T9-T11 VanDerWaalsContact O-N 3.11Å; T9-S12 WeakPolarHBondContact CG2-OG 3.26Å; T9-S12 WeakPolarHBondContact O-CB 3.3Å; T9-S12 PolarHBondContact O-N 3.46Å
10	F	94.4	Very high	94.8	Very high	5 Å²	5	48.9 Å²	48.9	2%	0.022	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-50.8	-38.6	-174.5	177.3	-121.4	0	0	0	114.1	A5 Y8 S12 I15 P34 A53 A60	A5-F10 HydrophobicContact CB-CB 4.16Å; A5-F10 HydrophobicContact CB-CD2 3.41Å; A5-F10 VanDerWaalsContact CB-CD2 3.41Å; A5-F10 HydrophobicContact CB-CE2 4.12Å; A5-F10 HydrophobicContact CB-CG 4.13Å; Y8-F10 PolarHBondContact O-N 2.8Å; F10-S12 VanDerWaalsContact C-N 3.28Å; F10-S12 PolarHBondContact O-N 3.18Å; F10-I15 HydrophobicContact CD2-CD1 4.15Å; F10-I15 HydrophobicContact CD2-CG1 4.4Å; F10-I15 HydrophobicContact CE2-CD1 3.8Å; F10-I15 HydrophobicContact CE2-CG1 3.66Å; F10-I15 HydrophobicContact CZ-CG1 4.36Å; F10-P34 HydrophobicContact CD1-CB 3.82Å; F10-P34 HydrophobicContact CD1-CG 4.1Å; F10-P34 HydrophobicContact CD2-CG 4.26Å; F10-P34 HydrophobicContact CE1-CB 3.46Å; F10-P34 VanDerWaalsContact CE1-CB 3.46Å; F10-P34 HydrophobicContact CE1-CG 3.64Å; F10-P34 HydrophobicContact CE2-CG 3.84Å; F10-P34 HydrophobicContact CG-CG 4.4Å; F10-P34 HydrophobicContact CZ-CB 3.87Å; F10-P34 HydrophobicContact CZ-CG 3.49Å; F10-P34 VanDerWaalsContact CZ-CG 3.49Å; F10-A53 HydrophobicContact CE1-CB 4.16Å; F10-A53 HydrophobicContact CZ-CB 4.11Å; F10-A60 HydrophobicContact CE2-CB 4.31Å; F10-A60 HydrophobicContact CZ-CB 4.07Å
11	T	94.5	Very high	94.8	Very high	50 Å²	50	49.3 Å²	49.3	31%	0.307	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-76	-10.7	-178.5	53.3	0	0	0	0	114.1	T9 Y13 P34 R35 K55	T9-T11 PolarHBondContact O-N 2.97Å; T9-T11 VanDerWaalsContact O-N 3.11Å; T11-Y13 VanDerWaalsContact C-N 3.34Å; T11-P34 HydrophobicContact CG2-CB 4.49Å; T11-R35 VanDerWaalsContact O-CB 3.26Å; T11-R35 WeakPolarHBondContact O-CB 3.35Å; T11-K55 HydrophobicContact CG2-CB 4.46Å; T11-K55 HydrophobicContact CG2-CD 4.25Å; T11-K55 HydrophobicContact CG2-CG 4.33Å
12	S	91.6	Very high	94.2	Very high	79 Å²	79	53.5 Å²	53.5	55%	0.552	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-83.5	-9.1	179.7	-62	0	0	0	0	113.9	T9 F10	T9-S12 WeakPolarHBondContact CG2-OG 3.26Å; T9-S12 WeakPolarHBondContact O-CB 3.3Å; T9-S12 PolarHBondContact O-N 3.46Å; F10-S12 VanDerWaalsContact C-N 3.28Å; F10-S12 PolarHBondContact O-N 3.18Å
13	Y	90.8	Very high	93.8	Very high	76 Å²	76	53.7 Å²	53.7	30%	0.298	33%	0.334	S	S	.	.	S	Bend	trans	-131.3	155.5	-173	-62.8	-84.8	0	0	0	111.6	Y8 T11 P34 R79	Y8-Y13 AromaticContact CD2-CD2 3.53Å; Y8-Y13 HydrophobicContact CD2-CD2 3.53Å; Y8-Y13 HydrophobicContact CD2-CE2 4.01Å; Y8-Y13 HydrophobicContact CD2-CG 4.42Å; Y8-Y13 AromaticContact CE2-CD2 3.99Å; Y8-Y13 HydrophobicContact CE2-CD2 3.99Å; Y8-Y13 HydrophobicContact CE2-CG 4.5Å; Y8-Y13 HydrophobicContact CG-CD2 4.42Å; T11-Y13 VanDerWaalsContact C-N 3.34Å; Y13-P34 WeakPolarHBondContact O-CD 3.42Å; Y13-R79 HydrophobicContact CD1-CG 4.09Å; Y13-R79 HydrophobicContact CG-CG 3.84Å
14	G	93.1	Very high	93.5	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	157.1	164.4	0	0	0	0	0	110.9	I32 S80	G14-I32 CarbonylContact C-O 3.57Å; G14-I32 WeakPolarHBondContact CA-O 3.4Å; G14-S80 VanDerWaalsContact C-OG 3.31Å; G14-S80 PolarHBondContact N-O 2.87Å; G14-S80 PolarHBondContact O-N 3.03Å; G14-S80 PolarHBondContact O-OG 3.23Å
15	I	96.1	Very high	93.2	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	108.5	171.7	-50.7	-65.8	0	0	0	107.8	Y8 F10 E31 I32 P34 A60 C77 A78	Y8-I15 WeakPolarHBondContact OH-CD1 3.25Å; F10-I15 HydrophobicContact CD2-CD1 4.15Å; F10-I15 HydrophobicContact CD2-CG1 4.4Å; F10-I15 HydrophobicContact CE2-CD1 3.8Å; F10-I15 HydrophobicContact CE2-CG1 3.66Å; F10-I15 HydrophobicContact CZ-CG1 4.36Å; I15-E31 VanDerWaalsContact O-CA 3.31Å; I15-E31 WeakPolarHBondContact O-CA 2.98Å; I15-I32 HydrophobicContact CB-CG2 4.16Å; I15-I32 PolarHBondContact N-O 2.88Å; I15-I32 PolarHBondContact O-N 2.83Å; I15-P34 HydrophobicContact CG1-CG 4.12Å; I15-A60 HydrophobicContact CB-CB 4Å; I15-A60 HydrophobicContact CG1-CB 4.05Å; I15-A60 HydrophobicContact CG2-CB 3.78Å; I15-C77 HydrophobicContact CG2-CB 4.19Å; I15-A78 CarbonylContact C-O 3.5Å; I15-A78 WeakPolarHBondContact CA-O 3.38Å
16	S	96.7	Very high	93.2	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.007	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	145.4	175.8	-71.9	0	0	0	0	111.2	W28 G30 C77 A78 S80	S16-W28 PolarHBondContact OG-NE1 2.92Å; S16-G30 CarbonylContact C-O 3.52Å; S16-G30 WeakPolarHBondContact CA-O 3.35Å; S16-C77 CarbonylContact O-C 3.38Å; S16-C77 VanDerWaalsContact O-CA 3.25Å; S16-C77 WeakPolarHBondContact O-CA 3.47Å; S16-A78 PolarHBondContact N-O 3.43Å; S16-A78 PolarHBondContact O-N 3.06Å; S16-S80 WeakPolarHBondContact OG-CB 3.48Å; S16-S80 PolarHBondContact OG-OG 3.02Å
17	W	97.7	Very high	93.3	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135.5	173.8	-68.5	89.7	0	0	0	109.7	L1 C3 I29 G30 L51 A60 M62 F76 C77	L1-W17 HydrophobicContact CB-CH2 3.94Å; L1-W17 HydrophobicContact CB-CZ3 3.71Å; C3-W17 HydrophobicContact CB-CH2 3.77Å; C3-W17 HydrophobicContact CB-CZ2 3.96Å; W17-I29 HydrophobicContact CB-CB 4.17Å; W17-I29 HydrophobicContact CB-CD1 4.31Å; W17-I29 WeakPolarHBondContact O-CB 3.45Å; W17-I29 PolarHBondContact O-N 3.01Å; W17-G30 PolarHBondContact N-O 3.48Å; W17-L51 HydrophobicContact CG-CD2 4.08Å; W17-A60 HydrophobicContact CZ2-CB 4.28Å; W17-M62 HydrophobicContact CB-CE 4.26Å; W17-M62 HydrophobicContact CB-SD 3.76Å; W17-M62 HydrophobicContact CD2-CB 3.66Å; W17-M62 HydrophobicContact CD2-CE 4.05Å; W17-M62 HydrophobicContact CD2-CG 4.45Å; W17-M62 HydrophobicContact CD2-SD 4.01Å; W17-M62 HydrophobicContact CE3-CB 3.91Å; W17-M62 HydrophobicContact CE3-CE 3.57Å; W17-M62 HydrophobicContact CE3-SD 4.16Å; W17-M62 HydrophobicContact CG-CB 4.19Å; W17-M62 HydrophobicContact CG-CE 4.37Å; W17-M62 HydrophobicContact CG-SD 3.86Å; W17-M62 HydrophobicContact CH2-CB 4.08Å; W17-M62 HydrophobicContact CZ2-CB 3.85Å; W17-M62 HydrophobicContact CZ3-CB 4.11Å; W17-M62 HydrophobicContact CZ3-CE 4.22Å; W17-F76 WeakPolarHBondContact CA-O 3.28Å; W17-C77 HydrophobicContact CD2-CB 4.36Å; W17-C77 HydrophobicContact CE3-CB 4.13Å; W17-C77 HydrophobicContact CH2-CB 4.3Å; W17-C77 HydrophobicContact CZ2-CB 4.49Å; W17-C77 HydrophobicContact CZ3-CB 4.1Å
18	V	97.3	Very high	93.5	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	136.3	-172.2	-178.1	0	0	0	0	109.5	L26 E27 Y75 F76 M92 W95	V18-L26 HydrophobicContact CG1-CB 3.78Å; V18-L26 HydrophobicContact CG1-CD2 3.96Å; V18-L26 HydrophobicContact CG1-CG 4.33Å; V18-E27 CarbonylContact C-O 3.57Å; V18-E27 WeakPolarHBondContact CA-O 3.46Å; V18-Y75 CarbonylContact O-C 3.56Å; V18-Y75 WeakPolarHBondContact O-CA 3.42Å; V18-F76 PolarHBondContact N-O 2.89Å; V18-F76 PolarHBondContact O-N 2.9Å; V18-M92 HydrophobicContact CG2-CE 4.27Å; V18-M92 HydrophobicContact CG2-SD 3.95Å; V18-W95 HydrophobicContact CB-CH2 4.07Å; V18-W95 HydrophobicContact CB-CZ3 3.77Å; V18-W95 HydrophobicContact CG1-CH2 4.03Å; V18-W95 HydrophobicContact CG1-CZ3 3.96Å; V18-W95 HydrophobicContact CG2-CH2 3.7Å; V18-W95 HydrophobicContact CG2-CZ3 3.82Å
19	K	96.6	Very high	93.9	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138.6	174.8	-175.7	-176.9	178.5	-169.6	0	109.2	E27 I29 F45 E70 D71 A73 Y75	K19-E27 HydrophobicContact CB-CB 4.43Å; K19-E27 PolarHBondContact N-O 3.08Å; K19-E27 PolarHBondContact O-N 2.79Å; K19-I29 HydrophobicContact CB-CD1 4.02Å; K19-I29 HydrophobicContact CB-CG1 4.18Å; K19-F45 HydrophobicContact CD-CE1 4.09Å; K19-F45 HydrophobicContact CD-CZ 4.18Å; K19-E70 PolarHBondContact NZ-O 3.41Å; K19-D71 IonicContact NZ-OD1 3.79Å; K19-D71 PolarHBondContact NZ-OD1 3.29Å; K19-A73 HydrophobicContact CD-CB 4.05Å; K19-A73 VanDerWaalsContact CE-CB 3.48Å; K19-A73 HydrophobicContact CG-CB 3.42Å; K19-A73 VanDerWaalsContact CG-CB 3.42Å; K19-Y75 HydrophobicContact CB-CD1 4.22Å; K19-Y75 HydrophobicContact CB-CE1 4.01Å; K19-Y75 HydrophobicContact CD-CE1 4.1Å; K19-Y75 HydrophobicContact CG-CD1 4.35Å; K19-Y75 HydrophobicContact CG-CE1 3.86Å; K19-Y75 HydrophobicContact CG-CE2 4.49Å
20	Q	96.8	Very high	94	Very high	78 Å²	78	45.5 Å²	45.5	36%	0.364	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.3	169.5	-167.7	179.8	25.5	0	0	110	L26 A73 V74 F76	Q20-L26 HydrophobicContact CB-CD2 3.83Å; Q20-L26 HydrophobicContact CG-CD2 3.93Å; Q20-A73 WeakPolarHBondContact O-CA 3.36Å; Q20-A73 VanDerWaalsContact O-CB 3.27Å; Q20-A73 WeakPolarHBondContact O-CB 3.21Å; Q20-V74 PolarHBondContact N-O 2.84Å; Q20-V74 PolarHBondContact O-N 3.14Å; Q20-F76 HydrophobicContact CB-CD2 4.43Å; Q20-F76 HydrophobicContact CB-CE2 3.76Å
21	R	93.9	Very high	94	Very high	59 Å²	59	45.3 Å²	45.3	22%	0.223	27%	0.267	C	S	.	.			trans	-87.4	145.7	169.2	-73.6	-176.4	-106.8	-167.9	-2.8	109.9	G23 Q24 E27 E70 A73	R21-G23 PolarHBondContact O-N 2.81Å; R21-Q24 HydrophobicContact CB-CB 3.98Å; R21-Q24 HydrophobicContact CB-CG 4.02Å; R21-Q24 PolarHBondContact O-N 2.99Å; R21-E27 IonicContact CZ-OE1 3.27Å; R21-E27 IonicContact NE-OE1 3.12Å; R21-E27 PolarHBondContact NE-OE1 2.88Å; R21-E27 VanDerWaalsContact NE-OE1 3.14Å; R21-E27 IonicContact NH2-OE1 2.87Å; R21-E27 PolarHBondContact NH2-OE1 3.2Å; R21-E27 IonicContact NH2-OE2 2.88Å; R21-E70 PolarHBondContact NH1-O 2.78Å; R21-A73 HydrophobicContact CG-CB 4.05Å
22	T	86.1	Confident	94.1	Very high	149 Å²	149	43.1 Å²	43.1	91%	0.914	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	126.3	175.7	-51.2	0	0	0	0	110	Q24	T22-Q24 PolarHBondContact O-N 2.83Å
23	G	88.8	Confident	94.3	Very high	89 Å²	89	41.8 Å²	41.8	92%	0.918	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.3	4.1	-178.2	0	0	0	0	0	115.4	R21	R21-G23 PolarHBondContact O-N 2.81Å
24	Q	90.6	Very high	94.6	Very high	99 Å²	99	38.3 Å²	38.3	46%	0.463	22%	0.223	S	C	.	.	S	Bend	trans	-116.1	162.1	174.8	-56.5	-174.2	7.6	0	0	111.2	R21 T22	R21-Q24 HydrophobicContact CB-CB 3.98Å; R21-Q24 HydrophobicContact CB-CG 4.02Å; R21-Q24 PolarHBondContact O-N 2.99Å; T22-Q24 PolarHBondContact O-N 2.83Å
25	G	91.2	Very high	94.7	Very high	54 Å²	54	47.8 Å²	47.8	56%	0.557	26%	0.259	S	S	*	.			trans	-69	176.2	174.5	0	0	0	0	0	113.3
26	L	94.2	Very high	94.6	Very high	96 Å²	96	51 Å²	51	50%	0.503	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	128.7	172.2	-64.1	176.2	0	0	0	110.3	V18 Q20 W95	V18-L26 HydrophobicContact CG1-CB 3.78Å; V18-L26 HydrophobicContact CG1-CD2 3.96Å; V18-L26 HydrophobicContact CG1-CG 4.33Å; Q20-L26 HydrophobicContact CB-CD2 3.83Å; Q20-L26 HydrophobicContact CG-CD2 3.93Å; L26-W95 HydrophobicContact CD1-CH2 3.88Å; L26-W95 HydrophobicContact CD1-CZ2 4.48Å; L26-W95 HydrophobicContact CD1-CZ3 4.38Å
27	E	95.5	Very high	94.5	Very high	30 Å²	30	53 Å²	53	14%	0.14	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.5	174.3	-64	-170.3	-101.6	0	0	109.5	V18 K19 R21 I29 K44 F45	V18-E27 CarbonylContact C-O 3.57Å; V18-E27 WeakPolarHBondContact CA-O 3.46Å; K19-E27 HydrophobicContact CB-CB 4.43Å; K19-E27 PolarHBondContact N-O 3.08Å; K19-E27 PolarHBondContact O-N 2.79Å; R21-E27 IonicContact CZ-OE1 3.27Å; R21-E27 IonicContact NE-OE1 3.12Å; R21-E27 PolarHBondContact NE-OE1 2.88Å; R21-E27 VanDerWaalsContact NE-OE1 3.14Å; R21-E27 IonicContact NH2-OE1 2.87Å; R21-E27 PolarHBondContact NH2-OE1 3.2Å; R21-E27 IonicContact NH2-OE2 2.88Å; E27-I29 PolarHBondContact O-N 2.91Å; E27-K44 IonicContact OE2-NZ 3.69Å; E27-F45 HydrophobicContact CB-CE2 4.45Å; E27-F45 HydrophobicContact CB-CZ 4.39Å
28	W	95.6	Very high	94.4	Very high	80 Å²	80	56.8 Å²	56.8	30%	0.303	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	127.8	174.2	-178.7	75.3	0	0	0	110.7	S16 G30 E31 N42 M92	S16-W28 PolarHBondContact OG-NE1 2.92Å; W28-G30 VanDerWaalsContact CE2-C 3.47Å; W28-G30 PolarHBondContact NE1-O 2.96Å; W28-E31 HydrophobicContact CZ2-CB 3.76Å; W28-N42 HydrophobicContact CE3-CB 3.82Å; W28-N42 HydrophobicContact CZ3-CB 4.03Å; W28-N42 WeakPolarHBondContact O-CB 3.23Å; W28-N42 PolarHBondContact O-ND2 3.27Å; W28-M92 VanDerWaalsContact CD1-CE 3.41Å; W28-M92 HydrophobicContact CG-CE 4.33Å
29	I	96.9	Very high	94.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-48.6	-178.4	-60.4	173.4	0	0	0	110.1	W17 K19 E27 N42 F45 A49 M62 Y75	W17-I29 HydrophobicContact CB-CB 4.17Å; W17-I29 HydrophobicContact CB-CD1 4.31Å; W17-I29 WeakPolarHBondContact O-CB 3.45Å; W17-I29 PolarHBondContact O-N 3.01Å; K19-I29 HydrophobicContact CB-CD1 4.02Å; K19-I29 HydrophobicContact CB-CG1 4.18Å; E27-I29 PolarHBondContact O-N 2.91Å; I29-N42 PolarHBondContact O-N 2.88Å; I29-F45 HydrophobicContact CB-CD2 4.29Å; I29-F45 HydrophobicContact CB-CG 4.22Å; I29-F45 HydrophobicContact CG1-CD1 4.15Å; I29-F45 HydrophobicContact CG1-CD2 4.28Å; I29-F45 HydrophobicContact CG1-CE1 4.07Å; I29-F45 HydrophobicContact CG1-CE2 4.18Å; I29-F45 HydrophobicContact CG1-CG 4.25Å; I29-F45 HydrophobicContact CG1-CZ 4.08Å; I29-F45 HydrophobicContact CG2-CB 3.73Å; I29-F45 HydrophobicContact CG2-CD1 4.07Å; I29-F45 HydrophobicContact CG2-CD2 4.33Å; I29-F45 HydrophobicContact CG2-CG 3.79Å; I29-A49 HydrophobicContact CG2-CB 3.8Å; I29-M62 HydrophobicContact CD1-CE 3.69Å; I29-M62 HydrophobicContact CD1-SD 3.71Å; I29-M62 HydrophobicContact CG2-SD 3.86Å; I29-Y75 HydrophobicContact CD1-CD1 3.71Å; I29-Y75 HydrophobicContact CD1-CE1 3.76Å
30	G	95.9	Very high	94.3	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.2	176.7	-172.5	0	0	0	0	0	112.2	S16 W17 W28 Y40	S16-G30 CarbonylContact C-O 3.52Å; S16-G30 WeakPolarHBondContact CA-O 3.35Å; W17-G30 PolarHBondContact N-O 3.48Å; W28-G30 VanDerWaalsContact CE2-C 3.47Å; W28-G30 PolarHBondContact NE1-O 2.96Å; G30-Y40 CarbonylContact C-O 3.58Å; G30-Y40 WeakPolarHBondContact CA-O 3.12Å
31	E	95.2	Very high	94.2	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	145.1	179.2	178.7	-174.1	-140.9	0	0	110	I15 W28 Y33 T39 Y40 S80 Y90	I15-E31 VanDerWaalsContact O-CA 3.31Å; I15-E31 WeakPolarHBondContact O-CA 2.98Å; W28-E31 HydrophobicContact CZ2-CB 3.76Å; E31-Y33 HydrophobicContact CG-CE2 4.38Å; E31-Y33 VanDerWaalsContact OE2-CE2 3.25Å; E31-Y33 WeakPolarHBondContact OE2-CE2 2.97Å; E31-Y33 PolarHBondContact OE2-OH 3.36Å; E31-T39 CarbonylContact O-C 3.44Å; E31-T39 VanDerWaalsContact O-CA 3.28Å; E31-T39 WeakPolarHBondContact O-CA 3.22Å; E31-Y40 PolarHBondContact N-O 3.32Å; E31-Y40 PolarHBondContact O-N 3.32Å; E31-S80 WeakPolarHBondContact OE1-CB 3.37Å; E31-S80 PolarHBondContact OE1-OG 3.22Å; E31-Y90 WeakPolarHBondContact OE2-CE1 3.42Å
32	I	96.3	Very high	94.2	Very high	5 Å²	5	61.8 Å²	61.8	3%	0.026	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.5	167.2	-175.7	165.8	0	0	0	110.8	G14 I15 P34 N38 T39 L51 T52 A53 A60	G14-I32 CarbonylContact C-O 3.57Å; G14-I32 WeakPolarHBondContact CA-O 3.4Å; I15-I32 HydrophobicContact CB-CG2 4.16Å; I15-I32 PolarHBondContact N-O 2.88Å; I15-I32 PolarHBondContact O-N 2.83Å; I32-P34 WeakPolarHBondContact O-CD 3.25Å; I32-N38 WeakPolarHBondContact CA-O 3.46Å; I32-T39 HydrophobicContact CB-CG2 4.04Å; I32-T39 HydrophobicContact CD1-CG2 3.96Å; I32-T39 HydrophobicContact CG1-CG2 3.87Å; I32-L51 HydrophobicContact CB-CB 4.11Å; I32-L51 HydrophobicContact CG2-CB 4.46Å; I32-T52 VanDerWaalsContact CD1-CA 3.49Å; I32-A53 HydrophobicContact CD1-CB 3.83Å; I32-A53 HydrophobicContact CG1-CB 4.47Å; I32-A60 HydrophobicContact CG2-CB 4.3Å
33	Y	95.6	Very high	94.6	Very high	51 Å²	51	61 Å²	61	20%	0.2	33%	0.334	C	S	.	.			trans	-95.6	104.8	169.1	-74.8	-82.5	0	0	0	110.1	E31 R35 S36 G37 N38 Y40 Y90	E31-Y33 HydrophobicContact CG-CE2 4.38Å; E31-Y33 VanDerWaalsContact OE2-CE2 3.25Å; E31-Y33 WeakPolarHBondContact OE2-CE2 2.97Å; E31-Y33 PolarHBondContact OE2-OH 3.36Å; Y33-R35 PolarHBondContact O-N 3.45Å; Y33-R35 VanDerWaalsContact O-N 3.14Å; Y33-S36 WeakPolarHBondContact CB-OG 3.19Å; Y33-S36 PolarHBondContact O-N 3.42Å; Y33-G37 WeakPolarHBondContact O-CA 3.41Å; Y33-G37 PolarHBondContact O-N 3.04Å; Y33-N38 HydrophobicContact CD2-CB 4.49Å; Y33-N38 PolarHBondContact N-O 2.89Å; Y33-Y40 HydrophobicContact CD2-CD2 4.06Å; Y33-Y40 AromaticContact CD2-CE2 3.72Å; Y33-Y40 HydrophobicContact CD2-CE2 3.72Å; Y33-Y40 AromaticContact CE2-CD2 3.8Å; Y33-Y40 HydrophobicContact CE2-CD2 3.8Å; Y33-Y40 AromaticContact CE2-CE2 3.51Å; Y33-Y40 HydrophobicContact CE2-CE2 3.51Å; Y33-Y90 VanDerWaalsContact OH-CE1 3.26Å; Y33-Y90 WeakPolarHBondContact OH-CE1 3.46Å
34	P	96.1	Very high	94.8	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.013	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.6	-174	-22.9	35.5	0	0	0	113.9	F10 T11 Y13 I15 I32 A53 K55	F10-P34 HydrophobicContact CD1-CB 3.82Å; F10-P34 HydrophobicContact CD1-CG 4.1Å; F10-P34 HydrophobicContact CD2-CG 4.26Å; F10-P34 HydrophobicContact CE1-CB 3.46Å; F10-P34 VanDerWaalsContact CE1-CB 3.46Å; F10-P34 HydrophobicContact CE1-CG 3.64Å; F10-P34 HydrophobicContact CE2-CG 3.84Å; F10-P34 HydrophobicContact CG-CG 4.4Å; F10-P34 HydrophobicContact CZ-CB 3.87Å; F10-P34 HydrophobicContact CZ-CG 3.49Å; F10-P34 VanDerWaalsContact CZ-CG 3.49Å; T11-P34 HydrophobicContact CG2-CB 4.49Å; Y13-P34 WeakPolarHBondContact O-CD 3.42Å; I15-P34 HydrophobicContact CG1-CG 4.12Å; I32-P34 WeakPolarHBondContact O-CD 3.25Å; P34-A53 HydrophobicContact CB-CB 4Å; P34-A53 HydrophobicContact CG-CB 4.26Å; P34-K55 WeakPolarHBondContact O-CE 3.16Å; P34-K55 PolarHBondContact O-NZ 3.48Å
35	R	94.9	Very high	95	Very high	201 Å²	201	59.6 Å²	59.6	76%	0.758	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-54.5	176.2	-177.9	172.9	-175.6	-173.9	1	112.1	T11 Y33 K55	T11-R35 VanDerWaalsContact O-CB 3.26Å; T11-R35 WeakPolarHBondContact O-CB 3.35Å; Y33-R35 PolarHBondContact O-N 3.45Å; Y33-R35 VanDerWaalsContact O-N 3.14Å; R35-K55 PolarHBondContact O-NZ 2.86Å
36	S	94.9	Very high	95	Very high	69 Å²	69	63 Å²	63	48%	0.483	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-23	-175.2	54.5	0	0	0	0	113.8	Y33 N38	Y33-S36 WeakPolarHBondContact CB-OG 3.19Å; Y33-S36 PolarHBondContact O-N 3.42Å; S36-N38 WeakPolarHBondContact OG-CB 3.48Å; S36-N38 PolarHBondContact OG-N 2.95Å
37	G	95	Very high	94.9	Very high	42 Å²	42	61.9 Å²	61.9	43%	0.433	31%	0.313	S	S	.	.			trans	78.4	3.4	-168.7	0	0	0	0	0	113.6	Y33 T39	Y33-G37 WeakPolarHBondContact O-CA 3.41Å; Y33-G37 PolarHBondContact O-N 3.04Å; G37-T39 PolarHBondContact O-N 3.02Å
38	N	95.1	Very high	94.9	Very high	83 Å²	83	63.7 Å²	63.7	44%	0.444	32%	0.32	S	S	.	.			trans	-64.8	137.3	178.8	-69	-4.3	0	0	0	110.2	I32 Y33 S36 Y40	I32-N38 WeakPolarHBondContact CA-O 3.46Å; Y33-N38 HydrophobicContact CD2-CB 4.49Å; Y33-N38 PolarHBondContact N-O 2.89Å; S36-N38 WeakPolarHBondContact OG-CB 3.48Å; S36-N38 PolarHBondContact OG-N 2.95Å; N38-Y40 HydrophobicContact CB-CE2 4.2Å
39	T	96.2	Very high	95	Very high	52 Å²	52	60 Å²	60	32%	0.319	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.5	176.7	52.2	0	0	0	0	110.5	E31 I32 G37 Y41 L51	E31-T39 CarbonylContact O-C 3.44Å; E31-T39 VanDerWaalsContact O-CA 3.28Å; E31-T39 WeakPolarHBondContact O-CA 3.22Å; I32-T39 HydrophobicContact CB-CG2 4.04Å; I32-T39 HydrophobicContact CD1-CG2 3.96Å; I32-T39 HydrophobicContact CG1-CG2 3.87Å; G37-T39 PolarHBondContact O-N 3.02Å; T39-Y41 WeakPolarHBondContact OG1-CE2 3.39Å; T39-L51 HydrophobicContact CG2-CB 3.96Å
40	Y	94.6	Very high	95	Very high	87 Å²	87	62.7 Å²	62.7	34%	0.341	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.2	173.7	-61.5	-83.5	0	0	0	108	G30 E31 Y33 N38	G30-Y40 CarbonylContact C-O 3.58Å; G30-Y40 WeakPolarHBondContact CA-O 3.12Å; E31-Y40 PolarHBondContact N-O 3.32Å; E31-Y40 PolarHBondContact O-N 3.32Å; Y33-Y40 HydrophobicContact CD2-CD2 4.06Å; Y33-Y40 AromaticContact CD2-CE2 3.72Å; Y33-Y40 HydrophobicContact CD2-CE2 3.72Å; Y33-Y40 AromaticContact CE2-CD2 3.8Å; Y33-Y40 HydrophobicContact CE2-CD2 3.8Å; Y33-Y40 AromaticContact CE2-CE2 3.51Å; Y33-Y40 HydrophobicContact CE2-CE2 3.51Å; N38-Y40 HydrophobicContact CB-CE2 4.2Å
41	Y	95.6	Very high	95.2	Very high	62 Å²	62	63 Å²	63	24%	0.243	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148	-176.8	-64.5	-89.2	0	0	0	110	T39 A49 L51	T39-Y41 WeakPolarHBondContact OG1-CE2 3.39Å; Y41-A49 HydrophobicContact CE1-CB 4.38Å; Y41-A49 VanDerWaalsContact CE1-O 3.26Å; Y41-A49 WeakPolarHBondContact CE1-O 3.26Å; Y41-L51 HydrophobicContact CE1-CD1 4.07Å; Y41-L51 HydrophobicContact CE1-CG 3.71Å; Y41-L51 PolarHBondContact OH-N 2.8Å; Y41-L51 VanDerWaalsContact OH-N 3.09Å
42	N	95	Very high	95.3	Very high	46 Å²	46	66.4 Å²	66.4	25%	0.246	35%	0.346	C	S	.	.			trans	-72.2	133.8	155.3	-179.4	-26.1	0	0	0	108.3	W28 I29 K44 F45 K46	W28-N42 HydrophobicContact CE3-CB 3.82Å; W28-N42 HydrophobicContact CZ3-CB 4.03Å; W28-N42 WeakPolarHBondContact O-CB 3.23Å; W28-N42 PolarHBondContact O-ND2 3.27Å; I29-N42 PolarHBondContact O-N 2.88Å; N42-K44 PolarHBondContact O-N 3.11Å; N42-K44 PolarHBondContact OD1-N 2.98Å; N42-K44 VanDerWaalsContact OD1-N 3.11Å; N42-F45 HydrophobicContact CB-CD2 4.01Å; N42-F45 PolarHBondContact O-N 2.91Å; N42-K46 PolarHBondContact O-N 2.67Å
43	E	94.4	Very high	95.4	Very high	131 Å²	131	67.8 Å²	67.8	61%	0.612	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-55.5	-29.9	-176.8	-69.2	-62.5	144.1	0	0	112.7	F45 K46	E43-F45 PolarHBondContact O-N 3.22Å; E43-K46 PolarHBondContact O-N 3.13Å; E43-K46 IonicContact OE1-NZ 3.74Å; E43-K46 PolarHBondContact OE1-NZ 2.73Å; E43-K46 WeakPolarHBondContact OE2-CD 2.97Å; E43-K46 IonicContact OE2-NZ 2.74Å; E43-K46 PolarHBondContact OE2-NZ 3.28Å; E43-K46 VanDerWaalsContact OE2-NZ 3.12Å
44	K	92.3	Very high	95.5	Very high	150 Å²	150	68 Å²	68	65%	0.652	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-61.2	-27	175.1	-69.6	-177.1	177.3	-179.5	0	114.3	E27 N42	E27-K44 IonicContact OE2-NZ 3.69Å; N42-K44 PolarHBondContact O-N 3.11Å; N42-K44 PolarHBondContact OD1-N 2.98Å; N42-K44 VanDerWaalsContact OD1-N 3.11Å
45	F	94.2	Very high	95.6	Very high	9 Å²	9	73.4 Å²	73.4	4%	0.039	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-110.5	-3.9	-174.3	-63.5	-83.7	0	0	0	113	K19 E27 I29 N42 E43 G47 K48 A49	K19-F45 HydrophobicContact CD-CE1 4.09Å; K19-F45 HydrophobicContact CD-CZ 4.18Å; E27-F45 HydrophobicContact CB-CE2 4.45Å; E27-F45 HydrophobicContact CB-CZ 4.39Å; I29-F45 HydrophobicContact CB-CD2 4.29Å; I29-F45 HydrophobicContact CB-CG 4.22Å; I29-F45 HydrophobicContact CG1-CD1 4.15Å; I29-F45 HydrophobicContact CG1-CD2 4.28Å; I29-F45 HydrophobicContact CG1-CE1 4.07Å; I29-F45 HydrophobicContact CG1-CE2 4.18Å; I29-F45 HydrophobicContact CG1-CG 4.25Å; I29-F45 HydrophobicContact CG1-CZ 4.08Å; I29-F45 HydrophobicContact CG2-CB 3.73Å; I29-F45 HydrophobicContact CG2-CD1 4.07Å; I29-F45 HydrophobicContact CG2-CD2 4.33Å; I29-F45 HydrophobicContact CG2-CG 3.79Å; N42-F45 HydrophobicContact CB-CD2 4.01Å; N42-F45 PolarHBondContact O-N 2.91Å; E43-F45 PolarHBondContact O-N 3.22Å; F45-G47 PolarHBondContact O-N 3.07Å; F45-K48 PolarHBondContact O-N 3.35Å; F45-A49 HydrophobicContact CB-CB 4.47Å; F45-A49 PolarHBondContact O-N 2.82Å
46	K	92.4	Very high	95.6	Very high	125 Å²	125	69 Å²	69	54%	0.543	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-61.4	126.6	175	-162.4	175.3	-171.8	173.7	0	109.3	N42 E43 K48	N42-K46 PolarHBondContact O-N 2.67Å; E43-K46 PolarHBondContact O-N 3.13Å; E43-K46 IonicContact OE1-NZ 3.74Å; E43-K46 PolarHBondContact OE1-NZ 2.73Å; E43-K46 WeakPolarHBondContact OE2-CD 2.97Å; E43-K46 IonicContact OE2-NZ 2.74Å; E43-K46 PolarHBondContact OE2-NZ 3.28Å; E43-K46 VanDerWaalsContact OE2-NZ 3.12Å; K46-K48 PolarHBondContact O-N 2.81Å
47	G	91.7	Very high	95.8	Very high	74 Å²	74	67.5 Å²	67.5	76%	0.763	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-18	-174.5	0	0	0	0	0	115.2	F45	F45-G47 PolarHBondContact O-N 3.07Å
48	K	94.9	Very high	95.9	Very high	68 Å²	68	67.3 Å²	67.3	30%	0.296	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-39	169.7	-78.4	-166.4	169	-162.6	0	112.5	F45 K46 L64 R65 D71	F45-K48 PolarHBondContact O-N 3.35Å; K46-K48 PolarHBondContact O-N 2.81Å; K48-L64 WeakPolarHBondContact O-CA 3.38Å; K48-R65 PolarHBondContact O-N 2.9Å; K48-D71 IonicContact NZ-OD1 3.24Å; K48-D71 IonicContact NZ-OD2 3Å; K48-D71 PolarHBondContact NZ-OD2 2.97Å
49	A	97.4	Very high	96	Very high	3 Å²	3	63.8 Å²	63.8	3%	0.025	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.3	-178.1	0	0	0	0	0	111.5	I29 Y41 F45 M62 E63 L64	I29-A49 HydrophobicContact CG2-CB 3.8Å; Y41-A49 HydrophobicContact CE1-CB 4.38Å; Y41-A49 VanDerWaalsContact CE1-O 3.26Å; Y41-A49 WeakPolarHBondContact CE1-O 3.26Å; F45-A49 HydrophobicContact CB-CB 4.47Å; F45-A49 PolarHBondContact O-N 2.82Å; A49-M62 HydrophobicContact CB-CG 4.4Å; A49-M62 HydrophobicContact CB-SD 4.33Å; A49-E63 CarbonylContact C-O 3.59Å; A49-E63 WeakPolarHBondContact CA-O 3.39Å; A49-L64 HydrophobicContact CB-CD2 3.92Å
50	T	98.3	Very high	96.1	Very high	55 Å²	55	61.3 Å²	61.3	34%	0.337	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.6	168.2	-58.5	0	0	0	0	108.6	T52 M62 E63	T50-T52 HydrophobicContact CG2-CG2 4.3Å; T50-M62 WeakPolarHBondContact O-CA 3Å; T50-E63 PolarHBondContact N-O 2.02Å; T50-E63 PolarHBondContact O-N 3.41Å
51	L	98.4	Very high	96.3	Very high	8 Å²	8	61.1 Å²	61.1	4%	0.042	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.2	179.2	-50.8	-176.6	0	0	0	110.8	W17 I32 T39 Y41 Y61 M62	W17-L51 HydrophobicContact CG-CD2 4.08Å; I32-L51 HydrophobicContact CB-CB 4.11Å; I32-L51 HydrophobicContact CG2-CB 4.46Å; T39-L51 HydrophobicContact CG2-CB 3.96Å; Y41-L51 HydrophobicContact CE1-CD1 4.07Å; Y41-L51 HydrophobicContact CE1-CG 3.71Å; Y41-L51 PolarHBondContact OH-N 2.8Å; Y41-L51 VanDerWaalsContact OH-N 3.09Å; L51-Y61 WeakPolarHBondContact CA-O 3.31Å; L51-M62 HydrophobicContact CD2-CB 3.74Å; L51-M62 HydrophobicContact CD2-CG 3.63Å; L51-M62 HydrophobicContact CD2-SD 3.92Å
52	T	98.5	Very high	96.5	Very high	72 Å²	72	58.2 Å²	58.2	44%	0.442	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	165.2	175.6	65.5	0	0	0	0	111	I32 T50 A60 Y61	I32-T52 VanDerWaalsContact CD1-CA 3.49Å; T50-T52 HydrophobicContact CG2-CG2 4.3Å; T52-A60 CarbonylContact O-C 3.6Å; T52-A60 WeakPolarHBondContact O-CA 3.41Å; T52-Y61 PolarHBondContact N-O 2.95Å; T52-Y61 PolarHBondContact O-N 2.8Å
53	A	98.2	Very high	96.6	Very high	34 Å²	34	60.5 Å²	60.5	28%	0.281	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	136.6	177.3	0	0	0	0	0	111	F10 I32 P34 T59	F10-A53 HydrophobicContact CE1-CB 4.16Å; F10-A53 HydrophobicContact CZ-CB 4.11Å; I32-A53 HydrophobicContact CD1-CB 3.83Å; I32-A53 HydrophobicContact CG1-CB 4.47Å; P34-A53 HydrophobicContact CB-CB 4Å; P34-A53 HydrophobicContact CG-CB 4.26Å; A53-T59 WeakPolarHBondContact CA-O 3.41Å
54	D	98.1	Very high	96.7	Very high	54 Å²	54	55.7 Å²	55.7	29%	0.289	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113.9	168.8	173.6	15.8	0	0	0	109.2	S56 S57 S58 T59 Y61	D54-S56 VanDerWaalsContact C-N 3.31Å; D54-S56 VanDerWaalsContact CG-OG 3.27Å; D54-S56 WeakPolarHBondContact OD1-CB 3.25Å; D54-S56 PolarHBondContact OD1-N 2.86Å; D54-S56 PolarHBondContact OD1-OG 2.88Å; D54-S56 PolarHBondContact OD2-OG 3.27Å; D54-S56 VanDerWaalsContact OD2-OG 3.1Å; D54-S57 VanDerWaalsContact CG-OG 3.26Å; D54-S57 VanDerWaalsContact OD2-CB 3.22Å; D54-S57 WeakPolarHBondContact OD2-CB 3.15Å; D54-S57 PolarHBondContact OD2-N 3.48Å; D54-S57 PolarHBondContact OD2-OG 2.78Å; D54-S58 WeakPolarHBondContact O-CA 3.19Å; D54-S58 PolarHBondContact O-N 2.8Å; D54-S58 VanDerWaalsContact O-N 3.11Å; D54-T59 PolarHBondContact N-O 2.82Å; D54-T59 PolarHBondContact O-N 2.47Å; D54-Y61 HydrophobicContact CB-CE2 3.96Å
55	K	96.6	Very high	96.8	Very high	117 Å²	117	54.8 Å²	54.8	51%	0.509	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.4	-178.6	-51.1	-175.4	-156.2	-167.2	0	111.6	T11 P34 R35 S58	T11-K55 HydrophobicContact CG2-CB 4.46Å; T11-K55 HydrophobicContact CG2-CD 4.25Å; T11-K55 HydrophobicContact CG2-CG 4.33Å; P34-K55 WeakPolarHBondContact O-CE 3.16Å; P34-K55 PolarHBondContact O-NZ 3.48Å; R35-K55 PolarHBondContact O-NZ 2.86Å; K55-S58 PolarHBondContact O-N 2.9Å
56	S	96.4	Very high	96.7	Very high	107 Å²	107	59.6 Å²	59.6	75%	0.748	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-43	-176.3	71.7	0	0	0	0	111.5	D54	D54-S56 VanDerWaalsContact C-N 3.31Å; D54-S56 VanDerWaalsContact CG-OG 3.27Å; D54-S56 WeakPolarHBondContact OD1-CB 3.25Å; D54-S56 PolarHBondContact OD1-N 2.86Å; D54-S56 PolarHBondContact OD1-OG 2.88Å; D54-S56 PolarHBondContact OD2-OG 3.27Å; D54-S56 VanDerWaalsContact OD2-OG 3.1Å
57	S	97.6	Very high	96.7	Very high	39 Å²	39	56.4 Å²	56.4	27%	0.273	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.3	176.1	66.6	0	0	0	0	114	D54 T59	D54-S57 VanDerWaalsContact CG-OG 3.26Å; D54-S57 VanDerWaalsContact OD2-CB 3.22Å; D54-S57 WeakPolarHBondContact OD2-CB 3.15Å; D54-S57 PolarHBondContact OD2-N 3.48Å; D54-S57 PolarHBondContact OD2-OG 2.78Å; S57-T59 VanDerWaalsContact C-N 3.28Å; S57-T59 PolarHBondContact O-N 2.92Å; S57-T59 PolarHBondContact O-OG1 3.45Å; S57-T59 WeakPolarHBondContact OG-CB 3.4Å; S57-T59 PolarHBondContact OG-OG1 3.26Å
58	S	97.6	Very high	96.8	Very high	38 Å²	38	55.9 Å²	55.9	27%	0.266	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	42.8	-172.2	-63.5	0	0	0	0	112.9	A5 D54 K55	A5-S58 PolarHBondContact N-O 3.46Å; D54-S58 WeakPolarHBondContact O-CA 3.19Å; D54-S58 PolarHBondContact O-N 2.8Å; D54-S58 VanDerWaalsContact O-N 3.11Å; K55-S58 PolarHBondContact O-N 2.9Å
59	T	98.4	Very high	96.6	Very high	9 Å²	9	56.2 Å²	56.2	6%	0.055	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.4	-174.6	-50.3	0	0	0	0	110.7	C3 K4 A53 D54 S57 Y61	C3-T59 CarbonylContact O-C 3.59Å; C3-T59 WeakPolarHBondContact O-CA 3.31Å; K4-T59 HydrophobicContact CB-CG2 4.49Å; A53-T59 WeakPolarHBondContact CA-O 3.41Å; D54-T59 PolarHBondContact N-O 2.82Å; D54-T59 PolarHBondContact O-N 2.47Å; S57-T59 VanDerWaalsContact C-N 3.28Å; S57-T59 PolarHBondContact O-N 2.92Å; S57-T59 PolarHBondContact O-OG1 3.45Å; S57-T59 WeakPolarHBondContact OG-CB 3.4Å; S57-T59 PolarHBondContact OG-OG1 3.26Å; T59-Y61 HydrophobicContact CG2-CD1 4.31Å; T59-Y61 HydrophobicContact CG2-CD2 4.38Å; T59-Y61 HydrophobicContact CG2-CE1 3.69Å; T59-Y61 HydrophobicContact CG2-CE2 3.75Å; T59-Y61 WeakPolarHBondContact CG2-OH 3.42Å; T59-Y61 WeakPolarHBondContact O-CE2 3.4Å
60	A	98.3	Very high	96.3	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	149.5	166.9	0	0	0	0	0	110	S2 C3 F10 I15 W17 I32 T52	S2-A60 CarbonylContact C-O 3.58Å; S2-A60 WeakPolarHBondContact CA-O 3.49Å; C3-A60 PolarHBondContact N-O 3.32Å; C3-A60 PolarHBondContact O-N 2.94Å; F10-A60 HydrophobicContact CE2-CB 4.31Å; F10-A60 HydrophobicContact CZ-CB 4.07Å; I15-A60 HydrophobicContact CB-CB 4Å; I15-A60 HydrophobicContact CG1-CB 4.05Å; I15-A60 HydrophobicContact CG2-CB 3.78Å; W17-A60 HydrophobicContact CZ2-CB 4.28Å; I32-A60 HydrophobicContact CG2-CB 4.3Å; T52-A60 CarbonylContact O-C 3.6Å; T52-A60 WeakPolarHBondContact O-CA 3.41Å
61	Y	98.6	Very high	96	Very high	82 Å²	82	60.3 Å²	60.3	32%	0.322	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.3	179.5	-55.4	-91.8	0	0	0	110.7	L1 L51 T52 D54 T59	L1-Y61 VanDerWaalsContact O-CA 3.31Å; L1-Y61 WeakPolarHBondContact O-CA 3.27Å; L51-Y61 WeakPolarHBondContact CA-O 3.31Å; T52-Y61 PolarHBondContact N-O 2.95Å; T52-Y61 PolarHBondContact O-N 2.8Å; D54-Y61 HydrophobicContact CB-CE2 3.96Å; T59-Y61 HydrophobicContact CG2-CD1 4.31Å; T59-Y61 HydrophobicContact CG2-CD2 4.38Å; T59-Y61 HydrophobicContact CG2-CE1 3.69Å; T59-Y61 HydrophobicContact CG2-CE2 3.75Å; T59-Y61 WeakPolarHBondContact CG2-OH 3.42Å; T59-Y61 WeakPolarHBondContact O-CE2 3.4Å
62	M	98.4	Very high	95.9	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.8	167.3	176.9	169.8	70	0	0	108.7	L1 W17 I29 A49 T50 L51 L64 Y75	L1-M62 HydrophobicContact CD1-CE 3.65Å; L1-M62 PolarHBondContact N-O 3.25Å; L1-M62 PolarHBondContact O-N 3.3Å; W17-M62 HydrophobicContact CB-CE 4.26Å; W17-M62 HydrophobicContact CB-SD 3.76Å; W17-M62 HydrophobicContact CD2-CB 3.66Å; W17-M62 HydrophobicContact CD2-CE 4.05Å; W17-M62 HydrophobicContact CD2-CG 4.45Å; W17-M62 HydrophobicContact CD2-SD 4.01Å; W17-M62 HydrophobicContact CE3-CB 3.91Å; W17-M62 HydrophobicContact CE3-CE 3.57Å; W17-M62 HydrophobicContact CE3-SD 4.16Å; W17-M62 HydrophobicContact CG-CB 4.19Å; W17-M62 HydrophobicContact CG-CE 4.37Å; W17-M62 HydrophobicContact CG-SD 3.86Å; W17-M62 HydrophobicContact CH2-CB 4.08Å; W17-M62 HydrophobicContact CZ2-CB 3.85Å; W17-M62 HydrophobicContact CZ3-CB 4.11Å; W17-M62 HydrophobicContact CZ3-CE 4.22Å; I29-M62 HydrophobicContact CD1-CE 3.69Å; I29-M62 HydrophobicContact CD1-SD 3.71Å; I29-M62 HydrophobicContact CG2-SD 3.86Å; A49-M62 HydrophobicContact CB-CG 4.4Å; A49-M62 HydrophobicContact CB-SD 4.33Å; T50-M62 WeakPolarHBondContact O-CA 3Å; L51-M62 HydrophobicContact CD2-CB 3.74Å; L51-M62 HydrophobicContact CD2-CG 3.63Å; L51-M62 HydrophobicContact CD2-SD 3.92Å; M62-L64 HydrophobicContact CE-CD1 4.21Å; M62-L64 HydrophobicContact CE-CD2 4.27Å; M62-L64 HydrophobicContact CE-CG 4.29Å; M62-L64 HydrophobicContact CG-CD2 4.17Å; M62-L64 HydrophobicContact CG-CG 4.28Å; M62-L64 HydrophobicContact SD-CD2 4.06Å; M62-Y75 HydrophobicContact CE-CD1 3.61Å; M62-Y75 HydrophobicContact CE-CE1 4.19Å; M62-Y75 HydrophobicContact CE-CG 4.41Å
63	E	98.3	Very high	95.8	Very high	93 Å²	93	58.7 Å²	58.7	44%	0.435	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.8	167.4	-165.9	-171.5	159.1	0	0	108.5	A49 T50 R65	A49-E63 CarbonylContact C-O 3.59Å; A49-E63 WeakPolarHBondContact CA-O 3.39Å; T50-E63 PolarHBondContact N-O 2.02Å; T50-E63 PolarHBondContact O-N 3.41Å; E63-R65 VanDerWaalsContact CD-NH2 3.32Å; E63-R65 IonicContact OE1-CZ 3.73Å; E63-R65 VanDerWaalsContact OE1-CZ 3.24Å; E63-R65 IonicContact OE1-NE 3.02Å; E63-R65 PolarHBondContact OE1-NE 3.24Å; E63-R65 IonicContact OE1-NH2 2.79Å; E63-R65 PolarHBondContact OE1-NH2 3.41Å; E63-R65 IonicContact OE2-CZ 3.78Å; E63-R65 IonicContact OE2-NE 3.14Å; E63-R65 IonicContact OE2-NH2 3.38Å; E63-R65 PolarHBondContact OE2-NH2 3.02Å
64	L	96.4	Very high	95.8	Very high	31 Å²	31	59.2 Å²	59.2	16%	0.162	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.6	174.6	-66.8	171.6	0	0	0	108.8	L1 K48 A49 M62 L67 Y75	L1-L64 HydrophobicContact CD1-CD1 3.76Å; L1-L64 HydrophobicContact CD1-CG 4.3Å; K48-L64 WeakPolarHBondContact O-CA 3.38Å; A49-L64 HydrophobicContact CB-CD2 3.92Å; M62-L64 HydrophobicContact CE-CD1 4.21Å; M62-L64 HydrophobicContact CE-CD2 4.27Å; M62-L64 HydrophobicContact CE-CG 4.29Å; M62-L64 HydrophobicContact CG-CD2 4.17Å; M62-L64 HydrophobicContact CG-CG 4.28Å; M62-L64 HydrophobicContact SD-CD2 4.06Å; L64-L67 HydrophobicContact CB-CD1 4.1Å; L64-L67 HydrophobicContact CB-CD2 3.75Å; L64-L67 HydrophobicContact CB-CG 4.14Å; L64-L67 HydrophobicContact CD1-CD2 4.26Å; L64-L67 HydrophobicContact CG-CD2 4.48Å; L64-Y75 HydrophobicContact CD1-CD1 4.18Å; L64-Y75 HydrophobicContact CD1-CE1 3.58Å; L64-Y75 HydrophobicContact CD1-CE2 4.32Å
65	R	94.9	Very high	95.8	Very high	131 Å²	131	56.9 Å²	56.9	49%	0.494	31%	0.312	S	S	.	.			trans	-123.4	156	-178.3	-62.7	-175.9	179.1	179.6	4.3	111.1	K48 E63 L67	K48-R65 PolarHBondContact O-N 2.9Å; E63-R65 VanDerWaalsContact CD-NH2 3.32Å; E63-R65 IonicContact OE1-CZ 3.73Å; E63-R65 VanDerWaalsContact OE1-CZ 3.24Å; E63-R65 IonicContact OE1-NE 3.02Å; E63-R65 PolarHBondContact OE1-NE 3.24Å; E63-R65 IonicContact OE1-NH2 2.79Å; E63-R65 PolarHBondContact OE1-NH2 3.41Å; E63-R65 IonicContact OE2-CZ 3.78Å; E63-R65 IonicContact OE2-NE 3.14Å; E63-R65 IonicContact OE2-NH2 3.38Å; E63-R65 PolarHBondContact OE2-NH2 3.02Å; R65-L67 VanDerWaalsContact C-N 3.27Å; R65-L67 PolarHBondContact O-N 3.32Å
66	S	91.5	Very high	95.9	Very high	110 Å²	110	52.7 Å²	52.7	77%	0.769	29%	0.294	S	S	*	.	S	Bend	trans	52.3	45.6	176.3	-52.6	0	0	0	0	112.9
67	L	92.1	Very high	95.9	Very high	58 Å²	58	48.4 Å²	48.4	30%	0.304	26%	0.264	S	S	.	.			trans	-70.2	141.4	-177.9	-67.5	-177	0	0	0	111.4	L64 R65 D71 V101 V103	L64-L67 HydrophobicContact CB-CD1 4.1Å; L64-L67 HydrophobicContact CB-CD2 3.75Å; L64-L67 HydrophobicContact CB-CG 4.14Å; L64-L67 HydrophobicContact CD1-CD2 4.26Å; L64-L67 HydrophobicContact CG-CD2 4.48Å; R65-L67 VanDerWaalsContact C-N 3.27Å; R65-L67 PolarHBondContact O-N 3.32Å; L67-D71 HydrophobicContact CB-CB 4.4Å; L67-D71 HydrophobicContact CD2-CB 3.69Å; L67-V101 HydrophobicContact CD1-CG1 4.46Å; L67-V103 HydrophobicContact CB-CG1 4.18Å; L67-V103 HydrophobicContact CB-CG2 3.94Å; L67-V103 HydrophobicContact CD1-CG2 3.97Å
68	T	92.8	Very high	95.8	Very high	63 Å²	63	46.6 Å²	46.6	39%	0.387	25%	0.252	S	S	.	.			trans	-115	173.8	170.9	67.8	0	0	0	0	110.6	E70 D71 V103	T68-E70 PolarHBondContact O-N 3.12Å; T68-D71 PolarHBondContact N-OD2 2.9Å; T68-D71 WeakPolarHBondContact O-CA 3.44Å; T68-D71 WeakPolarHBondContact O-CB 3.31Å; T68-D71 PolarHBondContact O-N 2.74Å; T68-V103 WeakPolarHBondContact O-CB 3.22Å; T68-V103 WeakPolarHBondContact O-CG1 3.4Å
69	S	92.6	Very high	95.6	Very high	75 Å²	75	46.5 Å²	46.5	52%	0.524	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-57	-30.2	176.2	53	0	0	0	0	113.3	D71 S72 V103	S69-D71 PolarHBondContact O-N 3.3Å; S69-S72 VanDerWaalsContact O-CB 3.3Å; S69-S72 WeakPolarHBondContact O-CB 3.33Å; S69-S72 PolarHBondContact O-N 2.87Å; S69-S72 VanDerWaalsContact O-N 3.08Å; S69-S72 PolarHBondContact O-OG 2.93Å; S69-V103 WeakPolarHBondContact CA-O 2.99Å
70	E	89.8	Confident	95	Very high	134 Å²	134	46 Å²	46	63%	0.626	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-66.9	-14.4	174.4	-58.4	-175.8	173	0	0	113.8	K19 R21 T68 S72	K19-E70 PolarHBondContact NZ-O 3.41Å; R21-E70 PolarHBondContact NH1-O 2.78Å; T68-E70 PolarHBondContact O-N 3.12Å; E70-S72 VanDerWaalsContact C-N 3.32Å
71	D	92.9	Very high	93.7	Very high	9 Å²	9	46.3 Å²	46.3	5%	0.048	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-84.2	-6.1	173.7	-68.2	-47.6	0	0	0	113.7	K19 K48 L67 T68 S69 A73 Y75	K19-D71 IonicContact NZ-OD1 3.79Å; K19-D71 PolarHBondContact NZ-OD1 3.29Å; K48-D71 IonicContact NZ-OD1 3.24Å; K48-D71 IonicContact NZ-OD2 3Å; K48-D71 PolarHBondContact NZ-OD2 2.97Å; L67-D71 HydrophobicContact CB-CB 4.4Å; L67-D71 HydrophobicContact CD2-CB 3.69Å; T68-D71 PolarHBondContact N-OD2 2.9Å; T68-D71 WeakPolarHBondContact O-CA 3.44Å; T68-D71 WeakPolarHBondContact O-CB 3.31Å; T68-D71 PolarHBondContact O-N 2.74Å; S69-D71 PolarHBondContact O-N 3.3Å; D71-A73 PolarHBondContact O-N 2.84Å; D71-Y75 PolarHBondContact O-OH 3.09Å
72	S	95.2	Very high	91.8	Very high	38 Å²	38	51.1 Å²	51.1	27%	0.266	26%	0.264	S	S	.	.			trans	-62	119.3	172.6	-56.6	0	0	0	0	111.4	S69 E70 V101 V103	S69-S72 VanDerWaalsContact O-CB 3.3Å; S69-S72 WeakPolarHBondContact O-CB 3.33Å; S69-S72 PolarHBondContact O-N 2.87Å; S69-S72 VanDerWaalsContact O-N 3.08Å; S69-S72 PolarHBondContact O-OG 2.93Å; E70-S72 VanDerWaalsContact C-N 3.32Å; S72-V101 CarbonylContact C-O 3.57Å; S72-V101 VanDerWaalsContact CA-O 3.25Å; S72-V101 WeakPolarHBondContact CA-O 3.46Å; S72-V103 PolarHBondContact OG-N 2.87Å; S72-V103 PolarHBondContact OG-O 2.89Å
73	A	97.1	Very high	89.5	Confident	8 Å²	8	57.9 Å²	57.9	7%	0.066	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	170.3	-171.9	0	0	0	0	0	111.7	K19 Q20 R21 D71 Y75 V101	K19-A73 HydrophobicContact CD-CB 4.05Å; K19-A73 VanDerWaalsContact CE-CB 3.48Å; K19-A73 HydrophobicContact CG-CB 3.42Å; K19-A73 VanDerWaalsContact CG-CB 3.42Å; Q20-A73 WeakPolarHBondContact O-CA 3.36Å; Q20-A73 VanDerWaalsContact O-CB 3.27Å; Q20-A73 WeakPolarHBondContact O-CB 3.21Å; R21-A73 HydrophobicContact CG-CB 4.05Å; D71-A73 PolarHBondContact O-N 2.84Å; A73-Y75 HydrophobicContact CB-CD2 4.29Å; A73-Y75 HydrophobicContact CB-CE2 3.82Å; A73-V101 PolarHBondContact N-O 3.1Å; A73-V101 PolarHBondContact O-N 2.61Å
74	V	98.1	Very high	87.1	Confident	46 Å²	46	56 Å²	56	28%	0.279	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.4	161.6	-171.7	0	0	0	0	108.7	Q20 F76 T99	Q20-V74 PolarHBondContact N-O 2.84Å; Q20-V74 PolarHBondContact O-N 3.14Å; V74-F76 HydrophobicContact CB-CE2 3.8Å; V74-F76 HydrophobicContact CB-CZ 3.95Å; V74-F76 HydrophobicContact CG1-CD2 4.25Å; V74-F76 HydrophobicContact CG1-CE1 3.88Å; V74-F76 HydrophobicContact CG1-CE2 3.53Å; V74-F76 HydrophobicContact CG1-CZ 3.32Å; V74-T99 WeakPolarHBondContact CA-O 3.49Å
75	Y	98.3	Very high	84.8	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.016	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.9	179.8	-72	-94.2	0	0	0	110	L1 V18 K19 I29 M62 L64 D71 A73 G98 T99 V101	L1-Y75 HydrophobicContact CD1-CG 4.45Å; L1-Y75 HydrophobicContact CD2-CG 4.38Å; V18-Y75 CarbonylContact O-C 3.56Å; V18-Y75 WeakPolarHBondContact O-CA 3.42Å; K19-Y75 HydrophobicContact CB-CD1 4.22Å; K19-Y75 HydrophobicContact CB-CE1 4.01Å; K19-Y75 HydrophobicContact CD-CE1 4.1Å; K19-Y75 HydrophobicContact CG-CD1 4.35Å; K19-Y75 HydrophobicContact CG-CE1 3.86Å; K19-Y75 HydrophobicContact CG-CE2 4.49Å; I29-Y75 HydrophobicContact CD1-CD1 3.71Å; I29-Y75 HydrophobicContact CD1-CE1 3.76Å; M62-Y75 HydrophobicContact CE-CD1 3.61Å; M62-Y75 HydrophobicContact CE-CE1 4.19Å; M62-Y75 HydrophobicContact CE-CG 4.41Å; L64-Y75 HydrophobicContact CD1-CD1 4.18Å; L64-Y75 HydrophobicContact CD1-CE1 3.58Å; L64-Y75 HydrophobicContact CD1-CE2 4.32Å; D71-Y75 PolarHBondContact O-OH 3.09Å; A73-Y75 HydrophobicContact CB-CD2 4.29Å; A73-Y75 HydrophobicContact CB-CE2 3.82Å; Y75-G98 CarbonylContact O-C 3.47Å; Y75-G98 WeakPolarHBondContact O-CA 3.45Å; Y75-T99 PolarHBondContact N-O 3.37Å; Y75-T99 PolarHBondContact O-N 2.98Å; Y75-V101 HydrophobicContact CD2-CB 3.84Å; Y75-V101 HydrophobicContact CD2-CG2 3.64Å; Y75-V101 HydrophobicContact CE2-CB 3.76Å; Y75-V101 HydrophobicContact CE2-CG1 4.47Å; Y75-V101 HydrophobicContact CE2-CG2 4Å
76	F	97.9	Very high	82.8	Confident	30 Å²	30	58.4 Å²	58.4	13%	0.132	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	148.8	-179.2	-56.8	-90.4	0	0	0	110.3	W17 V18 Q20 V74 W95	W17-F76 WeakPolarHBondContact CA-O 3.28Å; V18-F76 PolarHBondContact N-O 2.89Å; V18-F76 PolarHBondContact O-N 2.9Å; Q20-F76 HydrophobicContact CB-CD2 4.43Å; Q20-F76 HydrophobicContact CB-CE2 3.76Å; V74-F76 HydrophobicContact CB-CE2 3.8Å; V74-F76 HydrophobicContact CB-CZ 3.95Å; V74-F76 HydrophobicContact CG1-CD2 4.25Å; V74-F76 HydrophobicContact CG1-CE1 3.88Å; V74-F76 HydrophobicContact CG1-CE2 3.53Å; V74-F76 HydrophobicContact CG1-CZ 3.32Å; F76-W95 HydrophobicContact CB-CE3 3.75Å; F76-W95 HydrophobicContact CB-CZ3 3.92Å; F76-W95 HydrophobicContact CG-CE3 4.19Å; F76-W95 HydrophobicContact CG-CZ3 4.37Å
77	C	97.1	Very high	80.7	Confident	17 Å²	17	57 Å²	57	12%	0.115	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	149	157.3	63	0	0	0	0	109.2	C3 I15 S16 W17 G96	C3-C77 HydrophobicContact CB-CB 3.44Å; C3-C77 VanDerWaalsContact CB-CB 3.44Å; C3-C77 WeakPolarHBondContact CB-SG 3.26Å; C3-C77 WeakPolarHBondContact SG-CB 3.39Å; C3-C77 CovalentContact SG-SG 2.02Å; C3-C77 PolarHBondContact SG-SG 2.89Å; I15-C77 HydrophobicContact CG2-CB 4.19Å; S16-C77 CarbonylContact O-C 3.38Å; S16-C77 VanDerWaalsContact O-CA 3.25Å; S16-C77 WeakPolarHBondContact O-CA 3.47Å; W17-C77 HydrophobicContact CD2-CB 4.36Å; W17-C77 HydrophobicContact CE3-CB 4.13Å; W17-C77 HydrophobicContact CH2-CB 4.3Å; W17-C77 HydrophobicContact CZ2-CB 4.49Å; W17-C77 HydrophobicContact CZ3-CB 4.1Å; C77-G96 PolarHBondContact O-N 3.47Å
78	A	95.6	Very high	78.8	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.008	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	142.9	174.9	0	0	0	0	0	110.7	I15 S16 S80 M92 Y94 W95	I15-A78 CarbonylContact C-O 3.5Å; I15-A78 WeakPolarHBondContact CA-O 3.38Å; S16-A78 PolarHBondContact N-O 3.43Å; S16-A78 PolarHBondContact O-N 3.06Å; A78-S80 PolarHBondContact O-N 2.87Å; A78-M92 HydrophobicContact CB-CB 3.93Å; A78-M92 HydrophobicContact CB-CG 4.09Å; A78-M92 HydrophobicContact CB-SD 3.95Å; A78-Y94 CarbonylContact C-O 3.58Å; A78-Y94 WeakPolarHBondContact CA-O 3.26Å; A78-Y94 WeakPolarHBondContact CB-O 3.38Å; A78-W95 HydrophobicContact CB-CD2 3.69Å; A78-W95 HydrophobicContact CB-CE3 3.98Å; A78-W95 HydrophobicContact CB-CG 4.06Å; A78-W95 HydrophobicContact CB-CH2 4.46Å; A78-W95 HydrophobicContact CB-CZ2 4.2Å; A78-W95 HydrophobicContact CB-CZ3 4.36Å
79	R	93.1	Very high	76.8	Confident	35 Å²	35	64.6 Å²	64.6	13%	0.132	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.3	170.8	-172.4	-167.5	77	174.2	9.3	108.6	Y8 Y13 M92 D93 Y94	Y8-R79 HydrophobicContact CE2-CG 4.08Å; Y13-R79 HydrophobicContact CD1-CG 4.09Å; Y13-R79 HydrophobicContact CG-CG 3.84Å; R79-M92 WeakPolarHBondContact O-CA 3.49Å; R79-D93 IonicContact NH2-OD2 2.91Å; R79-D93 PolarHBondContact NH2-OD2 2.74Å; R79-D93 PolarHBondContact O-N 3Å; R79-Y94 PolarHBondContact N-O 3.32Å; R79-Y94 VanDerWaalsContact NH2-CD2 3.32Å
80	S	85.4	Confident	75.3	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	133.2	175.3	36.6	0	0	0	0	110.8	G14 S16 E31 A78	G14-S80 VanDerWaalsContact C-OG 3.31Å; G14-S80 PolarHBondContact N-O 2.87Å; G14-S80 PolarHBondContact O-N 3.03Å; G14-S80 PolarHBondContact O-OG 3.23Å; S16-S80 WeakPolarHBondContact OG-CB 3.48Å; S16-S80 PolarHBondContact OG-OG 3.02Å; E31-S80 WeakPolarHBondContact OE1-CB 3.37Å; E31-S80 PolarHBondContact OE1-OG 3.22Å; A78-S80 PolarHBondContact O-N 2.87Å
81	G	70.9	Confident	74.3	Confident	5 Å²	5	60.2 Å²	60.2	5%	0.052	32%	0.322	C	S	.	.			trans	-112.6	158.3	-178.1	0	0	0	0	0	113.1	Y83 A91	G81-Y83 PolarHBondContact O-N 2.95Å; G81-A91 PolarHBondContact N-O 3.29Å
82	Y	58.9	Low	73.8	Confident	184 Å²	184	62.1 Å²	62.1	72%	0.722	33%	0.331	S	S	*	.			trans	-83.5	103.9	165.1	-172.8	-95.4	0	0	0	108.6
83	Y	51.7	Low	73.1	Confident	144 Å²	144	63.4 Å²	63.4	57%	0.565	34%	0.335	S	S	*	.			trans	-87.3	123.1	164.5	-92.7	-88.4	0	0	0	108.6	G81 A91	G81-Y83 PolarHBondContact O-N 2.95Å; Y83-A91 HydrophobicContact CD2-CB 4.04Å; Y83-A91 HydrophobicContact CE2-CB 4.17Å
84	G	46.4	Very low	72.7	Confident	52 Å²	52	70 Å²	70	54%	0.536	36%	0.359	S	S	.	.	S	Bend	trans	-60.7	159.4	-175.1	0	0	0	0	0	114.5
85	S	48.2	Very low	72.5	Confident	88 Å²	88	72.6 Å²	72.6	62%	0.615	36%	0.364	S	S	*	.	S	Bend	trans	85.7	104.8	-178.6	75.8	0	0	0	0	116	T87	S85-T87 PolarHBondContact O-N 3.37Å; S85-T87 PolarHBondContact O-OG1 3.11Å
86	S	52.9	Low	72.4	Confident	126 Å²	126	73.8 Å²	73.8	88%	0.881	38%	0.377	S	S	*	.	S	Bend	trans	44.6	-5.6	150.3	42.1	0	0	0	0	122
87	T	48	Very low	72.3	Confident	80 Å²	80	81.4 Å²	81.4	49%	0.491	41%	0.413	S	S	.	.	S	Bend	trans	-136.9	121.7	175.7	45	0	0	0	0	106.9	S85 N89	S85-T87 PolarHBondContact O-N 3.37Å; S85-T87 PolarHBondContact O-OG1 3.11Å; T87-N89 PolarHBondContact O-N 2.79Å; T87-N89 PolarHBondContact OG1-ND2 2.82Å
88	R	52.1	Low	72.3	Confident	176 Å²	176	81.9 Å²	81.9	66%	0.664	42%	0.421	S	S	*	.			trans	-66.3	75.7	179.1	-68.3	178.4	177.7	-179.8	2.3	110.3	Y90	R88-Y90 HydrophobicContact CB-CD2 4.24Å; R88-Y90 HydrophobicContact CB-CE2 3.6Å; R88-Y90 HydrophobicContact CG-CE2 4.45Å; R88-Y90 VanDerWaalsContact O-CD2 3.23Å; R88-Y90 WeakPolarHBondContact O-CD2 3.42Å; R88-Y90 PolarHBondContact O-N 3.14Å
89	N	50.8	Low	72.4	Confident	104 Å²	104	85.6 Å²	85.6	56%	0.556	44%	0.444	S	S	*	.			trans	-87.7	92.8	177	-67.2	-35.7	0	0	0	108.5	T87 A91	T87-N89 PolarHBondContact O-N 2.79Å; T87-N89 PolarHBondContact OG1-ND2 2.82Å; N89-A91 VanDerWaalsContact C-N 3.34Å; N89-A91 PolarHBondContact O-N 2.77Å
90	Y	60.4	Low	72.6	Confident	84 Å²	84	87.9 Å²	87.9	33%	0.329	47%	0.465	S	S	.	.			trans	-74.7	83.9	175.3	-61.6	-89.9	0	0	0	109.9	E31 Y33 R88 M92	E31-Y90 WeakPolarHBondContact OE2-CE1 3.42Å; Y33-Y90 VanDerWaalsContact OH-CE1 3.26Å; Y33-Y90 WeakPolarHBondContact OH-CE1 3.46Å; R88-Y90 HydrophobicContact CB-CD2 4.24Å; R88-Y90 HydrophobicContact CB-CE2 3.6Å; R88-Y90 HydrophobicContact CG-CE2 4.45Å; R88-Y90 VanDerWaalsContact O-CD2 3.23Å; R88-Y90 WeakPolarHBondContact O-CD2 3.42Å; R88-Y90 PolarHBondContact O-N 3.14Å; Y90-M92 PolarHBondContact O-N 2.9Å
91	A	68.7	Low	73.1	Confident	34 Å²	34	89.4 Å²	89.4	28%	0.281	47%	0.474	S	S	.	.			trans	-69.5	123.2	169.1	0	0	0	0	0	109.1	G81 Y83 N89 D93	G81-A91 PolarHBondContact N-O 3.29Å; Y83-A91 HydrophobicContact CD2-CB 4.04Å; Y83-A91 HydrophobicContact CE2-CB 4.17Å; N89-A91 VanDerWaalsContact C-N 3.34Å; N89-A91 PolarHBondContact O-N 2.77Å; A91-D93 VanDerWaalsContact CB-OD1 3.26Å; A91-D93 WeakPolarHBondContact CB-OD1 3.43Å; A91-D93 PolarHBondContact O-N 2.91Å
92	M	82.8	Confident	74.3	Confident	49 Å²	49	94.6 Å²	94.6	24%	0.241	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	85.3	173.9	-68	-176.3	-159.6	0	0	108.6	V18 W28 A78 R79 Y90 W95	V18-M92 HydrophobicContact CG2-CE 4.27Å; V18-M92 HydrophobicContact CG2-SD 3.95Å; W28-M92 VanDerWaalsContact CD1-CE 3.41Å; W28-M92 HydrophobicContact CG-CE 4.33Å; A78-M92 HydrophobicContact CB-CB 3.93Å; A78-M92 HydrophobicContact CB-CG 4.09Å; A78-M92 HydrophobicContact CB-SD 3.95Å; R79-M92 WeakPolarHBondContact O-CA 3.49Å; Y90-M92 PolarHBondContact O-N 2.9Å; M92-W95 HydrophobicContact CB-CZ2 3.7Å; M92-W95 HydrophobicContact CG-CZ2 4.25Å; M92-W95 PolarHBondContact O-NE1 3.49Å; M92-W95 HydrophobicContact SD-CH2 3.72Å; M92-W95 HydrophobicContact SD-CZ2 3.51Å; M92-W95 VanDerWaalsContact SD-CZ2 3.51Å
93	D	80.9	Confident	75.9	Confident	65 Å²	65	87.3 Å²	87.3	35%	0.348	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-25	-168.3	-54.7	-31.8	0	0	0	113.3	R79 A91	R79-D93 IonicContact NH2-OD2 2.91Å; R79-D93 PolarHBondContact NH2-OD2 2.74Å; R79-D93 PolarHBondContact O-N 3Å; A91-D93 VanDerWaalsContact CB-OD1 3.26Å; A91-D93 WeakPolarHBondContact CB-OD1 3.43Å; A91-D93 PolarHBondContact O-N 2.91Å
94	Y	88.9	Confident	77.8	Confident	145 Å²	145	85.3 Å²	85.3	57%	0.569	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	130.2	-176.9	-68.2	-93.5	0	0	0	110.5	A78 R79	A78-Y94 CarbonylContact C-O 3.58Å; A78-Y94 WeakPolarHBondContact CA-O 3.26Å; A78-Y94 WeakPolarHBondContact CB-O 3.38Å; R79-Y94 PolarHBondContact N-O 3.32Å; R79-Y94 VanDerWaalsContact NH2-CD2 3.32Å
95	W	94.6	Very high	79.6	Confident	101 Å²	101	88.1 Å²	88.1	38%	0.383	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.8	-176	-68.4	71.6	0	0	0	110.8	V18 L26 F76 A78 M92	V18-W95 HydrophobicContact CB-CH2 4.07Å; V18-W95 HydrophobicContact CB-CZ3 3.77Å; V18-W95 HydrophobicContact CG1-CH2 4.03Å; V18-W95 HydrophobicContact CG1-CZ3 3.96Å; V18-W95 HydrophobicContact CG2-CH2 3.7Å; V18-W95 HydrophobicContact CG2-CZ3 3.82Å; L26-W95 HydrophobicContact CD1-CH2 3.88Å; L26-W95 HydrophobicContact CD1-CZ2 4.48Å; L26-W95 HydrophobicContact CD1-CZ3 4.38Å; F76-W95 HydrophobicContact CB-CE3 3.75Å; F76-W95 HydrophobicContact CB-CZ3 3.92Å; F76-W95 HydrophobicContact CG-CE3 4.19Å; F76-W95 HydrophobicContact CG-CZ3 4.37Å; A78-W95 HydrophobicContact CB-CD2 3.69Å; A78-W95 HydrophobicContact CB-CE3 3.98Å; A78-W95 HydrophobicContact CB-CG 4.06Å; A78-W95 HydrophobicContact CB-CH2 4.46Å; A78-W95 HydrophobicContact CB-CZ2 4.2Å; A78-W95 HydrophobicContact CB-CZ3 4.36Å; M92-W95 HydrophobicContact CB-CZ2 3.7Å; M92-W95 HydrophobicContact CG-CZ2 4.25Å; M92-W95 PolarHBondContact O-NE1 3.49Å; M92-W95 HydrophobicContact SD-CH2 3.72Å; M92-W95 HydrophobicContact SD-CZ2 3.51Å; M92-W95 VanDerWaalsContact SD-CZ2 3.51Å
96	G	95.4	Very high	80.9	Confident	29 Å²	29	92.5 Å²	92.5	30%	0.299	51%	0.509	S	S	.	.			trans	-68.9	163.3	164.1	0	0	0	0	0	111	C77 G98	C77-G96 PolarHBondContact O-N 3.47Å; G96-G98 PolarHBondContact O-N 3.11Å; G96-G98 VanDerWaalsContact O-N 3.13Å
97	Q	96	Very high	81.9	Confident	190 Å²	190	91.5 Å²	91.5	89%	0.888	50%	0.502	S	S	*	.			trans	-65.1	-16.6	-179.9	-63.5	-60.1	-42.8	0	0	113.8
98	G	96.6	Very high	82.4	Confident	28 Å²	28	96.8 Å²	96.8	29%	0.289	52%	0.521	S	S	.	.			trans	85.8	157.3	-175.7	0	0	0	0	0	113.1	Y75 G96	Y75-G98 CarbonylContact O-C 3.47Å; Y75-G98 WeakPolarHBondContact O-CA 3.45Å; G96-G98 PolarHBondContact O-N 3.11Å; G96-G98 VanDerWaalsContact O-N 3.13Å
99	T	97.6	Very high	82.5	Confident	78 Å²	78	97.1 Å²	97.1	48%	0.479	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.2	126.9	174.8	-82.3	0	0	0	0	109	L1 V74 Y75 V101	L1-T99 HydrophobicContact CD2-CG2 3.71Å; V74-T99 WeakPolarHBondContact CA-O 3.49Å; Y75-T99 PolarHBondContact N-O 3.37Å; Y75-T99 PolarHBondContact O-N 2.98Å; T99-V101 HydrophobicContact CG2-CG2 4.18Å
100	S	97.3	Very high	84.1	Confident	84 Å²	84	96.8 Å²	96.8	59%	0.587	55%	0.55	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.4	128.1	170.7	-170.2	0	0	0	0	109.8
101	V	96.2	Very high	85.4	Confident	31 Å²	31	97.4 Å²	97.4	19%	0.188	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.6	124.2	168.7	179.1	0	0	0	0	106.9	L1 L67 S72 A73 Y75 T99 V103	L1-V101 HydrophobicContact CD2-CG2 4.13Å; L67-V101 HydrophobicContact CD1-CG1 4.46Å; S72-V101 CarbonylContact C-O 3.57Å; S72-V101 VanDerWaalsContact CA-O 3.25Å; S72-V101 WeakPolarHBondContact CA-O 3.46Å; A73-V101 PolarHBondContact N-O 3.1Å; A73-V101 PolarHBondContact O-N 2.61Å; Y75-V101 HydrophobicContact CD2-CB 3.84Å; Y75-V101 HydrophobicContact CD2-CG2 3.64Å; Y75-V101 HydrophobicContact CE2-CB 3.76Å; Y75-V101 HydrophobicContact CE2-CG1 4.47Å; Y75-V101 HydrophobicContact CE2-CG2 4Å; T99-V101 HydrophobicContact CG2-CG2 4.18Å; V101-V103 HydrophobicContact CG1-CG2 4.24Å
102	T	95.6	Very high	86.3	Confident	114 Å²	114	100.9 Å²	100.9	70%	0.699	58%	0.577	S	S	*	*			trans	-115.7	129.4	177.1	-55.6	0	0	0	0	108.5
103	V	93.3	Very high	86.5	Confident	31 Å²	31	104 Å²	104	19%	0.188	60%	0.597	C	S	.	*			trans	-120.6	116	179.6	-174.1	0	0	0	0	107.3	L67 T68 S69 S72 V101	L67-V103 HydrophobicContact CB-CG1 4.18Å; L67-V103 HydrophobicContact CB-CG2 3.94Å; L67-V103 HydrophobicContact CD1-CG2 3.97Å; T68-V103 WeakPolarHBondContact O-CB 3.22Å; T68-V103 WeakPolarHBondContact O-CG1 3.4Å; S69-V103 WeakPolarHBondContact CA-O 2.99Å; S72-V103 PolarHBondContact OG-N 2.87Å; S72-V103 PolarHBondContact OG-O 2.89Å; V101-V103 HydrophobicContact CG1-CG2 4.24Å
104	S	90.8	Very high	86.9	Confident	103 Å²	103	106.4 Å²	106.4	72%	0.72	61%	0.613	S	S	*	*			trans	-114.1	139.4	176.2	51	0	0	0	0	109.7
105	S	85.5	Confident	86.7	Confident	111 Å²	111	103.9 Å²	103.9	78%	0.776	62%	0.616	S	S	*	*			trans	-75.1	129.9	165.7	51.4	0	0	0	0	109
106	E	75.5	Confident	86.2	Confident	180 Å²	180	104.1 Å²	104.1	84%	0.841	63%	0.632	S	S	*	*			trans	-97.1	119.8	167.4	-166.6	167.2	-150.8	0	0	108	Q108	E106-Q108 PolarHBondContact O-N 3.29Å
107	S	72.6	Confident	85.5	Confident	104 Å²	104	109.8 Å²	109.8	73%	0.727	66%	0.658	S	S	*	*			trans	-77.7	112.2	165.8	49.8	0	0	0	0	107.3	S109	S107-S109 PolarHBondContact O-N 2.68Å
108	Q	58	Low	84.6	Confident	192 Å²	192	103.2 Å²	103.2	90%	0.897	64%	0.639	S	S	*	*			trans	-65.7	103.9	162.8	-72.5	-179.2	15.2	0	0	107	E106	E106-Q108 PolarHBondContact O-N 3.29Å
109	S	56.2	Low	83.5	Confident	182 Å²	182	110 Å²	110	100%	1.273	67%	0.671	S	S	*	*			trans	-76	0	165.9	56.7	0	0	0	0	110.5	S107	S107-S109 PolarHBondContact O-N 2.68Å

Retrieved 109 of 109 residues in 21.4 ms (Link to these results)

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