X5J4T9_MOUSE Loading...

IgG1 heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4T9, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 109 aa.

						>X5J4T9_MOUSE|X5J4T9
PGLVAPSQTLSITCTVSGFSLTSYGVHWVRQPPGKGPEWLGVIWAGGSTNYSSALMSRLSIRKDNSNSHVFLKMNSLQTDDTAMYYCARDWVDYAMDSWGQGTSVTVSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	P	56.8	Low	79	Confident	119 Å²	119	70 Å²	70	77%	0.773	45%	0.45	S	S	*	.				0	140.7	0	-31.6	42.5	0	0	0	108.4	T103	P1-T103 HydrophobicContact CB-CG2 3.47Å; P1-T103 VanDerWaalsContact CB-CG2 3.47Å; P1-T103 HydrophobicContact CG-CG2 3.34Å
2	G	69.9	Low	80.3	Confident	48 Å²	48	64.5 Å²	64.5	50%	0.495	41%	0.414	S	S	.	.			trans	-127.1	-167.5	-159.2	0	0	0	0	0	113.4	V4	G2-V4 WeakPolarHBondContact O-CG2 3.42Å; G2-V4 PolarHBondContact O-N 3.27Å
3	L	71.1	Confident	81.5	Confident	127 Å²	127	64.6 Å²	64.6	67%	0.665	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.7	126.5	177	-162.5	68.4	0	0	0	110.6	T106 S108	L3-T106 WeakPolarHBondContact CA-O 3.4Å; L3-T106 HydrophobicContact CD1-CG2 3.87Å; L3-S108 WeakPolarHBondContact CD1-OG 3.42Å
4	V	77.1	Confident	82.4	Confident	20 Å²	20	60.8 Å²	60.8	12%	0.121	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.5	179.9	-149	0	0	0	0	109	G2 Q8 L77 V105 T106 V107 S108	G2-V4 WeakPolarHBondContact O-CG2 3.42Å; G2-V4 PolarHBondContact O-N 3.27Å; V4-Q8 HydrophobicContact CG1-CB 3.93Å; V4-L77 HydrophobicContact CB-CD1 3.94Å; V4-L77 HydrophobicContact CG1-CD1 3.63Å; V4-L77 HydrophobicContact CG2-CD1 4.39Å; V4-V105 HydrophobicContact CG2-CG1 3.89Å; V4-T106 PolarHBondContact N-O 3.06Å; V4-V107 WeakPolarHBondContact O-CA 3.31Å; V4-S108 PolarHBondContact O-N 2.73Å
5	A	79.5	Confident	83.3	Confident	41 Å²	41	63.1 Å²	63.1	34%	0.339	40%	0.402	S	S	.	.			trans	-79.5	154.1	176.1	0	0	0	0	0	110.8	Q8	A5-Q8 HydrophobicContact CB-CG 4.15Å; A5-Q8 WeakPolarHBondContact O-CB 3.45Å; A5-Q8 WeakPolarHBondContact O-CG 3.36Å; A5-Q8 PolarHBondContact O-N 3.3Å
6	P	77.4	Confident	83.7	Confident	50 Å²	50	59.9 Å²	59.9	33%	0.325	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	154.8	172.6	-24	33.8	0	0	0	112.1	Q8 L77 V107 S108	P6-Q8 PolarHBondContact O-N 3.08Å; P6-L77 WeakPolarHBondContact CA-O 3.16Å; P6-V107 HydrophobicContact CG-CG1 4.29Å; P6-S108 WeakPolarHBondContact CD-O 3.44Å
7	S	80.6	Confident	84.1	Confident	100 Å²	100	62.5 Å²	62.5	70%	0.699	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	-4.8	-177.4	-49.6	0	0	0	0	116	L77	S7-L77 PolarHBondContact N-O 2.86Å
8	Q	86.1	Confident	84.3	Confident	100 Å²	100	63.6 Å²	63.6	47%	0.467	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-74	168.5	172.3	-67.5	-169.1	-28.7	0	0	111.8	V4 A5 P6 S76 L77	V4-Q8 HydrophobicContact CG1-CB 3.93Å; A5-Q8 HydrophobicContact CB-CG 4.15Å; A5-Q8 WeakPolarHBondContact O-CB 3.45Å; A5-Q8 WeakPolarHBondContact O-CG 3.36Å; A5-Q8 PolarHBondContact O-N 3.3Å; P6-Q8 PolarHBondContact O-N 3.08Å; Q8-S76 PolarHBondContact O-N 3.02Å; Q8-L77 WeakPolarHBondContact O-CG 3.48Å; Q8-L77 PolarHBondContact O-N 2.97Å; Q8-L77 VanDerWaalsContact O-N 3.13Å
9	T	89.3	Confident	84.5	Confident	75 Å²	75	62.1 Å²	62.1	46%	0.46	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-101.2	128.5	174.5	-62.8	0	0	0	0	109.6	K73 M74 N75	T9-K73 HydrophobicContact CG2-CD 4.25Å; T9-K73 HydrophobicContact CG2-CG 3.86Å; T9-M74 CarbonylContact C-O 3.58Å; T9-M74 VanDerWaalsContact CA-O 3.3Å; T9-M74 WeakPolarHBondContact CA-O 3.3Å; T9-N75 WeakPolarHBondContact CG2-OD1 3.19Å; T9-N75 PolarHBondContact OG1-OD1 2.9Å
10	L	88.8	Confident	84.9	Confident	14 Å²	14	61.6 Å²	61.6	7%	0.073	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	139.5	171	176.7	64.3	0	0	0	109.6	I12 K73 M74 L77 V105	L10-I12 HydrophobicContact CD1-CG1 4Å; L10-I12 HydrophobicContact CD2-CD1 3.82Å; L10-I12 HydrophobicContact CD2-CG1 4.08Å; L10-I12 HydrophobicContact CG-CD1 4.23Å; L10-I12 HydrophobicContact CG-CG1 3.91Å; L10-K73 CarbonylContact O-C 3.51Å; L10-K73 VanDerWaalsContact O-CA 3.32Å; L10-K73 WeakPolarHBondContact O-CA 3.25Å; L10-M74 HydrophobicContact CB-CB 4.31Å; L10-M74 HydrophobicContact CD2-CG 4.49Å; L10-M74 HydrophobicContact CD2-SD 4.38Å; L10-M74 PolarHBondContact N-O 3.29Å; L10-M74 PolarHBondContact O-N 2.81Å; L10-L77 HydrophobicContact CB-CD1 3.71Å; L10-L77 HydrophobicContact CB-CD2 3.91Å; L10-L77 HydrophobicContact CB-CG 4.17Å; L10-L77 HydrophobicContact CD2-CD2 4.2Å; L10-V105 HydrophobicContact CD1-CG1 4.31Å; L10-V105 HydrophobicContact CD1-CG2 4.19Å; L10-V105 HydrophobicContact CD2-CB 4.49Å; L10-V105 HydrophobicContact CD2-CG1 3.97Å; L10-V105 HydrophobicContact CD2-CG2 4.01Å
11	S	92.4	Very high	85.3	Confident	76 Å²	76	58.8 Å²	58.8	53%	0.531	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	117.1	166.9	-172.3	0	0	0	0	108.9	L72	S11-L72 CarbonylContact C-O 3.55Å; S11-L72 WeakPolarHBondContact CA-O 3.25Å
12	I	94.1	Very high	87	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.2	174.9	-56.8	167	0	0	0	108.2	L10 W28 F71 L72 Y85 T103 V105	L10-I12 HydrophobicContact CD1-CG1 4Å; L10-I12 HydrophobicContact CD2-CD1 3.82Å; L10-I12 HydrophobicContact CD2-CG1 4.08Å; L10-I12 HydrophobicContact CG-CD1 4.23Å; L10-I12 HydrophobicContact CG-CG1 3.91Å; I12-W28 HydrophobicContact CB-CH2 4.07Å; I12-W28 HydrophobicContact CB-CZ3 4.25Å; I12-W28 HydrophobicContact CG2-CH2 3.66Å; I12-W28 HydrophobicContact CG2-CZ3 3.82Å; I12-F71 CarbonylContact O-C 3.54Å; I12-F71 VanDerWaalsContact O-CA 3.32Å; I12-F71 WeakPolarHBondContact O-CA 3.49Å; I12-L72 HydrophobicContact CB-CB 4.49Å; I12-L72 HydrophobicContact CD1-CD2 4.38Å; I12-L72 PolarHBondContact N-O 2.75Å; I12-L72 PolarHBondContact O-N 2.91Å; I12-Y85 VanDerWaalsContact CD1-CB 3.48Å; I12-Y85 HydrophobicContact CD1-CD1 3.83Å; I12-Y85 HydrophobicContact CD1-CD2 3.94Å; I12-Y85 HydrophobicContact CD1-CG 3.46Å; I12-Y85 VanDerWaalsContact CD1-CG 3.46Å; I12-T103 HydrophobicContact CD1-CG2 4.2Å; I12-T103 HydrophobicContact CG1-CG2 4.26Å; I12-T103 HydrophobicContact CG2-CG2 4.14Å; I12-V105 HydrophobicContact CD1-CG2 4.11Å
13	T	95.9	Very high	88.1	Confident	66 Å²	66	58.4 Å²	58.4	41%	0.405	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.4	173.1	-53.5	0	0	0	0	109.3	H69 F71	T13-H69 HydrophobicContact CG2-CB 4.08Å; T13-F71 HydrophobicContact CG2-CD1 3.98Å; T13-F71 HydrophobicContact CG2-CE1 3.62Å; T13-F71 HydrophobicContact CG2-CZ 4.28Å; T13-F71 VanDerWaalsContact OG1-CD1 3.31Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.4Å; T13-F71 VanDerWaalsContact OG1-CE1 3.31Å; T13-F71 WeakPolarHBondContact OG1-CE1 3.35Å
14	C	95	Very high	89.1	Confident	11 Å²	11	55.8 Å²	55.8	7%	0.074	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116.5	166.9	171.7	0	0	0	0	108.7	W28 H69 V70 C87	C14-W28 HydrophobicContact CB-CH2 3.65Å; C14-W28 HydrophobicContact CB-CZ2 3.72Å; C14-H69 CarbonylContact O-C 3.51Å; C14-H69 WeakPolarHBondContact O-CA 3.4Å; C14-V70 HydrophobicContact CB-CB 4.46Å; C14-V70 PolarHBondContact N-O 2.91Å; C14-V70 PolarHBondContact O-N 3.17Å; C14-C87 HydrophobicContact CB-CB 3.49Å; C14-C87 VanDerWaalsContact CB-CB 3.49Å; C14-C87 WeakPolarHBondContact CB-SG 3.01Å; C14-C87 WeakPolarHBondContact SG-CB 3.3Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 3.45Å
15	T	94.8	Very high	89.9	Confident	95 Å²	95	54.9 Å²	54.9	58%	0.583	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.7	170.9	-55.1	0	0	0	0	108.4	H69	T15-H69 PolarHBondContact OG1-CD2 3.12Å; T15-H69 VanDerWaalsContact OG1-CD2 3.24Å; T15-H69 PolarHBondContact OG1-NE2 2.9Å; T15-H69 VanDerWaalsContact OG1-NE2 3.11Å
16	V	91.1	Very high	90.6	Very high	13 Å²	13	53 Å²	53	8%	0.079	34%	0.341	C	S	.	.			trans	-89.4	144.6	178.4	-55.7	0	0	0	0	110.5	F19 L21 V26 S68 V70	V16-F19 HydrophobicContact CB-CE1 3.85Å; V16-F19 HydrophobicContact CB-CE2 4.13Å; V16-F19 HydrophobicContact CB-CZ 3.59Å; V16-F19 HydrophobicContact CG1-CE1 4.19Å; V16-F19 HydrophobicContact CG1-CE2 4.18Å; V16-F19 HydrophobicContact CG1-CZ 3.55Å; V16-F19 HydrophobicContact CG2-CE2 4.2Å; V16-F19 HydrophobicContact CG2-CZ 4.17Å; V16-L21 HydrophobicContact CB-CD2 4.39Å; V16-L21 HydrophobicContact CG1-CD2 4.01Å; V16-L21 HydrophobicContact CG2-CD1 4.07Å; V16-L21 HydrophobicContact CG2-CD2 3.56Å; V16-L21 HydrophobicContact CG2-CG 3.61Å; V16-V26 HydrophobicContact CG1-CG2 4.25Å; V16-S68 WeakPolarHBondContact CG2-O 3.49Å; V16-S68 PolarHBondContact N-O 3.37Å; V16-V70 HydrophobicContact CG1-CG2 4.39Å
17	S	89.6	Confident	91.5	Very high	104 Å²	104	51.2 Å²	51.2	73%	0.727	33%	0.329	S	S	*	.			trans	-140.9	152.3	173.9	60.5	0	0	0	0	109.3	F19	S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 PolarHBondContact O-N 3.21Å
18	G	87.6	Confident	92.2	Very high	82 Å²	82	46.6 Å²	46.6	85%	0.845	30%	0.296	S	S	*	.	S	Bend	trans	82.3	-0.4	-179.1	0	0	0	0	0	115.7
19	F	88.7	Confident	92.6	Very high	34 Å²	34	42 Å²	42	15%	0.149	28%	0.275	C	S	.	.	S	Bend	trans	-155.2	163.6	171.6	66.5	-86.4	0	0	0	111.9	V16 S17 L21 Y24 V26 R89	V16-F19 HydrophobicContact CB-CE1 3.85Å; V16-F19 HydrophobicContact CB-CE2 4.13Å; V16-F19 HydrophobicContact CB-CZ 3.59Å; V16-F19 HydrophobicContact CG1-CE1 4.19Å; V16-F19 HydrophobicContact CG1-CE2 4.18Å; V16-F19 HydrophobicContact CG1-CZ 3.55Å; V16-F19 HydrophobicContact CG2-CE2 4.2Å; V16-F19 HydrophobicContact CG2-CZ 4.17Å; S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 PolarHBondContact O-N 3.21Å; F19-L21 HydrophobicContact CE2-CD2 4.06Å; F19-Y24 HydrophobicContact CB-CD2 3.82Å; F19-Y24 HydrophobicContact CB-CE2 4.14Å; F19-Y24 AromaticContact CD2-CD2 3.96Å; F19-Y24 HydrophobicContact CD2-CD2 3.96Å; F19-Y24 HydrophobicContact CD2-CG 4.19Å; F19-Y24 HydrophobicContact CG-CD2 4.29Å; F19-V26 HydrophobicContact CE2-CG2 3.95Å; F19-V26 HydrophobicContact CZ-CG2 4.05Å; F19-R89 HydrophobicContact CD1-CG 4.39Å; F19-R89 HydrophobicContact CD2-CG 4.31Å; F19-R89 HydrophobicContact CE1-CB 3.96Å; F19-R89 HydrophobicContact CE1-CG 4.18Å; F19-R89 HydrophobicContact CE2-CB 4.42Å; F19-R89 HydrophobicContact CE2-CG 4.09Å; F19-R89 HydrophobicContact CG-CG 4.44Å; F19-R89 HydrophobicContact CZ-CB 3.86Å; F19-R89 HydrophobicContact CZ-CG 4Å
20	S	92	Very high	92.8	Very high	53 Å²	53	39.5 Å²	39.5	37%	0.371	26%	0.257	S	S	.	.			trans	-96.2	134.8	176.8	-177.1	0	0	0	0	112.4	T22 S23 Y24	S20-T22 PolarHBondContact O-N 3.29Å; S20-T22 PolarHBondContact OG-N 2.74Å; S20-T22 PolarHBondContact OG-OG1 2.99Å; S20-S23 PolarHBondContact O-N 3.1Å; S20-Y24 PolarHBondContact O-N 3.19Å; S20-Y24 VanDerWaalsContact O-N 3.13Å
21	L	93.6	Very high	93.1	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-11.3	173	-66	-179.2	0	0	0	114	V16 F19 V26 K63 N65 V70	V16-L21 HydrophobicContact CB-CD2 4.39Å; V16-L21 HydrophobicContact CG1-CD2 4.01Å; V16-L21 HydrophobicContact CG2-CD1 4.07Å; V16-L21 HydrophobicContact CG2-CD2 3.56Å; V16-L21 HydrophobicContact CG2-CG 3.61Å; F19-L21 HydrophobicContact CE2-CD2 4.06Å; L21-V26 HydrophobicContact CD2-CG2 3.61Å; L21-K63 HydrophobicContact CB-CD 4.45Å; L21-K63 HydrophobicContact CD1-CB 4.33Å; L21-K63 PolarHBondContact O-NZ 2.76Å; L21-N65 VanDerWaalsContact CB-OD1 3.31Å; L21-N65 WeakPolarHBondContact CB-OD1 3.47Å; L21-V70 HydrophobicContact CD1-CG2 3.86Å; L21-V70 HydrophobicContact CD2-CG2 3.59Å; L21-V70 HydrophobicContact CG-CG2 4.41Å
22	T	93.4	Very high	93.2	Very high	83 Å²	83	39.5 Å²	39.5	51%	0.509	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-15.3	171.5	58.3	0	0	0	0	112.9	S20 N65	S20-T22 PolarHBondContact O-N 3.29Å; S20-T22 PolarHBondContact OG-N 2.74Å; S20-T22 PolarHBondContact OG-OG1 2.99Å; T22-N65 HydrophobicContact CG2-CB 4.36Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.46Å
23	S	92	Very high	93.2	Very high	76 Å²	76	44.3 Å²	44.3	53%	0.531	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-25.9	-177.4	-55.5	0	0	0	0	113	S20	S20-S23 PolarHBondContact O-N 3.1Å
24	Y	91.8	Very high	93.1	Very high	72 Å²	72	45.6 Å²	45.6	28%	0.282	31%	0.307	S	S	.	.			trans	-128.5	149.6	-175.5	-61.3	-83.4	0	0	0	112.3	F19 S20 R89 D90 W91	F19-Y24 HydrophobicContact CB-CD2 3.82Å; F19-Y24 HydrophobicContact CB-CE2 4.14Å; F19-Y24 AromaticContact CD2-CD2 3.96Å; F19-Y24 HydrophobicContact CD2-CD2 3.96Å; F19-Y24 HydrophobicContact CD2-CG 4.19Å; F19-Y24 HydrophobicContact CG-CD2 4.29Å; S20-Y24 PolarHBondContact O-N 3.19Å; S20-Y24 VanDerWaalsContact O-N 3.13Å; Y24-R89 HydrophobicContact CD1-CG 4.41Å; Y24-R89 HydrophobicContact CG-CG 4.35Å; Y24-D90 WeakPolarHBondContact CD1-O 3.43Å; Y24-W91 AromaticContact CD1-CE3 3.9Å; Y24-W91 HydrophobicContact CD1-CE3 3.9Å; Y24-W91 AromaticContact CD1-CZ3 3.99Å; Y24-W91 HydrophobicContact CD1-CZ3 3.99Å; Y24-W91 HydrophobicContact CE1-CD2 4.46Å; Y24-W91 AromaticContact CE1-CE3 3.38Å; Y24-W91 HydrophobicContact CE1-CE3 3.38Å; Y24-W91 HydrophobicContact CE1-CH2 4.05Å; Y24-W91 AromaticContact CE1-CZ3 3.13Å; Y24-W91 HydrophobicContact CE1-CZ3 3.13Å; Y24-W91 HydrophobicContact CE2-CZ3 4.34Å; Y24-W91 AromaticContact CZ-CZ3 3.35Å; Y24-W91 WeakPolarHBondContact OH-CH2 3.31Å; Y24-W91 VanDerWaalsContact OH-CZ3 3.3Å; Y24-W91 WeakPolarHBondContact OH-CZ3 3.32Å
25	G	93.7	Very high	93	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.01	33%	0.33	C	S	.	.			trans	-79	163.6	167.1	0	0	0	0	0	112.2	I43 D90	G25-I43 CarbonylContact C-O 3.43Å; G25-I43 WeakPolarHBondContact CA-O 3.48Å; G25-D90 WeakPolarHBondContact O-CB 3.45Å; G25-D90 PolarHBondContact O-N 3.04Å
26	V	95.6	Very high	92.9	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	121.5	173.9	179.6	0	0	0	0	109.7	V16 F19 L21 V42 I43 V70 C87 A88	V16-V26 HydrophobicContact CG1-CG2 4.25Å; F19-V26 HydrophobicContact CE2-CG2 3.95Å; F19-V26 HydrophobicContact CZ-CG2 4.05Å; L21-V26 HydrophobicContact CD2-CG2 3.61Å; V26-V42 WeakPolarHBondContact O-CA 3.36Å; V26-V42 WeakPolarHBondContact O-CG2 3.31Å; V26-I43 HydrophobicContact CB-CG2 4.43Å; V26-I43 PolarHBondContact N-O 3.23Å; V26-I43 PolarHBondContact O-N 2.96Å; V26-V70 HydrophobicContact CB-CG1 4.35Å; V26-V70 HydrophobicContact CB-CG2 4.03Å; V26-V70 HydrophobicContact CG1-CB 4.35Å; V26-V70 HydrophobicContact CG1-CG1 4.23Å; V26-V70 HydrophobicContact CG1-CG2 4.17Å; V26-V70 HydrophobicContact CG2-CG2 3.92Å; V26-C87 HydrophobicContact CG1-CB 3.92Å; V26-A88 CarbonylContact C-O 3.6Å; V26-A88 VanDerWaalsContact CA-O 3.31Å; V26-A88 WeakPolarHBondContact CA-O 3.43Å
27	H	95.1	Very high	93	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.056	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	148.3	175.2	-63.4	-99.6	0	0	0	110.6	W39 G41 C87 A88 D90 M96	H27-W39 AromaticContact CG-NE1 3.88Å; H27-W39 AromaticContact ND1-CD1 3.84Å; H27-W39 AromaticContact ND1-CE2 3.99Å; H27-W39 AromaticContact ND1-NE1 3.09Å; H27-W39 PolarHBondContact ND1-NE1 3.3Å; H27-G41 CarbonylContact C-O 3.56Å; H27-G41 WeakPolarHBondContact CA-O 3.2Å; H27-C87 CarbonylContact O-C 3.6Å; H27-C87 WeakPolarHBondContact O-CA 3.47Å; H27-A88 HydrophobicContact CB-CB 4.42Å; H27-A88 PolarHBondContact N-O 3.07Å; H27-A88 PolarHBondContact O-N 3.24Å; H27-D90 WeakPolarHBondContact NE2-CB 3.48Å; H27-D90 IonicContact NE2-OD1 3.15Å; H27-D90 PolarHBondContact NE2-OD1 2.75Å; H27-D90 VanDerWaalsContact NE2-OD1 3.15Å; H27-M96 HydrophobicContact CB-CE 3.92Å; H27-M96 HydrophobicContact CB-SD 4.08Å
28	W	95.3	Very high	93.2	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.008	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.4	164.8	-76.5	95.9	0	0	0	109.6	I12 C14 L40 G41 V70 L72 Y86 C87	I12-W28 HydrophobicContact CB-CH2 4.07Å; I12-W28 HydrophobicContact CB-CZ3 4.25Å; I12-W28 HydrophobicContact CG2-CH2 3.66Å; I12-W28 HydrophobicContact CG2-CZ3 3.82Å; C14-W28 HydrophobicContact CB-CH2 3.65Å; C14-W28 HydrophobicContact CB-CZ2 3.72Å; W28-L40 HydrophobicContact CB-CB 4.07Å; W28-L40 HydrophobicContact CB-CD1 4.38Å; W28-L40 WeakPolarHBondContact O-CB 3.48Å; W28-L40 PolarHBondContact O-N 2.88Å; W28-G41 PolarHBondContact N-O 2.87Å; W28-G41 PolarHBondContact O-N 2.88Å; W28-V70 HydrophobicContact CZ2-CG1 4.36Å; W28-L72 HydrophobicContact CB-CD1 4.38Å; W28-L72 HydrophobicContact CB-CD2 4.37Å; W28-L72 HydrophobicContact CD2-CB 3.63Å; W28-L72 HydrophobicContact CD2-CD1 4.46Å; W28-L72 HydrophobicContact CD2-CD2 3.91Å; W28-L72 HydrophobicContact CD2-CG 4.21Å; W28-L72 HydrophobicContact CE3-CB 3.95Å; W28-L72 HydrophobicContact CE3-CD2 3.73Å; W28-L72 HydrophobicContact CE3-CG 4.43Å; W28-L72 HydrophobicContact CG-CB 4.13Å; W28-L72 HydrophobicContact CG-CD1 4.12Å; W28-L72 HydrophobicContact CG-CD2 4.2Å; W28-L72 HydrophobicContact CG-CG 4.39Å; W28-L72 HydrophobicContact CH2-CB 4.04Å; W28-L72 HydrophobicContact CZ2-CB 3.73Å; W28-L72 HydrophobicContact CZ3-CB 4.15Å; W28-L72 HydrophobicContact CZ3-CD2 4.31Å; W28-Y86 WeakPolarHBondContact CA-O 3.3Å; W28-Y86 VanDerWaalsContact CE3-O 3.31Å; W28-C87 HydrophobicContact CD2-CB 4.45Å; W28-C87 HydrophobicContact CE3-CB 4.34Å; W28-C87 HydrophobicContact CH2-CB 4.24Å; W28-C87 HydrophobicContact CZ2-CB 4.32Å; W28-C87 HydrophobicContact CZ3-CB 4.24Å
29	V	94.6	Very high	93.4	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.024	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	141.8	179.7	-179.6	0	0	0	0	107.5	P37 E38 Y85 Y86 M96 W99	V29-P37 HydrophobicContact CG1-CB 3.63Å; V29-E38 CarbonylContact C-O 3.59Å; V29-E38 WeakPolarHBondContact CA-O 3.27Å; V29-E38 WeakPolarHBondContact CG1-O 3.5Å; V29-Y85 CarbonylContact O-C 3.58Å; V29-Y86 PolarHBondContact N-O 2.93Å; V29-Y86 PolarHBondContact O-N 3.11Å; V29-M96 HydrophobicContact CG2-CE 4.5Å; V29-M96 HydrophobicContact CG2-SD 4.03Å; V29-W99 HydrophobicContact CB-CH2 4.06Å; V29-W99 HydrophobicContact CB-CZ3 3.81Å; V29-W99 HydrophobicContact CG1-CH2 3.96Å; V29-W99 HydrophobicContact CG1-CZ3 3.9Å; V29-W99 HydrophobicContact CG2-CH2 3.77Å; V29-W99 HydrophobicContact CG2-CZ3 3.95Å
30	R	94.4	Very high	93.6	Very high	23 Å²	23	49.3 Å²	49.3	9%	0.087	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	153.3	167.9	70.5	174.7	-175.7	-177.3	8.1	110.9	P37 E38 L40 D81 A83 M84 Y85	R30-P37 CarbonylContact O-C 3.59Å; R30-E38 HydrophobicContact CG-CB 4.04Å; R30-E38 IonicContact CZ-OE2 2.91Å; R30-E38 VanDerWaalsContact CZ-OE2 3.32Å; R30-E38 PolarHBondContact N-O 2.94Å; R30-E38 IonicContact NE-OE2 2.88Å; R30-E38 PolarHBondContact NE-OE2 3.22Å; R30-E38 IonicContact NH2-OE2 2.94Å; R30-E38 PolarHBondContact NH2-OE2 2.83Å; R30-E38 PolarHBondContact O-N 3.39Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CD2 4.49Å; R30-L40 HydrophobicContact CB-CG 4.35Å; R30-L40 HydrophobicContact CG-CD1 4.28Å; R30-L40 HydrophobicContact CG-CD2 3.81Å; R30-L40 HydrophobicContact CG-CG 4.14Å; R30-D81 IonicContact NH1-OD1 3.32Å; R30-D81 PolarHBondContact NH1-OD1 3.39Å; R30-A83 HydrophobicContact CB-CB 3.92Å; R30-A83 HydrophobicContact CG-CB 4.4Å; R30-M84 CarbonylContact C-O 3.49Å; R30-M84 WeakPolarHBondContact CA-O 3.32Å; R30-Y85 HydrophobicContact CB-CD1 3.88Å; R30-Y85 HydrophobicContact CB-CE1 3.81Å; R30-Y85 HydrophobicContact CB-CG 4.34Å
31	Q	95.1	Very high	93.7	Very high	79 Å²	79	46.8 Å²	46.8	37%	0.369	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	101.2	173.5	-170.6	175.8	15.1	0	0	109.2	K35 A83 M84 Y86	Q31-K35 WeakPolarHBondContact CG-O 3.34Å; Q31-K35 PolarHBondContact NE2-O 3.19Å; Q31-A83 WeakPolarHBondContact O-CA 3.2Å; Q31-A83 WeakPolarHBondContact O-CB 3.13Å; Q31-M84 PolarHBondContact N-O 3.05Å; Q31-M84 PolarHBondContact O-N 2.62Å; Q31-Y86 HydrophobicContact CB-CE2 4.02Å
32	P	94.2	Very high	93.8	Very high	11 Å²	11	46.6 Å²	46.6	7%	0.071	28%	0.278	C	S	.	.			trans	-64.8	152.9	172.6	-19.4	32.1	0	0	0	111.4	G34 K35 A83	P32-G34 PolarHBondContact O-N 3.21Å; P32-K35 HydrophobicContact CB-CB 4.13Å; P32-K35 HydrophobicContact CB-CD 4.02Å; P32-K35 HydrophobicContact CB-CG 4.28Å; P32-K35 HydrophobicContact CG-CB 4.35Å; P32-K35 HydrophobicContact CG-CD 4.19Å; P32-K35 PolarHBondContact O-N 2.92Å; P32-K35 VanDerWaalsContact O-N 3.08Å; P32-A83 HydrophobicContact CG-CB 4.41Å
33	P	93.6	Very high	93.9	Very high	104 Å²	104	43.1 Å²	43.1	68%	0.675	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	128.9	175.7	-24.6	33.8	0	0	0	111.8	K35 T82	P33-K35 PolarHBondContact O-N 2.82Å; P33-T82 WeakPolarHBondContact CD-O 3.22Å; P33-T82 HydrophobicContact CG-CG2 4.47Å
34	G	94.6	Very high	94	Very high	94 Å²	94	42.5 Å²	42.5	97%	0.969	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.3	8.1	179.5	0	0	0	0	0	115.4	P32	P32-G34 PolarHBondContact O-N 3.21Å
35	K	92.8	Very high	94.1	Very high	126 Å²	126	40.7 Å²	40.7	55%	0.548	24%	0.242	S	C	.	.	S	Bend	trans	-118.7	163.8	177.2	-61.7	-171.2	-175.9	175.8	0	112.1	Q31 P32 P33	Q31-K35 WeakPolarHBondContact CG-O 3.34Å; Q31-K35 PolarHBondContact NE2-O 3.19Å; P32-K35 HydrophobicContact CB-CB 4.13Å; P32-K35 HydrophobicContact CB-CD 4.02Å; P32-K35 HydrophobicContact CB-CG 4.28Å; P32-K35 HydrophobicContact CG-CB 4.35Å; P32-K35 HydrophobicContact CG-CD 4.19Å; P32-K35 PolarHBondContact O-N 2.92Å; P32-K35 VanDerWaalsContact O-N 3.08Å; P33-K35 PolarHBondContact O-N 2.82Å
36	G	92.1	Very high	94.1	Very high	45 Å²	45	44.4 Å²	44.4	46%	0.464	28%	0.281	S	S	.	.			trans	-72.2	170	171	0	0	0	0	0	112.7
37	P	92.9	Very high	94	Very high	87 Å²	87	46 Å²	46	57%	0.565	30%	0.297	S	S	*	.			trans	-65.4	132.2	174.6	25.7	-31.9	0	0	0	111.5	V29 R30	V29-P37 HydrophobicContact CG1-CB 3.63Å; R30-P37 CarbonylContact O-C 3.59Å
38	E	93.3	Very high	94	Very high	65 Å²	65	48.8 Å²	48.8	30%	0.304	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	120	177	-64.4	178.1	177	0	0	109.2	V29 R30	V29-E38 CarbonylContact C-O 3.59Å; V29-E38 WeakPolarHBondContact CA-O 3.27Å; V29-E38 WeakPolarHBondContact CG1-O 3.5Å; R30-E38 HydrophobicContact CG-CB 4.04Å; R30-E38 IonicContact CZ-OE2 2.91Å; R30-E38 VanDerWaalsContact CZ-OE2 3.32Å; R30-E38 PolarHBondContact N-O 2.94Å; R30-E38 IonicContact NE-OE2 2.88Å; R30-E38 PolarHBondContact NE-OE2 3.22Å; R30-E38 IonicContact NH2-OE2 2.94Å; R30-E38 PolarHBondContact NH2-OE2 2.83Å; R30-E38 PolarHBondContact O-N 3.39Å
39	W	92.9	Very high	94	Very high	92 Å²	92	51.2 Å²	51.2	35%	0.348	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	130.5	175.4	-179.8	73.2	0	0	0	110.8	H27 G41 V42 N50 S52	H27-W39 AromaticContact CG-NE1 3.88Å; H27-W39 AromaticContact ND1-CD1 3.84Å; H27-W39 AromaticContact ND1-CE2 3.99Å; H27-W39 AromaticContact ND1-NE1 3.09Å; H27-W39 PolarHBondContact ND1-NE1 3.3Å; W39-G41 VanDerWaalsContact CE2-C 3.48Å; W39-G41 PolarHBondContact NE1-O 3.05Å; W39-V42 HydrophobicContact CZ2-CB 3.97Å; W39-V42 HydrophobicContact CZ2-CG1 3.82Å; W39-N50 HydrophobicContact CH2-CB 4.09Å; W39-S52 WeakPolarHBondContact O-CB 3.36Å; W39-S52 PolarHBondContact O-OG 2.72Å
40	L	93.4	Very high	93.9	Very high	1 Å²	1	55 Å²	55	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-40.8	-177.6	-65	-176.4	0	0	0	112.8	W28 R30 S52 L55 L59 L72 Y85	W28-L40 HydrophobicContact CB-CB 4.07Å; W28-L40 HydrophobicContact CB-CD1 4.38Å; W28-L40 WeakPolarHBondContact O-CB 3.48Å; W28-L40 PolarHBondContact O-N 2.88Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CD2 4.49Å; R30-L40 HydrophobicContact CB-CG 4.35Å; R30-L40 HydrophobicContact CG-CD1 4.28Å; R30-L40 HydrophobicContact CG-CD2 3.81Å; R30-L40 HydrophobicContact CG-CG 4.14Å; L40-S52 PolarHBondContact O-N 2.9Å; L40-S52 PolarHBondContact O-OG 3.1Å; L40-L55 HydrophobicContact CD2-CD1 3.3Å; L40-L59 HydrophobicContact CB-CD1 4.07Å; L40-L59 HydrophobicContact CD2-CD1 4.4Å; L40-L72 HydrophobicContact CD1-CD2 3.81Å; L40-Y85 HydrophobicContact CD1-CD1 3.87Å; L40-Y85 HydrophobicContact CD1-CE1 3.78Å
41	G	94.2	Very high	93.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.3	177.8	-173.3	0	0	0	0	0	112.3	H27 W28 W39 N50	H27-G41 CarbonylContact C-O 3.56Å; H27-G41 WeakPolarHBondContact CA-O 3.2Å; W28-G41 PolarHBondContact N-O 2.87Å; W28-G41 PolarHBondContact O-N 2.88Å; W39-G41 VanDerWaalsContact CE2-C 3.48Å; W39-G41 PolarHBondContact NE1-O 3.05Å; G41-N50 CarbonylContact C-O 3.57Å; G41-N50 WeakPolarHBondContact CA-O 3.42Å
42	V	94.4	Very high	93.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	147.1	177.9	64.5	0	0	0	0	109.5	V26 W39 W44 T49 N50	V26-V42 WeakPolarHBondContact O-CA 3.36Å; V26-V42 WeakPolarHBondContact O-CG2 3.31Å; W39-V42 HydrophobicContact CZ2-CB 3.97Å; W39-V42 HydrophobicContact CZ2-CG1 3.82Å; V42-W44 HydrophobicContact CG1-CD2 4.2Å; V42-W44 HydrophobicContact CG1-CH2 4.23Å; V42-W44 HydrophobicContact CG1-CZ2 3.55Å; V42-W44 HydrophobicContact CG2-CD2 4.22Å; V42-W44 HydrophobicContact CG2-CE3 4.22Å; V42-W44 HydrophobicContact CG2-CH2 4.46Å; V42-W44 HydrophobicContact CG2-CZ2 4.46Å; V42-W44 HydrophobicContact CG2-CZ3 4.34Å; V42-T49 VanDerWaalsContact O-CA 3.25Å; V42-T49 WeakPolarHBondContact O-CA 3.4Å; V42-N50 HydrophobicContact CG1-CB 3.97Å; V42-N50 PolarHBondContact N-O 3.25Å; V42-N50 PolarHBondContact O-N 2.77Å
43	I	95.9	Very high	92.6	Very high	9 Å²	9	58.7 Å²	58.7	5%	0.046	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.4	161.1	-172	162.5	0	0	0	108.9	G25 V26 S48 T49 I61 K63 V70	G25-I43 CarbonylContact C-O 3.43Å; G25-I43 WeakPolarHBondContact CA-O 3.48Å; V26-I43 HydrophobicContact CB-CG2 4.43Å; V26-I43 PolarHBondContact N-O 3.23Å; V26-I43 PolarHBondContact O-N 2.96Å; I43-S48 WeakPolarHBondContact CA-O 3.37Å; I43-T49 HydrophobicContact CB-CG2 3.95Å; I43-T49 HydrophobicContact CD1-CG2 4Å; I43-T49 HydrophobicContact CG1-CG2 3.81Å; I43-I61 HydrophobicContact CB-CG2 3.68Å; I43-I61 HydrophobicContact CD1-CG2 4.46Å; I43-I61 HydrophobicContact CG2-CG2 3.65Å; I43-K63 HydrophobicContact CD1-CB 3.96Å; I43-K63 HydrophobicContact CD1-CD 3.92Å; I43-K63 HydrophobicContact CD1-CG 3.69Å; I43-K63 HydrophobicContact CG1-CD 4.12Å; I43-K63 HydrophobicContact CG1-CG 4.44Å; I43-V70 HydrophobicContact CG2-CG1 3.84Å
44	W	95.3	Very high	91.5	Very high	64 Å²	64	57.9 Å²	57.9	24%	0.242	39%	0.386	C	S	.	.			trans	-79.4	167.2	-176.6	-58.9	105	0	0	0	111.8	V42 G46 G47 S48 N50 K63 D90 Y94	V42-W44 HydrophobicContact CG1-CD2 4.2Å; V42-W44 HydrophobicContact CG1-CH2 4.23Å; V42-W44 HydrophobicContact CG1-CZ2 3.55Å; V42-W44 HydrophobicContact CG2-CD2 4.22Å; V42-W44 HydrophobicContact CG2-CE3 4.22Å; V42-W44 HydrophobicContact CG2-CH2 4.46Å; V42-W44 HydrophobicContact CG2-CZ2 4.46Å; V42-W44 HydrophobicContact CG2-CZ3 4.34Å; W44-G46 PolarHBondContact O-N 3.49Å; W44-G47 WeakPolarHBondContact O-CA 3.49Å; W44-G47 PolarHBondContact O-N 2.92Å; W44-S48 PolarHBondContact N-O 2.99Å; W44-N50 PolarHBondContact NE1-OD1 2.83Å; W44-K63 PolarHBondContact O-NZ 3.05Å; W44-D90 WeakPolarHBondContact CZ3-OD2 3.19Å; W44-Y94 HydrophobicContact CH2-CD1 4.37Å; W44-Y94 HydrophobicContact CH2-CE1 4.33Å
45	A	93.4	Very high	90.4	Very high	33 Å²	33	54 Å²	54	27%	0.273	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-38.1	174.2	0	0	0	0	0	112.4	G47 K63	A45-G47 VanDerWaalsContact C-N 3.26Å; A45-G47 PolarHBondContact O-N 3.44Å; A45-K63 VanDerWaalsContact C-NZ 3.29Å; A45-K63 PolarHBondContact O-NZ 2.82Å
46	G	93.1	Very high	89.5	Confident	80 Å²	80	53.6 Å²	53.6	83%	0.825	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-6.9	174.6	0	0	0	0	0	115.4	W44	W44-G46 PolarHBondContact O-N 3.49Å
47	G	93.8	Very high	89.1	Confident	34 Å²	34	57.1 Å²	57.1	35%	0.351	36%	0.362	S	S	.	.	S	Bend	trans	89.9	-4.8	178.2	0	0	0	0	0	115.4	W44 A45	W44-G47 WeakPolarHBondContact O-CA 3.49Å; W44-G47 PolarHBondContact O-N 2.92Å; A45-G47 VanDerWaalsContact C-N 3.26Å; A45-G47 PolarHBondContact O-N 3.44Å
48	S	94.6	Very high	89	Confident	72 Å²	72	54.4 Å²	54.4	50%	0.503	34%	0.341	S	S	.	.			trans	-63.1	152.7	168.4	49.7	0	0	0	0	110.9	I43 W44	I43-S48 WeakPolarHBondContact CA-O 3.37Å; W44-S48 PolarHBondContact N-O 2.99Å
49	T	94.9	Very high	88.9	Confident	52 Å²	52	52 Å²	52	32%	0.319	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144.6	-178.9	53.9	0	0	0	0	111.5	V42 I43 Y51 I61	V42-T49 VanDerWaalsContact O-CA 3.25Å; V42-T49 WeakPolarHBondContact O-CA 3.4Å; I43-T49 HydrophobicContact CB-CG2 3.95Å; I43-T49 HydrophobicContact CD1-CG2 4Å; I43-T49 HydrophobicContact CG1-CG2 3.81Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.15Å; T49-Y51 PolarHBondContact OG1-OH 3.01Å; T49-I61 HydrophobicContact CG2-CB 4.4Å
50	N	92.9	Very high	89	Confident	83 Å²	83	49.1 Å²	49.1	44%	0.444	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.5	167.8	-63.4	61.4	0	0	0	108.5	W39 G41 V42 W44	W39-N50 HydrophobicContact CH2-CB 4.09Å; G41-N50 CarbonylContact C-O 3.57Å; G41-N50 WeakPolarHBondContact CA-O 3.42Å; V42-N50 HydrophobicContact CG1-CB 3.97Å; V42-N50 PolarHBondContact N-O 3.25Å; V42-N50 PolarHBondContact O-N 2.77Å; W44-N50 PolarHBondContact NE1-OD1 2.83Å
51	Y	92.1	Very high	89.1	Confident	51 Å²	51	49.4 Å²	49.4	20%	0.2	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.7	-178.3	-58.2	-84	0	0	0	110.1	T49 M56 L59 I61	T49-Y51 WeakPolarHBondContact OG1-CE2 3.15Å; T49-Y51 PolarHBondContact OG1-OH 3.01Å; Y51-M56 HydrophobicContact CD2-CG 4.31Å; Y51-M56 HydrophobicContact CG-CG 4.36Å; Y51-L59 HydrophobicContact CD1-CB 3.8Å; Y51-L59 HydrophobicContact CD1-CD1 4.41Å; Y51-L59 HydrophobicContact CE1-CB 4.01Å; Y51-I61 HydrophobicContact CD1-CD1 4.21Å; Y51-I61 HydrophobicContact CE1-CB 4.38Å; Y51-I61 HydrophobicContact CE1-CD1 3.89Å; Y51-I61 HydrophobicContact CE1-CG1 3.92Å; Y51-I61 PolarHBondContact OH-N 3.39Å
52	S	88.6	Confident	89.2	Confident	21 Å²	21	57.7 Å²	57.7	15%	0.147	36%	0.357	C	S	.	.			trans	-67.8	138.6	165.5	64.1	0	0	0	0	110.2	W39 L40 A54 L55 M56	W39-S52 WeakPolarHBondContact O-CB 3.36Å; W39-S52 PolarHBondContact O-OG 2.72Å; L40-S52 PolarHBondContact O-N 2.9Å; L40-S52 PolarHBondContact O-OG 3.1Å; S52-A54 PolarHBondContact O-N 3.15Å; S52-L55 PolarHBondContact O-N 3.09Å; S52-M56 WeakPolarHBondContact O-CB 3.42Å; S52-M56 PolarHBondContact O-N 2.83Å; S52-M56 VanDerWaalsContact O-N 3.1Å
53	S	75.6	Confident	89.2	Confident	119 Å²	119	59.9 Å²	59.9	83%	0.832	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-33.2	-176.3	50.6	0	0	0	0	113.3	L55	S53-L55 VanDerWaalsContact C-N 3.26Å; S53-L55 PolarHBondContact O-N 3.1Å
54	A	71.6	Confident	89.2	Confident	88 Å²	88	61.8 Å²	61.8	73%	0.727	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-23.4	-177.4	0	0	0	0	0	114	S52	S52-A54 PolarHBondContact O-N 3.15Å
55	L	71.1	Confident	89.2	Confident	11 Å²	11	62 Å²	62	6%	0.058	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	0.5	-170.4	-63.6	170.1	0	0	0	113.7	L40 S52 S53 S57 R58 L59	L40-L55 HydrophobicContact CD2-CD1 3.3Å; S52-L55 PolarHBondContact O-N 3.09Å; S53-L55 VanDerWaalsContact C-N 3.26Å; S53-L55 PolarHBondContact O-N 3.1Å; L55-S57 PolarHBondContact O-N 2.9Å; L55-R58 PolarHBondContact O-N 3.49Å; L55-L59 HydrophobicContact CB-CD1 3.5Å; L55-L59 HydrophobicContact CB-CG 3.84Å; L55-L59 HydrophobicContact CD1-CD1 4.41Å; L55-L59 WeakPolarHBondContact O-CG 3.42Å; L55-L59 PolarHBondContact O-N 2.84Å
56	M	73.4	Confident	89.2	Confident	119 Å²	119	65.9 Å²	65.9	59%	0.586	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-34.4	-173.4	-176.5	172.6	172.7	0	0	114.3	Y51 S52 R58	Y51-M56 HydrophobicContact CD2-CG 4.31Å; Y51-M56 HydrophobicContact CG-CG 4.36Å; S52-M56 WeakPolarHBondContact O-CB 3.42Å; S52-M56 PolarHBondContact O-N 2.83Å; S52-M56 VanDerWaalsContact O-N 3.1Å; M56-R58 VanDerWaalsContact C-N 3.32Å; M56-R58 PolarHBondContact O-N 3.33Å
57	S	84.6	Confident	89.3	Confident	118 Å²	118	66.6 Å²	66.6	83%	0.825	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-18.9	-179	61.3	0	0	0	0	114.4	L55	L55-S57 PolarHBondContact O-N 2.9Å
58	R	90.2	Very high	89.3	Confident	31 Å²	31	67 Å²	67	12%	0.117	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-13.6	-174	-61	-167.6	-61.7	126.6	0.1	113.7	L55 M56 M74 N75 S76 D81	L55-R58 PolarHBondContact O-N 3.49Å; M56-R58 VanDerWaalsContact C-N 3.32Å; M56-R58 PolarHBondContact O-N 3.33Å; R58-M74 WeakPolarHBondContact O-CA 3.41Å; R58-N75 PolarHBondContact O-N 2.93Å; R58-S76 PolarHBondContact NH1-O 2.88Å; R58-D81 IonicContact CZ-OD1 3.84Å; R58-D81 IonicContact CZ-OD2 3.45Å; R58-D81 IonicContact NH1-OD1 3.22Å; R58-D81 IonicContact NH1-OD2 2.72Å; R58-D81 PolarHBondContact NH1-OD2 2.85Å; R58-D81 IonicContact NH2-OD1 3.88Å; R58-D81 PolarHBondContact NH2-OD1 2.02Å; R58-D81 IonicContact NH2-OD2 2.81Å; R58-D81 PolarHBondContact NH2-OD2 3.43Å
59	L	91.5	Very high	89.4	Confident	13 Å²	13	65.9 Å²	65.9	7%	0.068	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	144.6	-175.1	-64.5	-179.2	0	0	0	112.6	L40 Y51 L55 L72 K73 M74	L40-L59 HydrophobicContact CB-CD1 4.07Å; L40-L59 HydrophobicContact CD2-CD1 4.4Å; Y51-L59 HydrophobicContact CD1-CB 3.8Å; Y51-L59 HydrophobicContact CD1-CD1 4.41Å; Y51-L59 HydrophobicContact CE1-CB 4.01Å; L55-L59 HydrophobicContact CB-CD1 3.5Å; L55-L59 HydrophobicContact CB-CG 3.84Å; L55-L59 HydrophobicContact CD1-CD1 4.41Å; L55-L59 WeakPolarHBondContact O-CG 3.42Å; L55-L59 PolarHBondContact O-N 2.84Å; L59-L72 HydrophobicContact CD2-CD1 4.13Å; L59-K73 CarbonylContact C-O 3.55Å; L59-K73 WeakPolarHBondContact CA-O 3.39Å; L59-M74 HydrophobicContact CD2-CB 4.14Å; L59-M74 HydrophobicContact CD2-CE 3.75Å; L59-M74 HydrophobicContact CD2-CG 3.37Å; L59-M74 HydrophobicContact CD2-SD 3.67Å
60	S	93.9	Very high	89.5	Confident	33 Å²	33	63.4 Å²	63.4	23%	0.231	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	127.7	164.4	-179.2	0	0	0	0	109.3	K73	S60-K73 PolarHBondContact N-O 2.87Å; S60-K73 PolarHBondContact O-N 2.87Å
61	I	95.8	Very high	89.7	Confident	7 Å²	7	62.3 Å²	62.3	4%	0.036	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134	175.2	-59.2	161.8	0	0	0	108.7	I43 T49 Y51 V70 F71 L72	I43-I61 HydrophobicContact CB-CG2 3.68Å; I43-I61 HydrophobicContact CD1-CG2 4.46Å; I43-I61 HydrophobicContact CG2-CG2 3.65Å; T49-I61 HydrophobicContact CG2-CB 4.4Å; Y51-I61 HydrophobicContact CD1-CD1 4.21Å; Y51-I61 HydrophobicContact CE1-CB 4.38Å; Y51-I61 HydrophobicContact CE1-CD1 3.89Å; Y51-I61 HydrophobicContact CE1-CG1 3.92Å; Y51-I61 PolarHBondContact OH-N 3.39Å; I61-V70 HydrophobicContact CG2-CG1 4.05Å; I61-F71 VanDerWaalsContact CA-O 3.31Å; I61-F71 WeakPolarHBondContact CA-O 3.33Å; I61-L72 HydrophobicContact CG1-CD1 3.84Å
62	R	95.8	Very high	89.8	Confident	174 Å²	174	59.9 Å²	59.9	66%	0.657	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	159.6	175.7	-64.5	-174.6	-180	-173.7	-3.6	110.1	V70 F71	R62-V70 CarbonylContact O-C 3.38Å; R62-V70 WeakPolarHBondContact O-CA 3.01Å; R62-V70 WeakPolarHBondContact O-CG1 3.37Å; R62-F71 HydrophobicContact CB-CB 4.48Å; R62-F71 PolarHBondContact N-O 2.78Å; R62-F71 PolarHBondContact O-N 3.02Å
63	K	95.9	Very high	90.1	Very high	45 Å²	45	63.5 Å²	63.5	20%	0.196	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	149.4	171.3	70	-176.5	-172.8	178.7	0	111.4	L21 I43 W44 A45 N65 H69 V70	L21-K63 HydrophobicContact CB-CD 4.45Å; L21-K63 HydrophobicContact CD1-CB 4.33Å; L21-K63 PolarHBondContact O-NZ 2.76Å; I43-K63 HydrophobicContact CD1-CB 3.96Å; I43-K63 HydrophobicContact CD1-CD 3.92Å; I43-K63 HydrophobicContact CD1-CG 3.69Å; I43-K63 HydrophobicContact CG1-CD 4.12Å; I43-K63 HydrophobicContact CG1-CG 4.44Å; W44-K63 PolarHBondContact O-NZ 3.05Å; A45-K63 VanDerWaalsContact C-NZ 3.29Å; A45-K63 PolarHBondContact O-NZ 2.82Å; K63-N65 WeakPolarHBondContact CD-OD1 3.33Å; K63-N65 WeakPolarHBondContact CE-OD1 3.42Å; K63-H69 CarbonylContact C-O 3.49Å; K63-H69 VanDerWaalsContact CA-O 3.31Å; K63-H69 WeakPolarHBondContact CA-O 3.4Å; K63-V70 HydrophobicContact CB-CG2 4.26Å
64	D	95.8	Very high	90.9	Very high	50 Å²	50	57.9 Å²	57.9	27%	0.267	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	100.8	171	177	-0.9	0	0	0	107.5	S66 N67 S68 H69 F71	D64-S66 VanDerWaalsContact C-N 3.26Å; D64-S66 PolarHBondContact O-N 3.38Å; D64-S66 WeakPolarHBondContact OD1-CB 3.33Å; D64-S66 PolarHBondContact OD1-N 3.32Å; D64-N67 PolarHBondContact O-N 2.89Å; D64-N67 PolarHBondContact OD1-N 2.92Å; D64-N67 PolarHBondContact OD2-ND2 3.13Å; D64-S68 PolarHBondContact O-N 3.05Å; D64-H69 HydrophobicContact CB-CB 4.37Å; D64-H69 PolarHBondContact N-O 2.63Å; D64-H69 PolarHBondContact O-N 3.02Å; D64-F71 HydrophobicContact CB-CE2 3.9Å
65	N	94.2	Very high	91.8	Very high	69 Å²	69	56.4 Å²	56.4	37%	0.369	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-32.4	-177.1	-64.3	-15.1	0	0	0	111.7	L21 T22 K63 N67 S68	L21-N65 VanDerWaalsContact CB-OD1 3.31Å; L21-N65 WeakPolarHBondContact CB-OD1 3.47Å; T22-N65 HydrophobicContact CG2-CB 4.36Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.46Å; K63-N65 WeakPolarHBondContact CD-OD1 3.33Å; K63-N65 WeakPolarHBondContact CE-OD1 3.42Å; N65-N67 VanDerWaalsContact C-N 3.32Å; N65-N67 PolarHBondContact O-N 2.85Å; N65-S68 PolarHBondContact O-N 3.24Å
66	S	93.5	Very high	92.7	Very high	114 Å²	114	59.1 Å²	59.1	80%	0.797	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-37.2	-176.6	-58.9	0	0	0	0	111.6	D64	D64-S66 VanDerWaalsContact C-N 3.26Å; D64-S66 PolarHBondContact O-N 3.38Å; D64-S66 WeakPolarHBondContact OD1-CB 3.33Å; D64-S66 PolarHBondContact OD1-N 3.32Å
67	N	94.8	Very high	93.4	Very high	95 Å²	95	53.6 Å²	53.6	51%	0.508	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	3.1	178.4	-67.1	-69	0	0	0	113.3	D64 N65 H69	D64-N67 PolarHBondContact O-N 2.89Å; D64-N67 PolarHBondContact OD1-N 2.92Å; D64-N67 PolarHBondContact OD2-ND2 3.13Å; N65-N67 VanDerWaalsContact C-N 3.32Å; N65-N67 PolarHBondContact O-N 2.85Å; N67-H69 PolarHBondContact O-CD2 2.91Å; N67-H69 PolarHBondContact O-N 3.47Å; N67-H69 PolarHBondContact O-NE2 2.81Å
68	S	94.9	Very high	93.7	Very high	41 Å²	41	52.8 Å²	52.8	29%	0.287	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	40.2	-174.3	-60.7	0	0	0	0	112.6	V16 D64 N65	V16-S68 WeakPolarHBondContact CG2-O 3.49Å; V16-S68 PolarHBondContact N-O 3.37Å; D64-S68 PolarHBondContact O-N 3.05Å; N65-S68 PolarHBondContact O-N 3.24Å
69	H	96.4	Very high	93.6	Very high	50 Å²	50	54.8 Å²	54.8	23%	0.231	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	138.8	-178.5	-70.2	169.7	0	0	0	111.5	T13 C14 T15 K63 D64 N67 F71	T13-H69 HydrophobicContact CG2-CB 4.08Å; C14-H69 CarbonylContact O-C 3.51Å; C14-H69 WeakPolarHBondContact O-CA 3.4Å; T15-H69 PolarHBondContact OG1-CD2 3.12Å; T15-H69 VanDerWaalsContact OG1-CD2 3.24Å; T15-H69 PolarHBondContact OG1-NE2 2.9Å; T15-H69 VanDerWaalsContact OG1-NE2 3.11Å; K63-H69 CarbonylContact C-O 3.49Å; K63-H69 VanDerWaalsContact CA-O 3.31Å; K63-H69 WeakPolarHBondContact CA-O 3.4Å; D64-H69 HydrophobicContact CB-CB 4.37Å; D64-H69 PolarHBondContact N-O 2.63Å; D64-H69 PolarHBondContact O-N 3.02Å; N67-H69 PolarHBondContact O-CD2 2.91Å; N67-H69 PolarHBondContact O-N 3.47Å; N67-H69 PolarHBondContact O-NE2 2.81Å; H69-F71 HydrophobicContact CB-CD2 4.47Å; H69-F71 HydrophobicContact CB-CE1 4.32Å; H69-F71 HydrophobicContact CB-CE2 3.63Å; H69-F71 HydrophobicContact CB-CZ 3.55Å; H69-F71 AromaticContact ND1-CZ 3.97Å
70	V	96.8	Very high	93.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132	167.3	-174.3	0	0	0	0	108.1	C14 V16 L21 V26 W28 I43 I61 R62 K63	C14-V70 HydrophobicContact CB-CB 4.46Å; C14-V70 PolarHBondContact N-O 2.91Å; C14-V70 PolarHBondContact O-N 3.17Å; V16-V70 HydrophobicContact CG1-CG2 4.39Å; L21-V70 HydrophobicContact CD1-CG2 3.86Å; L21-V70 HydrophobicContact CD2-CG2 3.59Å; L21-V70 HydrophobicContact CG-CG2 4.41Å; V26-V70 HydrophobicContact CB-CG1 4.35Å; V26-V70 HydrophobicContact CB-CG2 4.03Å; V26-V70 HydrophobicContact CG1-CB 4.35Å; V26-V70 HydrophobicContact CG1-CG1 4.23Å; V26-V70 HydrophobicContact CG1-CG2 4.17Å; V26-V70 HydrophobicContact CG2-CG2 3.92Å; W28-V70 HydrophobicContact CZ2-CG1 4.36Å; I43-V70 HydrophobicContact CG2-CG1 3.84Å; I61-V70 HydrophobicContact CG2-CG1 4.05Å; R62-V70 CarbonylContact O-C 3.38Å; R62-V70 WeakPolarHBondContact O-CA 3.01Å; R62-V70 WeakPolarHBondContact O-CG1 3.37Å; K63-V70 HydrophobicContact CB-CG2 4.26Å
71	F	96.3	Very high	93.3	Very high	60 Å²	60	58.2 Å²	58.2	26%	0.263	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.9	-175.9	-55.7	-87.2	0	0	0	109.9	I12 T13 I61 R62 D64 H69	I12-F71 CarbonylContact O-C 3.54Å; I12-F71 VanDerWaalsContact O-CA 3.32Å; I12-F71 WeakPolarHBondContact O-CA 3.49Å; T13-F71 HydrophobicContact CG2-CD1 3.98Å; T13-F71 HydrophobicContact CG2-CE1 3.62Å; T13-F71 HydrophobicContact CG2-CZ 4.28Å; T13-F71 VanDerWaalsContact OG1-CD1 3.31Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.4Å; T13-F71 VanDerWaalsContact OG1-CE1 3.31Å; T13-F71 WeakPolarHBondContact OG1-CE1 3.35Å; I61-F71 VanDerWaalsContact CA-O 3.31Å; I61-F71 WeakPolarHBondContact CA-O 3.33Å; R62-F71 HydrophobicContact CB-CB 4.48Å; R62-F71 PolarHBondContact N-O 2.78Å; R62-F71 PolarHBondContact O-N 3.02Å; D64-F71 HydrophobicContact CB-CE2 3.9Å; H69-F71 HydrophobicContact CB-CD2 4.47Å; H69-F71 HydrophobicContact CB-CE1 4.32Å; H69-F71 HydrophobicContact CB-CE2 3.63Å; H69-F71 HydrophobicContact CB-CZ 3.55Å; H69-F71 AromaticContact ND1-CZ 3.97Å
72	L	95.5	Very high	93.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.7	165.1	178.1	68.5	0	0	0	108.5	S11 I12 W28 L40 L59 I61 M74 Y85	S11-L72 CarbonylContact C-O 3.55Å; S11-L72 WeakPolarHBondContact CA-O 3.25Å; I12-L72 HydrophobicContact CB-CB 4.49Å; I12-L72 HydrophobicContact CD1-CD2 4.38Å; I12-L72 PolarHBondContact N-O 2.75Å; I12-L72 PolarHBondContact O-N 2.91Å; W28-L72 HydrophobicContact CB-CD1 4.38Å; W28-L72 HydrophobicContact CB-CD2 4.37Å; W28-L72 HydrophobicContact CD2-CB 3.63Å; W28-L72 HydrophobicContact CD2-CD1 4.46Å; W28-L72 HydrophobicContact CD2-CD2 3.91Å; W28-L72 HydrophobicContact CD2-CG 4.21Å; W28-L72 HydrophobicContact CE3-CB 3.95Å; W28-L72 HydrophobicContact CE3-CD2 3.73Å; W28-L72 HydrophobicContact CE3-CG 4.43Å; W28-L72 HydrophobicContact CG-CB 4.13Å; W28-L72 HydrophobicContact CG-CD1 4.12Å; W28-L72 HydrophobicContact CG-CD2 4.2Å; W28-L72 HydrophobicContact CG-CG 4.39Å; W28-L72 HydrophobicContact CH2-CB 4.04Å; W28-L72 HydrophobicContact CZ2-CB 3.73Å; W28-L72 HydrophobicContact CZ3-CB 4.15Å; W28-L72 HydrophobicContact CZ3-CD2 4.31Å; L40-L72 HydrophobicContact CD1-CD2 3.81Å; L59-L72 HydrophobicContact CD2-CD1 4.13Å; I61-L72 HydrophobicContact CG1-CD1 3.84Å; L72-M74 HydrophobicContact CD2-CG 4.41Å; L72-M74 HydrophobicContact CD2-SD 4.32Å; L72-M74 HydrophobicContact CG-CG 4.19Å; L72-Y85 HydrophobicContact CD2-CD1 3.75Å; L72-Y85 HydrophobicContact CD2-CE1 4.17Å
73	K	94.1	Very high	93.2	Very high	97 Å²	97	51.3 Å²	51.3	42%	0.422	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.3	172.1	-171.2	177.8	-176	-179	0	109.5	T9 L10 L59 S60 N75	T9-K73 HydrophobicContact CG2-CD 4.25Å; T9-K73 HydrophobicContact CG2-CG 3.86Å; L10-K73 CarbonylContact O-C 3.51Å; L10-K73 VanDerWaalsContact O-CA 3.32Å; L10-K73 WeakPolarHBondContact O-CA 3.25Å; L59-K73 CarbonylContact C-O 3.55Å; L59-K73 WeakPolarHBondContact CA-O 3.39Å; S60-K73 PolarHBondContact N-O 2.87Å; S60-K73 PolarHBondContact O-N 2.87Å; K73-N75 WeakPolarHBondContact CE-OD1 3.43Å
74	M	92.1	Very high	93.2	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.5	173.2	-49.8	-165.1	39.3	0	0	109.6	T9 L10 R58 L59 L72 L77 D81 Y85	T9-M74 CarbonylContact C-O 3.58Å; T9-M74 VanDerWaalsContact CA-O 3.3Å; T9-M74 WeakPolarHBondContact CA-O 3.3Å; L10-M74 HydrophobicContact CB-CB 4.31Å; L10-M74 HydrophobicContact CD2-CG 4.49Å; L10-M74 HydrophobicContact CD2-SD 4.38Å; L10-M74 PolarHBondContact N-O 3.29Å; L10-M74 PolarHBondContact O-N 2.81Å; R58-M74 WeakPolarHBondContact O-CA 3.41Å; L59-M74 HydrophobicContact CD2-CB 4.14Å; L59-M74 HydrophobicContact CD2-CE 3.75Å; L59-M74 HydrophobicContact CD2-CG 3.37Å; L59-M74 HydrophobicContact CD2-SD 3.67Å; L72-M74 HydrophobicContact CD2-CG 4.41Å; L72-M74 HydrophobicContact CD2-SD 4.32Å; L72-M74 HydrophobicContact CG-CG 4.19Å; M74-L77 HydrophobicContact CB-CD2 3.98Å; M74-L77 HydrophobicContact CE-CD2 4.33Å; M74-D81 HydrophobicContact CE-CB 4.24Å; M74-Y85 HydrophobicContact SD-CE1 3.52Å; M74-Y85 VanDerWaalsContact SD-CE1 3.52Å
75	N	91.1	Very high	93.2	Very high	57 Å²	57	49.5 Å²	49.5	31%	0.305	27%	0.273	S	S	.	.			trans	-95.9	156.6	175.1	-56.1	-45.5	0	0	0	110.5	T9 R58 K73 L77	T9-N75 WeakPolarHBondContact CG2-OD1 3.19Å; T9-N75 PolarHBondContact OG1-OD1 2.9Å; R58-N75 PolarHBondContact O-N 2.93Å; K73-N75 WeakPolarHBondContact CE-OD1 3.43Å; N75-L77 PolarHBondContact O-N 2.81Å
76	S	89.3	Confident	93.2	Very high	68 Å²	68	48.3 Å²	48.3	48%	0.476	26%	0.264	S	S	.	.	S	Bend	trans	53.2	57	174.2	-55.5	0	0	0	0	112.3	Q8 R58	Q8-S76 PolarHBondContact O-N 3.02Å; R58-S76 PolarHBondContact NH1-O 2.88Å
77	L	89.3	Confident	93.3	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	23%	0.231	C	C	.	.			trans	-56.8	142.3	179.8	-70.7	171.3	0	0	0	112.2	V4 P6 S7 Q8 L10 M74 N75 D81 V107	V4-L77 HydrophobicContact CB-CD1 3.94Å; V4-L77 HydrophobicContact CG1-CD1 3.63Å; V4-L77 HydrophobicContact CG2-CD1 4.39Å; P6-L77 WeakPolarHBondContact CA-O 3.16Å; S7-L77 PolarHBondContact N-O 2.86Å; Q8-L77 WeakPolarHBondContact O-CG 3.48Å; Q8-L77 PolarHBondContact O-N 2.97Å; Q8-L77 VanDerWaalsContact O-N 3.13Å; L10-L77 HydrophobicContact CB-CD1 3.71Å; L10-L77 HydrophobicContact CB-CD2 3.91Å; L10-L77 HydrophobicContact CB-CG 4.17Å; L10-L77 HydrophobicContact CD2-CD2 4.2Å; M74-L77 HydrophobicContact CB-CD2 3.98Å; M74-L77 HydrophobicContact CE-CD2 4.33Å; N75-L77 PolarHBondContact O-N 2.81Å; L77-D81 WeakPolarHBondContact CA-OD2 3.31Å; L77-D81 HydrophobicContact CD2-CB 4.05Å; L77-V107 HydrophobicContact CB-CG1 4.27Å; L77-V107 HydrophobicContact CB-CG2 4.25Å; L77-V107 HydrophobicContact CD1-CG2 4.23Å
78	Q	90.1	Very high	93.3	Very high	101 Å²	101	39.2 Å²	39.2	47%	0.472	21%	0.208	S	C	.	.			trans	-117.2	159.4	175.2	-62.1	176.9	-4	0	0	109.1	D80 D81 V107	Q78-D80 PolarHBondContact O-N 2.88Å; Q78-D81 PolarHBondContact N-OD2 2.77Å; Q78-D81 VanDerWaalsContact O-CB 3.3Å; Q78-D81 WeakPolarHBondContact O-CB 3.36Å; Q78-D81 PolarHBondContact O-N 2.86Å; Q78-V107 WeakPolarHBondContact O-CB 3.31Å; Q78-V107 WeakPolarHBondContact O-CG1 3.45Å
79	T	88.9	Confident	93.2	Very high	73 Å²	73	39.2 Å²	39.2	45%	0.448	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-54.3	-35.2	175.8	46	0	0	0	0	112.1	D81 T82	T79-D81 PolarHBondContact O-N 2.89Å; T79-T82 VanDerWaalsContact O-CB 3.25Å; T79-T82 WeakPolarHBondContact O-CB 3Å; T79-T82 PolarHBondContact O-N 3.13Å; T79-T82 PolarHBondContact O-OG1 2.82Å
80	D	88.8	Confident	92.8	Very high	118 Å²	118	38 Å²	38	63%	0.631	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-69.2	-10.8	178.5	-67	9.9	0	0	0	113.6	Q78	Q78-D80 PolarHBondContact O-N 2.88Å
81	D	90.7	Very high	92	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-82.7	0.9	171.5	-59.4	-43.5	0	0	0	112.2	R30 R58 M74 L77 Q78 T79 A83 Y85 V107	R30-D81 IonicContact NH1-OD1 3.32Å; R30-D81 PolarHBondContact NH1-OD1 3.39Å; R58-D81 IonicContact CZ-OD1 3.84Å; R58-D81 IonicContact CZ-OD2 3.45Å; R58-D81 IonicContact NH1-OD1 3.22Å; R58-D81 IonicContact NH1-OD2 2.72Å; R58-D81 PolarHBondContact NH1-OD2 2.85Å; R58-D81 IonicContact NH2-OD1 3.88Å; R58-D81 PolarHBondContact NH2-OD1 2.02Å; R58-D81 IonicContact NH2-OD2 2.81Å; R58-D81 PolarHBondContact NH2-OD2 3.43Å; M74-D81 HydrophobicContact CE-CB 4.24Å; L77-D81 WeakPolarHBondContact CA-OD2 3.31Å; L77-D81 HydrophobicContact CD2-CB 4.05Å; Q78-D81 PolarHBondContact N-OD2 2.77Å; Q78-D81 VanDerWaalsContact O-CB 3.3Å; Q78-D81 WeakPolarHBondContact O-CB 3.36Å; Q78-D81 PolarHBondContact O-N 2.86Å; T79-D81 PolarHBondContact O-N 2.89Å; D81-A83 PolarHBondContact O-N 2.68Å; D81-Y85 WeakPolarHBondContact O-CE2 3.47Å; D81-Y85 PolarHBondContact O-OH 3.46Å; D81-V107 HydrophobicContact CB-CG2 4.48Å
82	T	93.5	Very high	90.6	Very high	33 Å²	33	44 Å²	44	20%	0.202	23%	0.228	C	C	.	.			trans	-64	113.3	170.3	-64.6	0	0	0	0	110.4	P33 T79 V105 T106 V107	P33-T82 WeakPolarHBondContact CD-O 3.22Å; P33-T82 HydrophobicContact CG-CG2 4.47Å; T79-T82 VanDerWaalsContact O-CB 3.25Å; T79-T82 WeakPolarHBondContact O-CB 3Å; T79-T82 PolarHBondContact O-N 3.13Å; T79-T82 PolarHBondContact O-OG1 2.82Å; T82-V105 WeakPolarHBondContact CA-O 3.44Å; T82-T106 HydrophobicContact CG2-CG2 4.39Å; T82-V107 PolarHBondContact OG1-N 2.78Å; T82-V107 PolarHBondContact OG1-O 3.23Å
83	A	94.8	Very high	89.3	Confident	3 Å²	3	51 Å²	51	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	167.2	-175.7	0	0	0	0	0	111.6	R30 Q31 P32 D81 Y85 V105	R30-A83 HydrophobicContact CB-CB 3.92Å; R30-A83 HydrophobicContact CG-CB 4.4Å; Q31-A83 WeakPolarHBondContact O-CA 3.2Å; Q31-A83 WeakPolarHBondContact O-CB 3.13Å; P32-A83 HydrophobicContact CG-CB 4.41Å; D81-A83 PolarHBondContact O-N 2.68Å; A83-Y85 HydrophobicContact CB-CD2 4.3Å; A83-Y85 HydrophobicContact CB-CE2 3.81Å; A83-Y85 WeakPolarHBondContact O-CD2 3.31Å; A83-V105 PolarHBondContact N-O 3.35Å; A83-V105 VanDerWaalsContact N-O 3.1Å; A83-V105 PolarHBondContact O-N 2.9Å
84	M	96.1	Very high	88	Confident	56 Å²	56	55.3 Å²	55.3	28%	0.276	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	130.7	157.5	-72.3	-65.3	-62.7	0	0	109.5	R30 Q31 Y86 T103 S104	R30-M84 CarbonylContact C-O 3.49Å; R30-M84 WeakPolarHBondContact CA-O 3.32Å; Q31-M84 PolarHBondContact N-O 3.05Å; Q31-M84 PolarHBondContact O-N 2.62Å; M84-Y86 HydrophobicContact CB-CD2 4.42Å; M84-Y86 HydrophobicContact CB-CE2 3.43Å; M84-Y86 VanDerWaalsContact CB-CE2 3.43Å; M84-Y86 VanDerWaalsContact CB-OH 3.27Å; M84-Y86 WeakPolarHBondContact CB-OH 3.43Å; M84-Y86 HydrophobicContact CE-CE1 4.36Å; M84-T103 WeakPolarHBondContact CA-O 3.36Å; M84-S104 WeakPolarHBondContact SD-CA 3.46Å; M84-S104 WeakPolarHBondContact SD-CB 3.39Å; M84-S104 PolarHBondContact SD-N 2.87Å
85	Y	95.4	Very high	87	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.1	180	-72.1	-99	0	0	0	110.7	I12 V29 R30 L40 L72 M74 D81 A83 G102 T103 V105	I12-Y85 VanDerWaalsContact CD1-CB 3.48Å; I12-Y85 HydrophobicContact CD1-CD1 3.83Å; I12-Y85 HydrophobicContact CD1-CD2 3.94Å; I12-Y85 HydrophobicContact CD1-CG 3.46Å; I12-Y85 VanDerWaalsContact CD1-CG 3.46Å; V29-Y85 CarbonylContact O-C 3.58Å; R30-Y85 HydrophobicContact CB-CD1 3.88Å; R30-Y85 HydrophobicContact CB-CE1 3.81Å; R30-Y85 HydrophobicContact CB-CG 4.34Å; L40-Y85 HydrophobicContact CD1-CD1 3.87Å; L40-Y85 HydrophobicContact CD1-CE1 3.78Å; L72-Y85 HydrophobicContact CD2-CD1 3.75Å; L72-Y85 HydrophobicContact CD2-CE1 4.17Å; M74-Y85 HydrophobicContact SD-CE1 3.52Å; M74-Y85 VanDerWaalsContact SD-CE1 3.52Å; D81-Y85 WeakPolarHBondContact O-CE2 3.47Å; D81-Y85 PolarHBondContact O-OH 3.46Å; A83-Y85 HydrophobicContact CB-CD2 4.3Å; A83-Y85 HydrophobicContact CB-CE2 3.81Å; A83-Y85 WeakPolarHBondContact O-CD2 3.31Å; Y85-G102 CarbonylContact O-C 3.57Å; Y85-G102 WeakPolarHBondContact O-CA 3.48Å; Y85-T103 PolarHBondContact N-O 3.45Å; Y85-T103 PolarHBondContact O-N 2.89Å; Y85-V105 HydrophobicContact CD2-CB 3.99Å; Y85-V105 HydrophobicContact CD2-CG2 3.71Å; Y85-V105 HydrophobicContact CE2-CB 3.8Å; Y85-V105 HydrophobicContact CE2-CG2 3.96Å
86	Y	95.4	Very high	86.5	Confident	44 Å²	44	57.7 Å²	57.7	17%	0.173	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.1	-176.3	-55	-88	0	0	0	110.3	W28 V29 Q31 M84 W99	W28-Y86 WeakPolarHBondContact CA-O 3.3Å; W28-Y86 VanDerWaalsContact CE3-O 3.31Å; V29-Y86 PolarHBondContact N-O 2.93Å; V29-Y86 PolarHBondContact O-N 3.11Å; Q31-Y86 HydrophobicContact CB-CE2 4.02Å; M84-Y86 HydrophobicContact CB-CD2 4.42Å; M84-Y86 HydrophobicContact CB-CE2 3.43Å; M84-Y86 VanDerWaalsContact CB-CE2 3.43Å; M84-Y86 VanDerWaalsContact CB-OH 3.27Å; M84-Y86 WeakPolarHBondContact CB-OH 3.43Å; M84-Y86 HydrophobicContact CE-CE1 4.36Å; Y86-W99 HydrophobicContact CG-CE3 4.17Å; Y86-W99 HydrophobicContact CG-CZ3 4.36Å
87	C	95.1	Very high	86.1	Confident	16 Å²	16	57.9 Å²	57.9	11%	0.108	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.8	161.5	55.3	0	0	0	0	109.2	C14 V26 H27 W28 G100	C14-C87 HydrophobicContact CB-CB 3.49Å; C14-C87 VanDerWaalsContact CB-CB 3.49Å; C14-C87 WeakPolarHBondContact CB-SG 3.01Å; C14-C87 WeakPolarHBondContact SG-CB 3.3Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 3.45Å; V26-C87 HydrophobicContact CG1-CB 3.92Å; H27-C87 CarbonylContact O-C 3.6Å; H27-C87 WeakPolarHBondContact O-CA 3.47Å; W28-C87 HydrophobicContact CD2-CB 4.45Å; W28-C87 HydrophobicContact CE3-CB 4.34Å; W28-C87 HydrophobicContact CH2-CB 4.24Å; W28-C87 HydrophobicContact CZ2-CB 4.32Å; W28-C87 HydrophobicContact CZ3-CB 4.24Å; C87-G100 PolarHBondContact O-N 3.45Å
88	A	94.2	Very high	85.9	Confident	2 Å²	2	60.3 Å²	60.3	2%	0.017	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	140.7	177.9	0	0	0	0	0	110.7	V26 H27 M96 S98 W99	V26-A88 CarbonylContact C-O 3.6Å; V26-A88 VanDerWaalsContact CA-O 3.31Å; V26-A88 WeakPolarHBondContact CA-O 3.43Å; H27-A88 HydrophobicContact CB-CB 4.42Å; H27-A88 PolarHBondContact N-O 3.07Å; H27-A88 PolarHBondContact O-N 3.24Å; A88-M96 HydrophobicContact CB-CB 3.99Å; A88-M96 HydrophobicContact CB-CG 4.13Å; A88-M96 HydrophobicContact CB-SD 4.03Å; A88-S98 CarbonylContact C-O 3.41Å; A88-S98 WeakPolarHBondContact CA-O 3.44Å; A88-W99 HydrophobicContact CB-CD2 3.91Å; A88-W99 HydrophobicContact CB-CE3 4.27Å; A88-W99 HydrophobicContact CB-CG 4.21Å; A88-W99 HydrophobicContact CB-CZ2 4.41Å
89	R	93	Very high	85.9	Confident	40 Å²	40	61 Å²	61	15%	0.151	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138	173.4	179.7	177.3	68.6	176.9	6.6	110.1	F19 Y24 W91 M96 D97 S98	F19-R89 HydrophobicContact CD1-CG 4.39Å; F19-R89 HydrophobicContact CD2-CG 4.31Å; F19-R89 HydrophobicContact CE1-CB 3.96Å; F19-R89 HydrophobicContact CE1-CG 4.18Å; F19-R89 HydrophobicContact CE2-CB 4.42Å; F19-R89 HydrophobicContact CE2-CG 4.09Å; F19-R89 HydrophobicContact CG-CG 4.44Å; F19-R89 HydrophobicContact CZ-CB 3.86Å; F19-R89 HydrophobicContact CZ-CG 4Å; Y24-R89 HydrophobicContact CD1-CG 4.41Å; Y24-R89 HydrophobicContact CG-CG 4.35Å; R89-W91 VanDerWaalsContact NH1-CZ3 3.33Å; R89-W91 VanDerWaalsContact NH2-CE3 3.32Å; R89-W91 VanDerWaalsContact NH2-CZ3 3.35Å; R89-M96 WeakPolarHBondContact O-CA 3.4Å; R89-D97 IonicContact CZ-OD1 3.42Å; R89-D97 IonicContact CZ-OD2 3.6Å; R89-D97 IonicContact NE-OD1 2.91Å; R89-D97 PolarHBondContact NE-OD1 3.03Å; R89-D97 IonicContact NE-OD2 3.82Å; R89-D97 IonicContact NH2-OD1 3.12Å; R89-D97 PolarHBondContact NH2-OD1 3.46Å; R89-D97 VanDerWaalsContact NH2-OD1 3.12Å; R89-D97 IonicContact NH2-OD2 2.63Å; R89-D97 PolarHBondContact NH2-OD2 3.4Å; R89-S98 PolarHBondContact N-O 3.27Å
90	D	88.1	Confident	86	Confident	25 Å²	25	58.8 Å²	58.8	13%	0.134	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	126.1	164.8	-178.2	56	0	0	0	110	Y24 G25 H27 W44	Y24-D90 WeakPolarHBondContact CD1-O 3.43Å; G25-D90 WeakPolarHBondContact O-CB 3.45Å; G25-D90 PolarHBondContact O-N 3.04Å; H27-D90 WeakPolarHBondContact NE2-CB 3.48Å; H27-D90 IonicContact NE2-OD1 3.15Å; H27-D90 PolarHBondContact NE2-OD1 2.75Å; H27-D90 VanDerWaalsContact NE2-OD1 3.15Å; W44-D90 WeakPolarHBondContact CZ3-OD2 3.19Å
91	W	79.7	Confident	86.1	Confident	88 Å²	88	62.1 Å²	62.1	33%	0.333	31%	0.313	S	S	.	.			trans	-116.3	168.5	176.3	-160	-110.8	0	0	0	111.7	Y24 R89 D93 Y94 A95 D97	Y24-W91 AromaticContact CD1-CE3 3.9Å; Y24-W91 HydrophobicContact CD1-CE3 3.9Å; Y24-W91 AromaticContact CD1-CZ3 3.99Å; Y24-W91 HydrophobicContact CD1-CZ3 3.99Å; Y24-W91 HydrophobicContact CE1-CD2 4.46Å; Y24-W91 AromaticContact CE1-CE3 3.38Å; Y24-W91 HydrophobicContact CE1-CE3 3.38Å; Y24-W91 HydrophobicContact CE1-CH2 4.05Å; Y24-W91 AromaticContact CE1-CZ3 3.13Å; Y24-W91 HydrophobicContact CE1-CZ3 3.13Å; Y24-W91 HydrophobicContact CE2-CZ3 4.34Å; Y24-W91 AromaticContact CZ-CZ3 3.35Å; Y24-W91 WeakPolarHBondContact OH-CH2 3.31Å; Y24-W91 VanDerWaalsContact OH-CZ3 3.3Å; Y24-W91 WeakPolarHBondContact OH-CZ3 3.32Å; R89-W91 VanDerWaalsContact NH1-CZ3 3.33Å; R89-W91 VanDerWaalsContact NH2-CE3 3.32Å; R89-W91 VanDerWaalsContact NH2-CZ3 3.35Å; W91-D93 PolarHBondContact O-N 3.24Å; W91-Y94 PolarHBondContact O-N 2.79Å; W91-Y94 VanDerWaalsContact O-N 3.1Å; W91-A95 VanDerWaalsContact CB-O 3.31Å; W91-A95 WeakPolarHBondContact CB-O 3.31Å; W91-A95 PolarHBondContact N-O 2.97Å; W91-D97 HydrophobicContact CB-CB 4.33Å; W91-D97 VanDerWaalsContact CD2-OD2 3.3Å; W91-D97 VanDerWaalsContact CG-OD2 3.28Å
92	V	67.3	Low	86.1	Confident	99 Å²	99	63.2 Å²	63.2	60%	0.6	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-52.7	135.9	176.8	-172.2	0	0	0	0	109.2
93	D	68.9	Low	86.2	Confident	146 Å²	146	62.9 Å²	62.9	78%	0.781	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	71.6	24	-173.3	-51.1	-42.9	0	0	0	116.5	W91 A95	W91-D93 PolarHBondContact O-N 3.24Å; D93-A95 PolarHBondContact O-N 3.22Å
94	Y	66.1	Low	86.2	Confident	188 Å²	188	65.8 Å²	65.8	74%	0.737	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	65	21.7	177.1	-50.7	-79.4	0	0	0	114.4	W44 W91	W44-Y94 HydrophobicContact CH2-CD1 4.37Å; W44-Y94 HydrophobicContact CH2-CE1 4.33Å; W91-Y94 PolarHBondContact O-N 2.79Å; W91-Y94 VanDerWaalsContact O-N 3.1Å
95	A	72.5	Confident	86	Confident	47 Å²	47	63.2 Å²	63.2	39%	0.388	33%	0.331	S	S	.	.			trans	-81	139.1	176	0	0	0	0	0	111.2	W91 D93	W91-A95 VanDerWaalsContact CB-O 3.31Å; W91-A95 WeakPolarHBondContact CB-O 3.31Å; W91-A95 PolarHBondContact N-O 2.97Å; D93-A95 PolarHBondContact O-N 3.22Å
96	M	80.5	Confident	85.8	Confident	59 Å²	59	66 Å²	66	29%	0.291	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	90.4	171.1	-64.3	-178.9	-158.7	0	0	109.5	H27 V29 A88 R89 W99	H27-M96 HydrophobicContact CB-CE 3.92Å; H27-M96 HydrophobicContact CB-SD 4.08Å; V29-M96 HydrophobicContact CG2-CE 4.5Å; V29-M96 HydrophobicContact CG2-SD 4.03Å; A88-M96 HydrophobicContact CB-CB 3.99Å; A88-M96 HydrophobicContact CB-CG 4.13Å; A88-M96 HydrophobicContact CB-SD 4.03Å; R89-M96 WeakPolarHBondContact O-CA 3.4Å; M96-W99 HydrophobicContact CB-CZ2 3.91Å; M96-W99 HydrophobicContact CG-CZ2 4.5Å; M96-W99 PolarHBondContact O-NE1 3.32Å; M96-W99 HydrophobicContact SD-CH2 4.09Å; M96-W99 HydrophobicContact SD-CZ2 3.75Å
97	D	79.8	Confident	85.5	Confident	73 Å²	73	64.1 Å²	64.1	39%	0.39	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-18.4	-168.8	70.3	-15.7	0	0	0	114.4	R89 W91	R89-D97 IonicContact CZ-OD1 3.42Å; R89-D97 IonicContact CZ-OD2 3.6Å; R89-D97 IonicContact NE-OD1 2.91Å; R89-D97 PolarHBondContact NE-OD1 3.03Å; R89-D97 IonicContact NE-OD2 3.82Å; R89-D97 IonicContact NH2-OD1 3.12Å; R89-D97 PolarHBondContact NH2-OD1 3.46Å; R89-D97 VanDerWaalsContact NH2-OD1 3.12Å; R89-D97 IonicContact NH2-OD2 2.63Å; R89-D97 PolarHBondContact NH2-OD2 3.4Å; W91-D97 HydrophobicContact CB-CB 4.33Å; W91-D97 VanDerWaalsContact CD2-OD2 3.3Å; W91-D97 VanDerWaalsContact CG-OD2 3.28Å
98	S	84.6	Confident	84.9	Confident	54 Å²	54	65.7 Å²	65.7	38%	0.378	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.8	178.6	-176.1	0	0	0	0	111	A88 R89	A88-S98 CarbonylContact C-O 3.41Å; A88-S98 WeakPolarHBondContact CA-O 3.44Å; R89-S98 PolarHBondContact N-O 3.27Å
99	W	91.2	Very high	83.8	Confident	115 Å²	115	73.3 Å²	73.3	44%	0.436	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.9	-175.9	-69.3	68.2	0	0	0	111	V29 Y86 A88 M96	V29-W99 HydrophobicContact CB-CH2 4.06Å; V29-W99 HydrophobicContact CB-CZ3 3.81Å; V29-W99 HydrophobicContact CG1-CH2 3.96Å; V29-W99 HydrophobicContact CG1-CZ3 3.9Å; V29-W99 HydrophobicContact CG2-CH2 3.77Å; V29-W99 HydrophobicContact CG2-CZ3 3.95Å; Y86-W99 HydrophobicContact CG-CE3 4.17Å; Y86-W99 HydrophobicContact CG-CZ3 4.36Å; A88-W99 HydrophobicContact CB-CD2 3.91Å; A88-W99 HydrophobicContact CB-CE3 4.27Å; A88-W99 HydrophobicContact CB-CG 4.21Å; A88-W99 HydrophobicContact CB-CZ2 4.41Å; M96-W99 HydrophobicContact CB-CZ2 3.91Å; M96-W99 HydrophobicContact CG-CZ2 4.5Å; M96-W99 PolarHBondContact O-NE1 3.32Å; M96-W99 HydrophobicContact SD-CH2 4.09Å; M96-W99 HydrophobicContact SD-CZ2 3.75Å
100	G	90	Very high	83.4	Confident	27 Å²	27	75 Å²	75	28%	0.278	42%	0.418	S	S	.	.			trans	-68.7	161.8	169.5	0	0	0	0	0	112	C87 G102	C87-G100 PolarHBondContact O-N 3.45Å; G100-G102 PolarHBondContact O-N 3.41Å
101	Q	90.9	Very high	83.1	Confident	187 Å²	187	77.6 Å²	77.6	87%	0.874	43%	0.433	S	S	*	.			trans	-60.9	-15.9	179.8	-66.7	-64.4	-45.5	0	0	114.1
102	G	92.1	Very high	83.3	Confident	25 Å²	25	77.1 Å²	77.1	26%	0.258	44%	0.439	S	S	.	.			trans	86	163.8	-179.2	0	0	0	0	0	113.2	Y85 G100	Y85-G102 CarbonylContact O-C 3.57Å; Y85-G102 WeakPolarHBondContact O-CA 3.48Å; G100-G102 PolarHBondContact O-N 3.41Å
103	T	94.4	Very high	84.3	Confident	25 Å²	25	75.8 Å²	75.8	15%	0.153	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	117.6	-179.5	-79.4	0	0	0	0	108.8	P1 I12 M84 Y85 V105	P1-T103 HydrophobicContact CB-CG2 3.47Å; P1-T103 VanDerWaalsContact CB-CG2 3.47Å; P1-T103 HydrophobicContact CG-CG2 3.34Å; I12-T103 HydrophobicContact CD1-CG2 4.2Å; I12-T103 HydrophobicContact CG1-CG2 4.26Å; I12-T103 HydrophobicContact CG2-CG2 4.14Å; M84-T103 WeakPolarHBondContact CA-O 3.36Å; Y85-T103 PolarHBondContact N-O 3.45Å; Y85-T103 PolarHBondContact O-N 2.89Å; T103-V105 HydrophobicContact CG2-CG2 3.93Å
104	S	94.1	Very high	85.2	Confident	65 Å²	65	71.4 Å²	71.4	46%	0.455	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.6	173.4	-167	0	0	0	0	110.1	M84	M84-S104 WeakPolarHBondContact SD-CA 3.46Å; M84-S104 WeakPolarHBondContact SD-CB 3.39Å; M84-S104 PolarHBondContact SD-N 2.87Å
105	V	92.3	Very high	86.5	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128	172.4	-178.8	0	0	0	0	108.7	V4 L10 I12 T82 A83 Y85 T103 V107	V4-V105 HydrophobicContact CG2-CG1 3.89Å; L10-V105 HydrophobicContact CD1-CG1 4.31Å; L10-V105 HydrophobicContact CD1-CG2 4.19Å; L10-V105 HydrophobicContact CD2-CB 4.49Å; L10-V105 HydrophobicContact CD2-CG1 3.97Å; L10-V105 HydrophobicContact CD2-CG2 4.01Å; I12-V105 HydrophobicContact CD1-CG2 4.11Å; T82-V105 WeakPolarHBondContact CA-O 3.44Å; A83-V105 PolarHBondContact N-O 3.35Å; A83-V105 VanDerWaalsContact N-O 3.1Å; A83-V105 PolarHBondContact O-N 2.9Å; Y85-V105 HydrophobicContact CD2-CB 3.99Å; Y85-V105 HydrophobicContact CD2-CG2 3.71Å; Y85-V105 HydrophobicContact CE2-CB 3.8Å; Y85-V105 HydrophobicContact CE2-CG2 3.96Å; T103-V105 HydrophobicContact CG2-CG2 3.93Å; V105-V107 HydrophobicContact CG1-CG2 4.3Å
106	T	92.2	Very high	87.5	Confident	59 Å²	59	64.8 Å²	64.8	36%	0.362	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.6	175.9	-54.1	0	0	0	0	108.8	L3 V4 T82	L3-T106 WeakPolarHBondContact CA-O 3.4Å; L3-T106 HydrophobicContact CD1-CG2 3.87Å; V4-T106 PolarHBondContact N-O 3.06Å; T82-T106 HydrophobicContact CG2-CG2 4.39Å
107	V	88.1	Confident	88	Confident	6 Å²	6	65.2 Å²	65.2	4%	0.036	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.6	175	-173.8	0	0	0	0	108.2	V4 P6 L77 Q78 D81 T82 V105	V4-V107 WeakPolarHBondContact O-CA 3.31Å; P6-V107 HydrophobicContact CG-CG1 4.29Å; L77-V107 HydrophobicContact CB-CG1 4.27Å; L77-V107 HydrophobicContact CB-CG2 4.25Å; L77-V107 HydrophobicContact CD1-CG2 4.23Å; Q78-V107 WeakPolarHBondContact O-CB 3.31Å; Q78-V107 WeakPolarHBondContact O-CG1 3.45Å; D81-V107 HydrophobicContact CB-CG2 4.48Å; T82-V107 PolarHBondContact OG1-N 2.78Å; T82-V107 PolarHBondContact OG1-O 3.23Å; V105-V107 HydrophobicContact CG1-CG2 4.3Å
108	S	83.7	Confident	88.7	Confident	48 Å²	48	64.6 Å²	64.6	34%	0.336	39%	0.393	S	S	.	.			trans	-128	141.4	179.8	66.9	0	0	0	0	110.8	L3 V4 P6	L3-S108 WeakPolarHBondContact CD1-OG 3.42Å; V4-S108 PolarHBondContact O-N 2.73Å; P6-S108 WeakPolarHBondContact CD-O 3.44Å
109	S	71.3	Confident	89.1	Confident	163 Å²	163	65.5 Å²	65.5	100%	1.14	39%	0.394	S	S	*	.			trans	-67.9	0	171.2	53.7	0	0	0	0	112.9

Retrieved 109 of 109 residues in 70.1 ms (Link to these results)

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