X5J4Q7_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4Q7, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 115 aa.

						>X5J4Q7_MOUSE|X5J4Q7
PGLVAPSQSLSITCTVSGFSLTSYGVSWVRQPPGKGLEWLGVIWGDGSTNYHSALISRLSISKDNSKSQVFLKLNSLQTDDTATYYCAKSYDYDVGFAYWGQGTLVTVSAESQSF
					

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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	51.5	Low	75.7	Confident	154 Å²	154	70.1 Å²	70.1	100%	1	45%	0.451	S	S	*	.				0	122.4	0	-1.2	22.5	0	0	0	109.5	L105	P1-L105 WeakPolarHBondContact CB-O 3.33Å
2	G	64	Low	77.1	Confident	45 Å²	45	65.1 Å²	65.1	46%	0.464	42%	0.418	S	S	.	.			trans	-111	138.7	-169.4	0	0	0	0	0	112.4
3	L	70.1	Confident	78.5	Confident	113 Å²	113	65.4 Å²	65.4	59%	0.592	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	128.7	160.3	-172.5	69.2	0	0	0	107.6	T107 S109	L3-T107 HydrophobicContact CD1-CG2 4.12Å; L3-S109 WeakPolarHBondContact CD1-OG 3.39Å
4	V	72.6	Confident	79.6	Confident	14 Å²	14	61.5 Å²	61.5	9%	0.085	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.1	-178.9	-164.7	0	0	0	0	109.8	Q8 L10 L77 T107 V108	V4-Q8 HydrophobicContact CG1-CB 3.78Å; V4-Q8 VanDerWaalsContact CG1-OE1 3.27Å; V4-L10 HydrophobicContact CG2-CD1 4.38Å; V4-L77 HydrophobicContact CB-CD1 3.86Å; V4-L77 HydrophobicContact CG1-CD1 3.3Å; V4-T107 PolarHBondContact N-O 3.28Å; V4-T107 VanDerWaalsContact N-O 3.1Å; V4-V108 WeakPolarHBondContact O-CA 3.44Å
5	A	76.9	Confident	80.6	Confident	21 Å²	21	63.6 Å²	63.6	17%	0.174	41%	0.405	C	S	.	.			trans	-75.9	153.6	177.6	0	0	0	0	0	111.3	Q8	A5-Q8 HydrophobicContact CB-CG 4.26Å; A5-Q8 WeakPolarHBondContact O-CB 3.48Å; A5-Q8 PolarHBondContact O-N 3.48Å
6	P	72.3	Confident	81.2	Confident	47 Å²	47	60.5 Å²	60.5	31%	0.305	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	152.4	172.2	-23.3	33.7	0	0	0	111.8	Q8 L77 V108 S109 A110	P6-Q8 PolarHBondContact O-N 3.04Å; P6-Q8 VanDerWaalsContact O-N 3.09Å; P6-L77 WeakPolarHBondContact CA-O 3.35Å; P6-V108 HydrophobicContact CG-CG1 4.39Å; P6-S109 WeakPolarHBondContact CD-O 3.21Å; P6-A110 HydrophobicContact CG-CB 4.24Å
7	S	76.6	Confident	81.7	Confident	101 Å²	101	63.2 Å²	63.2	71%	0.706	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	-6.4	-178.2	-51.8	0	0	0	0	116.2	L77	S7-L77 PolarHBondContact N-O 2.83Å
8	Q	82.7	Confident	81.9	Confident	105 Å²	105	64.6 Å²	64.6	49%	0.491	43%	0.434	S	S	.	.			trans	-75.2	169.3	169	-66	-171.1	-17.3	0	0	111.3	V4 A5 P6 S76 L77	V4-Q8 HydrophobicContact CG1-CB 3.78Å; V4-Q8 VanDerWaalsContact CG1-OE1 3.27Å; A5-Q8 HydrophobicContact CB-CG 4.26Å; A5-Q8 WeakPolarHBondContact O-CB 3.48Å; A5-Q8 PolarHBondContact O-N 3.48Å; P6-Q8 PolarHBondContact O-N 3.04Å; P6-Q8 VanDerWaalsContact O-N 3.09Å; Q8-S76 PolarHBondContact O-N 2.89Å; Q8-L77 HydrophobicContact CB-CD1 4.49Å; Q8-L77 VanDerWaalsContact O-CG 3.31Å; Q8-L77 WeakPolarHBondContact O-CG 3.3Å; Q8-L77 PolarHBondContact O-N 3.04Å; Q8-L77 VanDerWaalsContact O-N 3.09Å
9	S	86.1	Confident	82.2	Confident	68 Å²	68	63.1 Å²	63.1	48%	0.476	42%	0.42	S	S	.	.			trans	-105	138.8	172.2	-56.1	0	0	0	0	109.8	L74 N75	S9-L74 CarbonylContact C-O 3.59Å; S9-L74 VanDerWaalsContact CA-O 3.28Å; S9-L74 WeakPolarHBondContact CA-O 3.13Å; S9-N75 PolarHBondContact OG-OD1 2.82Å
10	L	87.8	Confident	82.5	Confident	29 Å²	29	62.5 Å²	62.5	15%	0.152	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.8	172.4	171.8	67.4	0	0	0	109.7	V4 I12 K73 L74 L77 V106	V4-L10 HydrophobicContact CG2-CD1 4.38Å; L10-I12 HydrophobicContact CD1-CG1 4.27Å; L10-I12 HydrophobicContact CD2-CD1 3.82Å; L10-I12 HydrophobicContact CD2-CG1 3.77Å; L10-I12 HydrophobicContact CG-CD1 4.42Å; L10-I12 HydrophobicContact CG-CG1 3.82Å; L10-K73 CarbonylContact O-C 3.6Å; L10-K73 VanDerWaalsContact O-CA 3.3Å; L10-K73 WeakPolarHBondContact O-CA 3.45Å; L10-L74 PolarHBondContact N-O 3.28Å; L10-L74 PolarHBondContact O-N 3.26Å; L10-L77 HydrophobicContact CB-CD1 3.85Å; L10-L77 HydrophobicContact CB-CD2 4.14Å; L10-L77 HydrophobicContact CB-CG 4.42Å; L10-V106 HydrophobicContact CD2-CB 4.18Å; L10-V106 HydrophobicContact CD2-CG1 3.48Å; L10-V106 VanDerWaalsContact CD2-CG1 3.48Å; L10-V106 HydrophobicContact CD2-CG2 3.66Å
11	S	91.7	Very high	83	Confident	74 Å²	74	59.7 Å²	59.7	52%	0.517	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.7	167.3	-169.5	0	0	0	0	109.2	L72	S11-L72 CarbonylContact C-O 3.43Å; S11-L72 WeakPolarHBondContact CA-O 3.34Å
12	I	93.3	Very high	84.9	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.051	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.9	176.1	-47.6	-177.7	0	0	0	108.1	L10 W28 F71 L72 Y85 V106	L10-I12 HydrophobicContact CD1-CG1 4.27Å; L10-I12 HydrophobicContact CD2-CD1 3.82Å; L10-I12 HydrophobicContact CD2-CG1 3.77Å; L10-I12 HydrophobicContact CG-CD1 4.42Å; L10-I12 HydrophobicContact CG-CG1 3.82Å; I12-W28 HydrophobicContact CB-CH2 4.05Å; I12-W28 HydrophobicContact CB-CZ3 4.19Å; I12-W28 HydrophobicContact CG2-CH2 3.79Å; I12-W28 HydrophobicContact CG2-CZ3 3.8Å; I12-F71 CarbonylContact O-C 3.57Å; I12-F71 WeakPolarHBondContact O-CA 3.19Å; I12-L72 HydrophobicContact CB-CB 4.33Å; I12-L72 HydrophobicContact CD1-CD2 4.24Å; I12-L72 PolarHBondContact N-O 3.32Å; I12-L72 PolarHBondContact O-N 2.78Å; I12-Y85 HydrophobicContact CD1-CD1 3.72Å; I12-Y85 HydrophobicContact CD1-CD2 3.82Å; I12-Y85 HydrophobicContact CD1-CE1 4.39Å; I12-Y85 HydrophobicContact CD1-CG 3.39Å; I12-V106 HydrophobicContact CD1-CG2 3.91Å
13	T	95.1	Very high	86	Confident	69 Å²	69	58 Å²	58	42%	0.423	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.9	177.1	-54.9	0	0	0	0	109.9	Q69 F71	T13-Q69 HydrophobicContact CG2-CB 4.21Å; T13-Q69 HydrophobicContact CG2-CG 3.96Å; T13-F71 HydrophobicContact CG2-CD1 3.94Å; T13-F71 HydrophobicContact CG2-CE1 3.6Å; T13-F71 HydrophobicContact CG2-CZ 4.43Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.39Å
14	C	94.1	Very high	86.9	Confident	11 Å²	11	56.8 Å²	56.8	7%	0.074	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	116.6	167.3	174.2	0	0	0	0	109.2	W28 Q69 V70 C87	C14-W28 HydrophobicContact CB-CH2 3.58Å; C14-W28 HydrophobicContact CB-CZ2 3.74Å; C14-W28 HydrophobicContact CB-CZ3 4.45Å; C14-Q69 CarbonylContact O-C 3.56Å; C14-Q69 WeakPolarHBondContact O-CA 3.39Å; C14-V70 PolarHBondContact N-O 2.87Å; C14-V70 PolarHBondContact O-N 2.76Å; C14-C87 HydrophobicContact CB-CB 3.45Å; C14-C87 VanDerWaalsContact CB-CB 3.45Å; C14-C87 WeakPolarHBondContact CB-SG 3.41Å; C14-C87 WeakPolarHBondContact SG-CB 3.32Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 3.36Å
15	T	94.3	Very high	87.8	Confident	93 Å²	93	56.2 Å²	56.2	57%	0.571	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.8	169.9	-53.9	0	0	0	0	108.3	S68 Q69	T15-S68 WeakPolarHBondContact CA-O 3.28Å; T15-Q69 HydrophobicContact CG2-CG 4.43Å; T15-Q69 PolarHBondContact OG1-NE2 3.08Å
16	V	90.3	Very high	88.5	Confident	14 Å²	14	55.3 Å²	55.3	9%	0.085	36%	0.357	C	S	.	.			trans	-96.1	148.7	178.8	-56.8	0	0	0	0	111	F19 L21 V26 S68	V16-F19 HydrophobicContact CB-CE1 3.88Å; V16-F19 HydrophobicContact CB-CE2 4.25Å; V16-F19 HydrophobicContact CB-CZ 3.64Å; V16-F19 HydrophobicContact CG1-CE1 4.23Å; V16-F19 HydrophobicContact CG1-CE2 4.33Å; V16-F19 HydrophobicContact CG1-CZ 3.63Å; V16-F19 HydrophobicContact CG2-CE2 4.19Å; V16-F19 HydrophobicContact CG2-CZ 4.09Å; V16-L21 HydrophobicContact CB-CD2 4.44Å; V16-L21 HydrophobicContact CG1-CD2 4.14Å; V16-L21 HydrophobicContact CG2-CD1 4.16Å; V16-L21 HydrophobicContact CG2-CD2 3.5Å; V16-L21 HydrophobicContact CG2-CG 3.66Å; V16-V26 HydrophobicContact CG1-CG2 4.12Å; V16-S68 WeakPolarHBondContact CG2-O 3.36Å; V16-S68 PolarHBondContact N-O 2.87Å
17	S	88.9	Confident	89.5	Confident	107 Å²	107	53.1 Å²	53.1	75%	0.748	34%	0.343	S	S	*	.			trans	-138.6	155.1	172.7	62.6	0	0	0	0	109.7	F19	S17-F19 VanDerWaalsContact C-N 3.33Å; S17-F19 PolarHBondContact O-N 3.35Å
18	G	86.3	Confident	90.4	Very high	88 Å²	88	48.5 Å²	48.5	91%	0.907	31%	0.31	S	S	*	.	S	Bend	trans	81.3	1.9	178.6	0	0	0	0	0	115.9
19	F	86.4	Confident	90.8	Very high	35 Å²	35	43.7 Å²	43.7	15%	0.154	29%	0.287	C	S	.	.	S	Bend	trans	-156.8	161.6	170.6	65.3	-85.9	0	0	0	112.2	V16 S17 L21 Y24 V26 K89	V16-F19 HydrophobicContact CB-CE1 3.88Å; V16-F19 HydrophobicContact CB-CE2 4.25Å; V16-F19 HydrophobicContact CB-CZ 3.64Å; V16-F19 HydrophobicContact CG1-CE1 4.23Å; V16-F19 HydrophobicContact CG1-CE2 4.33Å; V16-F19 HydrophobicContact CG1-CZ 3.63Å; V16-F19 HydrophobicContact CG2-CE2 4.19Å; V16-F19 HydrophobicContact CG2-CZ 4.09Å; S17-F19 VanDerWaalsContact C-N 3.33Å; S17-F19 PolarHBondContact O-N 3.35Å; F19-L21 HydrophobicContact CE2-CD2 4.08Å; F19-Y24 HydrophobicContact CB-CD2 3.79Å; F19-Y24 HydrophobicContact CB-CE2 4.12Å; F19-Y24 AromaticContact CD2-CD2 4Å; F19-Y24 HydrophobicContact CD2-CD2 4Å; F19-Y24 HydrophobicContact CD2-CG 4.24Å; F19-Y24 HydrophobicContact CG-CD2 4.27Å; F19-V26 HydrophobicContact CE2-CG2 3.89Å; F19-V26 HydrophobicContact CZ-CG2 3.95Å; F19-K89 HydrophobicContact CD1-CD 3.89Å; F19-K89 HydrophobicContact CD1-CG 4.27Å; F19-K89 HydrophobicContact CD2-CD 4.47Å; F19-K89 HydrophobicContact CD2-CG 4.4Å; F19-K89 HydrophobicContact CE1-CB 4Å; F19-K89 HydrophobicContact CE1-CD 4.09Å; F19-K89 HydrophobicContact CE1-CG 4.02Å; F19-K89 HydrophobicContact CE2-CG 4.14Å; F19-K89 HydrophobicContact CG-CD 4.09Å; F19-K89 HydrophobicContact CG-CG 4.45Å; F19-K89 HydrophobicContact CZ-CB 4Å; F19-K89 HydrophobicContact CZ-CD 4.45Å; F19-K89 HydrophobicContact CZ-CG 3.93Å
20	S	89.7	Confident	91.2	Very high	52 Å²	52	41.3 Å²	41.3	36%	0.364	27%	0.268	S	S	.	.			trans	-89	134.2	174.7	-178.2	0	0	0	0	112	T22 S23 Y24	S20-T22 PolarHBondContact O-N 3.12Å; S20-T22 PolarHBondContact OG-N 3.29Å; S20-T22 PolarHBondContact OG-OG1 3.42Å; S20-S23 PolarHBondContact O-N 2.81Å; S20-S23 VanDerWaalsContact O-N 3.11Å; S20-Y24 PolarHBondContact O-N 2.96Å
21	L	91.7	Very high	91.5	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-10.1	172.9	-69.6	-177.4	0	0	0	114.1	V16 F19 V26 G45 K63 N65 Q69 V70	V16-L21 HydrophobicContact CB-CD2 4.44Å; V16-L21 HydrophobicContact CG1-CD2 4.14Å; V16-L21 HydrophobicContact CG2-CD1 4.16Å; V16-L21 HydrophobicContact CG2-CD2 3.5Å; V16-L21 HydrophobicContact CG2-CG 3.66Å; F19-L21 HydrophobicContact CE2-CD2 4.08Å; L21-V26 HydrophobicContact CD2-CG2 3.55Å; L21-G45 WeakPolarHBondContact O-CA 3.29Å; L21-K63 HydrophobicContact CB-CD 4.43Å; L21-K63 HydrophobicContact CD1-CB 4.38Å; L21-K63 PolarHBondContact O-NZ 3.16Å; L21-N65 WeakPolarHBondContact CB-OD1 3.3Å; L21-Q69 WeakPolarHBondContact CD1-O 3.31Å; L21-V70 HydrophobicContact CD1-CG2 3.89Å; L21-V70 HydrophobicContact CD2-CG2 3.59Å; L21-V70 HydrophobicContact CG-CG2 4.43Å
22	T	91.4	Very high	91.5	Very high	80 Å²	80	40.6 Å²	40.6	49%	0.491	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-19.1	172.3	57.3	0	0	0	0	112.7	S20 G45 N65	S20-T22 PolarHBondContact O-N 3.12Å; S20-T22 PolarHBondContact OG-N 3.29Å; S20-T22 PolarHBondContact OG-OG1 3.42Å; T22-G45 CarbonylContact O-C 3.53Å; T22-G45 WeakPolarHBondContact O-CA 3.48Å; T22-N65 HydrophobicContact CG2-CB 4.5Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.37Å
23	S	88.3	Confident	91.5	Very high	82 Å²	82	44.7 Å²	44.7	57%	0.573	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-20.2	-175	-52	0	0	0	0	113.4	S20	S20-S23 PolarHBondContact O-N 2.81Å; S20-S23 VanDerWaalsContact O-N 3.11Å
24	Y	88.3	Confident	91.3	Very high	88 Å²	88	45.9 Å²	45.9	35%	0.345	31%	0.31	S	S	.	.	S	Bend	trans	-136.1	153.7	-176	-62	-82.1	0	0	0	111.6	F19 S20 Y91	F19-Y24 HydrophobicContact CB-CD2 3.79Å; F19-Y24 HydrophobicContact CB-CE2 4.12Å; F19-Y24 AromaticContact CD2-CD2 4Å; F19-Y24 HydrophobicContact CD2-CD2 4Å; F19-Y24 HydrophobicContact CD2-CG 4.24Å; F19-Y24 HydrophobicContact CG-CD2 4.27Å; S20-Y24 PolarHBondContact O-N 2.96Å; Y24-Y91 AromaticContact CD1-CD1 3.91Å; Y24-Y91 HydrophobicContact CD1-CD1 3.91Å; Y24-Y91 AromaticContact CD1-CE1 3.83Å; Y24-Y91 HydrophobicContact CD1-CE1 3.83Å; Y24-Y91 AromaticContact CE1-CD1 3.72Å; Y24-Y91 HydrophobicContact CE1-CD1 3.72Å; Y24-Y91 AromaticContact CE1-CE1 3.42Å; Y24-Y91 HydrophobicContact CE1-CE1 3.42Å; Y24-Y91 VanDerWaalsContact CE1-CE1 3.42Å
25	G	91.1	Very high	91.2	Very high	2 Å²	2	52.1 Å²	52.1	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	158.5	171.6	0	0	0	0	0	112.6	I43 S90	G25-I43 CarbonylContact C-O 3.49Å; G25-I43 WeakPolarHBondContact CA-O 3.43Å; G25-S90 PolarHBondContact N-O 3.43Å; G25-S90 PolarHBondContact O-N 2.73Å
26	V	93.1	Very high	91.1	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.012	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	119	171.2	-179.9	0	0	0	0	108.9	V16 F19 L21 V42 I43 V70 C87 A88	V16-V26 HydrophobicContact CG1-CG2 4.12Å; F19-V26 HydrophobicContact CE2-CG2 3.89Å; F19-V26 HydrophobicContact CZ-CG2 3.95Å; L21-V26 HydrophobicContact CD2-CG2 3.55Å; V26-V42 WeakPolarHBondContact O-CA 3.25Å; V26-I43 PolarHBondContact N-O 2.71Å; V26-I43 PolarHBondContact O-N 3.46Å; V26-V70 HydrophobicContact CB-CG1 4.34Å; V26-V70 HydrophobicContact CB-CG2 3.93Å; V26-V70 HydrophobicContact CG1-CB 4.28Å; V26-V70 HydrophobicContact CG1-CG1 4.24Å; V26-V70 HydrophobicContact CG1-CG2 4.11Å; V26-V70 HydrophobicContact CG2-CG2 3.87Å; V26-C87 HydrophobicContact CG1-CB 4Å; V26-A88 CarbonylContact C-O 3.55Å; V26-A88 WeakPolarHBondContact CA-O 3.39Å
27	S	93.2	Very high	91.2	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.014	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	145.4	176.7	-78.5	0	0	0	0	110.9	W39 G41 V42 C87 A88 F97	S27-W39 PolarHBondContact OG-NE1 2.81Å; S27-G41 CarbonylContact C-O 3.55Å; S27-G41 WeakPolarHBondContact CA-O 3.49Å; S27-V42 WeakPolarHBondContact OG-CB 3.44Å; S27-V42 WeakPolarHBondContact OG-CG2 3.32Å; S27-C87 CarbonylContact O-C 3.58Å; S27-C87 VanDerWaalsContact O-CA 3.28Å; S27-C87 WeakPolarHBondContact O-CA 3.4Å; S27-A88 PolarHBondContact N-O 3.33Å; S27-A88 PolarHBondContact O-N 2.97Å; S27-F97 VanDerWaalsContact CB-CE1 3.42Å
28	W	93.8	Very high	91.3	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.015	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.8	168.2	-73	98.2	0	0	0	109.7	I12 C14 L40 G41 V70 L72 Y86 C87	I12-W28 HydrophobicContact CB-CH2 4.05Å; I12-W28 HydrophobicContact CB-CZ3 4.19Å; I12-W28 HydrophobicContact CG2-CH2 3.79Å; I12-W28 HydrophobicContact CG2-CZ3 3.8Å; C14-W28 HydrophobicContact CB-CH2 3.58Å; C14-W28 HydrophobicContact CB-CZ2 3.74Å; C14-W28 HydrophobicContact CB-CZ3 4.45Å; W28-L40 HydrophobicContact CB-CB 4.11Å; W28-L40 HydrophobicContact CB-CD1 4.36Å; W28-L40 WeakPolarHBondContact O-CB 3.44Å; W28-L40 PolarHBondContact O-N 3.18Å; W28-G41 PolarHBondContact N-O 3.17Å; W28-V70 HydrophobicContact CZ2-CG1 4.32Å; W28-L72 HydrophobicContact CB-CD1 4.14Å; W28-L72 HydrophobicContact CB-CD2 4.38Å; W28-L72 HydrophobicContact CD2-CB 3.69Å; W28-L72 HydrophobicContact CD2-CD1 4.33Å; W28-L72 HydrophobicContact CD2-CD2 4.05Å; W28-L72 HydrophobicContact CD2-CG 4.25Å; W28-L72 HydrophobicContact CE3-CB 4.05Å; W28-L72 HydrophobicContact CE3-CD2 3.94Å; W28-L72 HydrophobicContact CG-CB 4.14Å; W28-L72 HydrophobicContact CG-CD1 3.9Å; W28-L72 HydrophobicContact CG-CD2 4.25Å; W28-L72 HydrophobicContact CG-CG 4.34Å; W28-L72 HydrophobicContact CH2-CB 4.11Å; W28-L72 HydrophobicContact CZ2-CB 3.78Å; W28-L72 HydrophobicContact CZ3-CB 4.25Å; W28-Y86 WeakPolarHBondContact CA-O 3.3Å; W28-C87 HydrophobicContact CD2-CB 4.42Å; W28-C87 HydrophobicContact CE3-CB 4.21Å; W28-C87 HydrophobicContact CH2-CB 4.27Å; W28-C87 HydrophobicContact CZ2-CB 4.45Å; W28-C87 HydrophobicContact CZ3-CB 4.13Å
29	V	92.9	Very high	91.5	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.018	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	141.9	179.9	-178.4	0	0	0	0	107.4	L37 E38 Y85 Y86 F97 W100	V29-L37 HydrophobicContact CG1-CB 3.86Å; V29-L37 HydrophobicContact CG1-CD2 3.86Å; V29-L37 HydrophobicContact CG1-CG 4.36Å; V29-E38 CarbonylContact C-O 3.47Å; V29-E38 VanDerWaalsContact CA-O 3.31Å; V29-E38 WeakPolarHBondContact CA-O 3.35Å; V29-E38 WeakPolarHBondContact CG1-O 3.46Å; V29-Y85 CarbonylContact O-C 3.58Å; V29-Y86 PolarHBondContact N-O 2.82Å; V29-Y86 PolarHBondContact O-N 2.8Å; V29-F97 HydrophobicContact CG2-CZ 4.26Å; V29-W100 HydrophobicContact CB-CH2 3.97Å; V29-W100 HydrophobicContact CB-CZ3 3.75Å; V29-W100 HydrophobicContact CG1-CH2 3.92Å; V29-W100 HydrophobicContact CG1-CZ3 3.97Å; V29-W100 HydrophobicContact CG2-CH2 3.74Å; V29-W100 HydrophobicContact CG2-CZ3 3.91Å
30	R	93.3	Very high	91.8	Very high	19 Å²	19	49.9 Å²	49.9	7%	0.072	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	153.8	171	71.3	176.5	178.9	-175.3	2	111.5	E38 L40 D81 A83 T84 Y85	R30-E38 HydrophobicContact CG-CB 4.12Å; R30-E38 IonicContact CZ-OE2 2.87Å; R30-E38 VanDerWaalsContact CZ-OE2 3.26Å; R30-E38 PolarHBondContact N-O 3.24Å; R30-E38 IonicContact NE-OE2 3.35Å; R30-E38 PolarHBondContact NE-OE2 2.95Å; R30-E38 IonicContact NH2-OE1 3.99Å; R30-E38 PolarHBondContact NH2-OE1 3.09Å; R30-E38 IonicContact NH2-OE2 2.76Å; R30-E38 PolarHBondContact NH2-OE2 3.03Å; R30-E38 PolarHBondContact O-N 2.96Å; R30-L40 HydrophobicContact CB-CD1 4.1Å; R30-L40 HydrophobicContact CB-CG 4.42Å; R30-L40 HydrophobicContact CG-CD1 4.24Å; R30-L40 HydrophobicContact CG-CD2 3.81Å; R30-L40 HydrophobicContact CG-CG 4.17Å; R30-D81 IonicContact NH1-OD1 3.26Å; R30-D81 PolarHBondContact NH1-OD1 3.47Å; R30-A83 HydrophobicContact CB-CB 3.85Å; R30-A83 HydrophobicContact CG-CB 4.25Å; R30-T84 CarbonylContact C-O 3.55Å; R30-T84 VanDerWaalsContact CA-O 3.25Å; R30-T84 WeakPolarHBondContact CA-O 3.02Å; R30-Y85 HydrophobicContact CB-CD1 3.92Å; R30-Y85 HydrophobicContact CB-CE1 3.93Å; R30-Y85 HydrophobicContact CB-CG 4.3Å
31	Q	93.9	Very high	91.9	Very high	74 Å²	74	47.4 Å²	47.4	35%	0.346	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	101.9	171.4	-165.9	177.2	22.2	0	0	109.6	K35 L37 A83 T84 Y86	Q31-K35 WeakPolarHBondContact CG-O 3.39Å; Q31-K35 PolarHBondContact NE2-O 2.95Å; Q31-L37 HydrophobicContact CB-CD2 3.95Å; Q31-L37 HydrophobicContact CG-CD2 4.29Å; Q31-A83 WeakPolarHBondContact O-CA 3.24Å; Q31-A83 WeakPolarHBondContact O-CB 3.48Å; Q31-T84 PolarHBondContact N-O 3.08Å; Q31-T84 PolarHBondContact O-N 2.64Å; Q31-Y86 HydrophobicContact CB-CE2 3.87Å
32	P	93.3	Very high	92	Very high	13 Å²	13	47.3 Å²	47.3	8%	0.084	28%	0.28	C	S	.	.			trans	-65.5	150.9	170.6	-18.1	31.2	0	0	0	111	G34 K35 A83	P32-G34 PolarHBondContact O-N 2.93Å; P32-K35 HydrophobicContact CB-CB 4.06Å; P32-K35 HydrophobicContact CB-CD 3.96Å; P32-K35 HydrophobicContact CB-CG 4.19Å; P32-K35 HydrophobicContact CG-CB 4.28Å; P32-K35 HydrophobicContact CG-CD 4.21Å; P32-K35 PolarHBondContact O-N 3.22Å; P32-A83 HydrophobicContact CG-CB 4.39Å
33	P	91.5	Very high	92.1	Very high	97 Å²	97	44 Å²	44	63%	0.63	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	127.6	176.9	-25.3	34	0	0	0	112	K35 T82	P33-K35 PolarHBondContact O-N 2.91Å; P33-T82 VanDerWaalsContact CD-O 3.3Å; P33-T82 WeakPolarHBondContact CD-O 3.46Å; P33-T82 HydrophobicContact CG-CG2 4.4Å
34	G	92.8	Very high	92.4	Very high	94 Å²	94	41.4 Å²	41.4	97%	0.969	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.1	8.6	179.9	0	0	0	0	0	115.5	P32	P32-G34 PolarHBondContact O-N 2.93Å
35	K	91.9	Very high	92.5	Very high	141 Å²	141	38 Å²	38	61%	0.613	23%	0.228	S	C	*	.	S	Bend	trans	-117.1	166	177.5	-59.6	-170.2	-174.8	174.7	0	112	Q31 P32 P33	Q31-K35 WeakPolarHBondContact CG-O 3.39Å; Q31-K35 PolarHBondContact NE2-O 2.95Å; P32-K35 HydrophobicContact CB-CB 4.06Å; P32-K35 HydrophobicContact CB-CD 3.96Å; P32-K35 HydrophobicContact CB-CG 4.19Å; P32-K35 HydrophobicContact CG-CB 4.28Å; P32-K35 HydrophobicContact CG-CD 4.21Å; P32-K35 PolarHBondContact O-N 3.22Å; P33-K35 PolarHBondContact O-N 2.91Å
36	G	91.4	Very high	92.6	Very high	55 Å²	55	44.2 Å²	44.2	57%	0.567	26%	0.261	S	S	*	.			trans	-70.9	175.8	172.8	0	0	0	0	0	113.1
37	L	91.5	Very high	92.5	Very high	102 Å²	102	45.8 Å²	45.8	53%	0.534	28%	0.278	S	S	.	.			trans	-69	132.2	173.4	-67.9	171.1	0	0	0	110.5	V29 Q31 Y86 W100	V29-L37 HydrophobicContact CG1-CB 3.86Å; V29-L37 HydrophobicContact CG1-CD2 3.86Å; V29-L37 HydrophobicContact CG1-CG 4.36Å; Q31-L37 HydrophobicContact CB-CD2 3.95Å; Q31-L37 HydrophobicContact CG-CD2 4.29Å; L37-Y86 HydrophobicContact CD2-CD2 4.43Å; L37-Y86 HydrophobicContact CD2-CE2 4.35Å; L37-W100 HydrophobicContact CD1-CH2 4.02Å; L37-W100 HydrophobicContact CD1-CZ2 4.49Å
38	E	91.3	Very high	92.5	Very high	50 Å²	50	48.2 Å²	48.2	23%	0.234	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.3	176.4	-175.2	-174.4	-179.4	0	0	109.3	V29 R30 H52	V29-E38 CarbonylContact C-O 3.47Å; V29-E38 VanDerWaalsContact CA-O 3.31Å; V29-E38 WeakPolarHBondContact CA-O 3.35Å; V29-E38 WeakPolarHBondContact CG1-O 3.46Å; R30-E38 HydrophobicContact CG-CB 4.12Å; R30-E38 IonicContact CZ-OE2 2.87Å; R30-E38 VanDerWaalsContact CZ-OE2 3.26Å; R30-E38 PolarHBondContact N-O 3.24Å; R30-E38 IonicContact NE-OE2 3.35Å; R30-E38 PolarHBondContact NE-OE2 2.95Å; R30-E38 IonicContact NH2-OE1 3.99Å; R30-E38 PolarHBondContact NH2-OE1 3.09Å; R30-E38 IonicContact NH2-OE2 2.76Å; R30-E38 PolarHBondContact NH2-OE2 3.03Å; R30-E38 PolarHBondContact O-N 2.96Å; E38-H52 IonicContact OE1-CE1 3.96Å; E38-H52 IonicContact OE1-ND1 2.91Å
39	W	91.4	Very high	92.4	Very high	83 Å²	83	50.4 Å²	50.4	31%	0.314	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	133.1	174.8	178.9	84.1	0	0	0	110.4	S27 G41 V42 N50 H52	S27-W39 PolarHBondContact OG-NE1 2.81Å; W39-G41 VanDerWaalsContact CZ2-C 3.4Å; W39-G41 PolarHBondContact NE1-O 2.86Å; W39-V42 HydrophobicContact CZ2-CB 4Å; W39-V42 HydrophobicContact CZ2-CG1 3.84Å; W39-N50 HydrophobicContact CH2-CB 4Å; W39-N50 HydrophobicContact CZ2-CB 4.48Å; W39-H52 HydrophobicContact CE3-CB 4.08Å; W39-H52 HydrophobicContact CZ3-CB 4.23Å; W39-H52 VanDerWaalsContact O-CB 3.32Å; W39-H52 WeakPolarHBondContact O-CB 3.46Å
40	L	92.1	Very high	92.4	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-37.6	-176.3	-62.4	-176.3	0	0	0	112.7	W28 R30 H52 L55 L59 L72 Y85	W28-L40 HydrophobicContact CB-CB 4.11Å; W28-L40 HydrophobicContact CB-CD1 4.36Å; W28-L40 WeakPolarHBondContact O-CB 3.44Å; W28-L40 PolarHBondContact O-N 3.18Å; R30-L40 HydrophobicContact CB-CD1 4.1Å; R30-L40 HydrophobicContact CB-CG 4.42Å; R30-L40 HydrophobicContact CG-CD1 4.24Å; R30-L40 HydrophobicContact CG-CD2 3.81Å; R30-L40 HydrophobicContact CG-CG 4.17Å; L40-H52 PolarHBondContact O-N 3.19Å; L40-L55 HydrophobicContact CD2-CD1 3.35Å; L40-L59 HydrophobicContact CB-CD1 4.04Å; L40-L59 HydrophobicContact CD2-CD1 4.38Å; L40-L72 HydrophobicContact CD1-CD2 3.85Å; L40-Y85 HydrophobicContact CD1-CD1 3.8Å; L40-Y85 HydrophobicContact CD1-CE1 3.71Å
41	G	92.8	Very high	92.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	172.9	-174	0	0	0	0	0	112.2	S27 W28 W39 N50	S27-G41 CarbonylContact C-O 3.55Å; S27-G41 WeakPolarHBondContact CA-O 3.49Å; W28-G41 PolarHBondContact N-O 3.17Å; W39-G41 VanDerWaalsContact CZ2-C 3.4Å; W39-G41 PolarHBondContact NE1-O 2.86Å; G41-N50 CarbonylContact C-O 3.5Å; G41-N50 WeakPolarHBondContact CA-O 3.27Å
42	V	93	Very high	91.9	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	146.5	179	65.8	0	0	0	0	109.6	V26 S27 W39 W44 T49 N50	V26-V42 WeakPolarHBondContact O-CA 3.25Å; S27-V42 WeakPolarHBondContact OG-CB 3.44Å; S27-V42 WeakPolarHBondContact OG-CG2 3.32Å; W39-V42 HydrophobicContact CZ2-CB 4Å; W39-V42 HydrophobicContact CZ2-CG1 3.84Å; V42-W44 HydrophobicContact CG1-CD2 4.34Å; V42-W44 HydrophobicContact CG1-CZ2 3.76Å; V42-W44 HydrophobicContact CG2-CD2 4.11Å; V42-W44 HydrophobicContact CG2-CE3 4.28Å; V42-W44 HydrophobicContact CG2-CH2 4.33Å; V42-W44 HydrophobicContact CG2-CZ2 4.16Å; V42-W44 HydrophobicContact CG2-CZ3 4.38Å; V42-T49 VanDerWaalsContact O-CA 3.26Å; V42-T49 WeakPolarHBondContact O-CA 3.47Å; V42-N50 HydrophobicContact CG1-CB 3.91Å; V42-N50 PolarHBondContact N-O 2.85Å; V42-N50 PolarHBondContact O-N 3.14Å
43	I	94.3	Very high	91.3	Very high	11 Å²	11	59 Å²	59	6%	0.056	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.9	161.9	-172.2	163.4	0	0	0	109.1	G25 V26 S48 T49 I61 K63 V70	G25-I43 CarbonylContact C-O 3.49Å; G25-I43 WeakPolarHBondContact CA-O 3.43Å; V26-I43 PolarHBondContact N-O 2.71Å; V26-I43 PolarHBondContact O-N 3.46Å; I43-S48 WeakPolarHBondContact CA-O 3.4Å; I43-T49 HydrophobicContact CB-CG2 3.97Å; I43-T49 HydrophobicContact CD1-CG2 4.02Å; I43-T49 HydrophobicContact CG1-CG2 3.8Å; I43-I61 HydrophobicContact CB-CG2 3.7Å; I43-I61 HydrophobicContact CG2-CG2 3.66Å; I43-K63 HydrophobicContact CD1-CB 4.04Å; I43-K63 HydrophobicContact CD1-CD 3.87Å; I43-K63 HydrophobicContact CD1-CG 3.73Å; I43-K63 HydrophobicContact CG1-CD 4.09Å; I43-K63 HydrophobicContact CG1-CG 4.49Å; I43-V70 HydrophobicContact CG2-CG1 3.7Å
44	W	93.4	Very high	90.7	Very high	27 Å²	27	57.9 Å²	57.9	10%	0.102	36%	0.358	C	S	.	.			trans	-86.2	170.1	-176.7	-64.7	111.8	0	0	0	112.3	V42 D46 G47 S48 N50 K63	V42-W44 HydrophobicContact CG1-CD2 4.34Å; V42-W44 HydrophobicContact CG1-CZ2 3.76Å; V42-W44 HydrophobicContact CG2-CD2 4.11Å; V42-W44 HydrophobicContact CG2-CE3 4.28Å; V42-W44 HydrophobicContact CG2-CH2 4.33Å; V42-W44 HydrophobicContact CG2-CZ2 4.16Å; V42-W44 HydrophobicContact CG2-CZ3 4.38Å; W44-D46 VanDerWaalsContact C-N 3.27Å; W44-D46 VanDerWaalsContact CB-OD1 3.29Å; W44-D46 WeakPolarHBondContact CB-OD1 3.32Å; W44-D46 PolarHBondContact O-N 2.94Å; W44-G47 PolarHBondContact O-N 3.22Å; W44-S48 VanDerWaalsContact CD1-OG 3.23Å; W44-S48 PolarHBondContact N-O 3.05Å; W44-N50 PolarHBondContact NE1-ND2 3.36Å; W44-N50 VanDerWaalsContact NE1-ND2 3.2Å; W44-K63 PolarHBondContact O-NZ 2.81Å
45	G	91.4	Very high	90	Very high	17 Å²	17	53.9 Å²	53.9	18%	0.175	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-38.4	-179.6	0	0	0	0	0	113.4	L21 T22 G47 K63	L21-G45 WeakPolarHBondContact O-CA 3.29Å; T22-G45 CarbonylContact O-C 3.53Å; T22-G45 WeakPolarHBondContact O-CA 3.48Å; G45-G47 PolarHBondContact O-N 2.95Å; G45-K63 VanDerWaalsContact C-NZ 3.3Å; G45-K63 PolarHBondContact O-NZ 2.95Å
46	D	91.6	Very high	89.3	Confident	131 Å²	131	52 Å²	52	70%	0.701	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-9.7	175.9	68.2	-8.4	0	0	0	114.1	W44 S48	W44-D46 VanDerWaalsContact C-N 3.27Å; W44-D46 VanDerWaalsContact CB-OD1 3.29Å; W44-D46 WeakPolarHBondContact CB-OD1 3.32Å; W44-D46 PolarHBondContact O-N 2.94Å; D46-S48 WeakPolarHBondContact OD1-CB 3.42Å; D46-S48 PolarHBondContact OD1-N 2.94Å; D46-S48 PolarHBondContact OD1-OG 3.47Å; D46-S48 PolarHBondContact OD2-OG 3.05Å
47	G	91.8	Very high	89.1	Confident	36 Å²	36	54.4 Å²	54.4	37%	0.371	32%	0.318	S	S	.	.	S	Bend	trans	92.7	-1.5	-178.8	0	0	0	0	0	114.6	W44 G45	W44-G47 PolarHBondContact O-N 3.22Å; G45-G47 PolarHBondContact O-N 2.95Å
48	S	92.6	Very high	89	Confident	52 Å²	52	51 Å²	51	36%	0.364	30%	0.298	S	S	.	.			trans	-64.7	150.3	171.7	64.5	0	0	0	0	110.9	I43 W44 D46	I43-S48 WeakPolarHBondContact CA-O 3.4Å; W44-S48 VanDerWaalsContact CD1-OG 3.23Å; W44-S48 PolarHBondContact N-O 3.05Å; D46-S48 WeakPolarHBondContact OD1-CB 3.42Å; D46-S48 PolarHBondContact OD1-N 2.94Å; D46-S48 PolarHBondContact OD1-OG 3.47Å; D46-S48 PolarHBondContact OD2-OG 3.05Å
49	T	93.3	Very high	89	Confident	51 Å²	51	49.1 Å²	49.1	31%	0.313	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.3	-177.2	54	0	0	0	0	111.2	V42 I43 Y51	V42-T49 VanDerWaalsContact O-CA 3.26Å; V42-T49 WeakPolarHBondContact O-CA 3.47Å; I43-T49 HydrophobicContact CB-CG2 3.97Å; I43-T49 HydrophobicContact CD1-CG2 4.02Å; I43-T49 HydrophobicContact CG1-CG2 3.8Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.4Å; T49-Y51 PolarHBondContact OG1-OH 3.47Å
50	N	91.5	Very high	89	Confident	72 Å²	72	47.6 Å²	47.6	39%	0.385	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.6	167.4	-61.1	-38.8	0	0	0	108.9	W39 G41 V42 W44	W39-N50 HydrophobicContact CH2-CB 4Å; W39-N50 HydrophobicContact CZ2-CB 4.48Å; G41-N50 CarbonylContact C-O 3.5Å; G41-N50 WeakPolarHBondContact CA-O 3.27Å; V42-N50 HydrophobicContact CG1-CB 3.91Å; V42-N50 PolarHBondContact N-O 2.85Å; V42-N50 PolarHBondContact O-N 3.14Å; W44-N50 PolarHBondContact NE1-ND2 3.36Å; W44-N50 VanDerWaalsContact NE1-ND2 3.2Å
51	Y	90.4	Very high	89.2	Confident	55 Å²	55	47.9 Å²	47.9	22%	0.216	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	153.9	-177.7	-61.1	-85.4	0	0	0	111	T49 S53 I56 L59 I61	T49-Y51 WeakPolarHBondContact OG1-CE2 3.4Å; T49-Y51 PolarHBondContact OG1-OH 3.47Å; Y51-S53 PolarHBondContact O-N 3.47Å; Y51-I56 HydrophobicContact CD2-CD1 4.18Å; Y51-I56 HydrophobicContact CD2-CG1 4.01Å; Y51-I56 HydrophobicContact CG-CD1 4.49Å; Y51-I56 HydrophobicContact CG-CG1 4.04Å; Y51-L59 HydrophobicContact CD1-CB 4.11Å; Y51-L59 HydrophobicContact CE1-CB 4.33Å; Y51-I61 HydrophobicContact CD1-CD1 4.19Å; Y51-I61 HydrophobicContact CE1-CB 4.3Å; Y51-I61 HydrophobicContact CE1-CD1 3.91Å; Y51-I61 HydrophobicContact CE1-CG1 3.9Å; Y51-I61 PolarHBondContact OH-N 2.74Å
52	H	86.6	Confident	89.3	Confident	63 Å²	63	50.6 Å²	50.6	29%	0.292	31%	0.312	S	S	.	.			trans	-67.1	125.3	164.3	-169.7	-107.3	0	0	0	109.3	E38 W39 L40 A54 L55 I56	E38-H52 IonicContact OE1-CE1 3.96Å; E38-H52 IonicContact OE1-ND1 2.91Å; W39-H52 HydrophobicContact CE3-CB 4.08Å; W39-H52 HydrophobicContact CZ3-CB 4.23Å; W39-H52 VanDerWaalsContact O-CB 3.32Å; W39-H52 WeakPolarHBondContact O-CB 3.46Å; L40-H52 PolarHBondContact O-N 3.19Å; H52-A54 PolarHBondContact O-N 3.38Å; H52-A54 VanDerWaalsContact O-N 3.12Å; H52-L55 PolarHBondContact O-N 2.84Å; H52-I56 PolarHBondContact O-N 3Å
53	S	81.5	Confident	89.4	Confident	100 Å²	100	52.7 Å²	52.7	70%	0.699	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-34.2	-170.1	54.7	0	0	0	0	113.4	Y51 L55 I56	Y51-S53 PolarHBondContact O-N 3.47Å; S53-L55 PolarHBondContact O-N 2.82Å; S53-I56 WeakPolarHBondContact O-CG2 3.43Å
54	A	79.1	Confident	89.5	Confident	72 Å²	72	54 Å²	54	60%	0.595	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.6	179.3	0	0	0	0	0	114.2	H52	H52-A54 PolarHBondContact O-N 3.38Å; H52-A54 VanDerWaalsContact O-N 3.12Å
55	L	76.3	Confident	89.5	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.052	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-0.3	-170.9	-61.4	172.8	0	0	0	113.4	L40 H52 S53 S57 R58 L59	L40-L55 HydrophobicContact CD2-CD1 3.35Å; H52-L55 PolarHBondContact O-N 2.84Å; S53-L55 PolarHBondContact O-N 2.82Å; L55-S57 PolarHBondContact O-N 3.28Å; L55-S57 VanDerWaalsContact O-N 3.14Å; L55-R58 PolarHBondContact O-N 2.85Å; L55-L59 HydrophobicContact CB-CD1 3.38Å; L55-L59 HydrophobicContact CB-CG 3.98Å; L55-L59 HydrophobicContact CD1-CD1 4.08Å; L55-L59 HydrophobicContact CG-CD1 4.37Å; L55-L59 WeakPolarHBondContact O-CB 3.41Å; L55-L59 PolarHBondContact O-N 2.9Å
56	I	78.6	Confident	89.6	Confident	101 Å²	101	60.4 Å²	60.4	52%	0.518	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.7	-174.4	-163.3	166	0	0	0	113.8	Y51 H52 S53 R58	Y51-I56 HydrophobicContact CD2-CD1 4.18Å; Y51-I56 HydrophobicContact CD2-CG1 4.01Å; Y51-I56 HydrophobicContact CG-CD1 4.49Å; Y51-I56 HydrophobicContact CG-CG1 4.04Å; H52-I56 PolarHBondContact O-N 3Å; S53-I56 WeakPolarHBondContact O-CG2 3.43Å; I56-R58 VanDerWaalsContact C-N 3.31Å; I56-R58 PolarHBondContact O-N 2.81Å
57	S	85.9	Confident	89.7	Confident	106 Å²	106	60.1 Å²	60.1	74%	0.741	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-18.9	-180	58.9	0	0	0	0	113.8	L55	L55-S57 PolarHBondContact O-N 3.28Å; L55-S57 VanDerWaalsContact O-N 3.14Å
58	R	90.1	Very high	89.8	Confident	30 Å²	30	60.5 Å²	60.5	11%	0.113	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-19	-173.9	-60.5	-167	-59.9	127.3	2.8	113.3	L55 I56 L74 N75 S76 D81	L55-R58 PolarHBondContact O-N 2.85Å; I56-R58 VanDerWaalsContact C-N 3.31Å; I56-R58 PolarHBondContact O-N 2.81Å; R58-L74 HydrophobicContact CB-CD1 3.85Å; R58-L74 WeakPolarHBondContact O-CA 3.28Å; R58-N75 PolarHBondContact O-N 2.8Å; R58-S76 PolarHBondContact NH1-O 3.1Å; R58-D81 IonicContact CZ-OD1 3.79Å; R58-D81 IonicContact CZ-OD2 3.56Å; R58-D81 IonicContact NH1-OD1 3.67Å; R58-D81 IonicContact NH1-OD2 2.71Å; R58-D81 PolarHBondContact NH1-OD2 3.33Å; R58-D81 IonicContact NH2-OD1 2.95Å; R58-D81 PolarHBondContact NH2-OD1 2.71Å; R58-D81 IonicContact NH2-OD2 3.46Å; R58-D81 PolarHBondContact NH2-OD2 2.89Å
59	L	90.8	Very high	90	Very high	12 Å²	12	60.3 Å²	60.3	6%	0.063	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	144.5	-176.9	-74.2	175.6	0	0	0	112.9	L40 Y51 L55 L72 K73 L74	L40-L59 HydrophobicContact CB-CD1 4.04Å; L40-L59 HydrophobicContact CD2-CD1 4.38Å; Y51-L59 HydrophobicContact CD1-CB 4.11Å; Y51-L59 HydrophobicContact CE1-CB 4.33Å; L55-L59 HydrophobicContact CB-CD1 3.38Å; L55-L59 HydrophobicContact CB-CG 3.98Å; L55-L59 HydrophobicContact CD1-CD1 4.08Å; L55-L59 HydrophobicContact CG-CD1 4.37Å; L55-L59 WeakPolarHBondContact O-CB 3.41Å; L55-L59 PolarHBondContact O-N 2.9Å; L59-L72 HydrophobicContact CD2-CD1 3.76Å; L59-L72 HydrophobicContact CD2-CG 4.28Å; L59-K73 CarbonylContact C-O 3.52Å; L59-K73 WeakPolarHBondContact CA-O 2.97Å; L59-L74 HydrophobicContact CD2-CB 4.05Å; L59-L74 HydrophobicContact CD2-CD1 3.5Å; L59-L74 VanDerWaalsContact CD2-CD1 3.5Å; L59-L74 HydrophobicContact CD2-CG 4.25Å; L59-L74 HydrophobicContact CG-CD1 3.94Å
60	S	92.9	Very high	90.1	Very high	50 Å²	50	57.9 Å²	57.9	35%	0.35	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	130.5	166.9	174.7	0	0	0	0	108.9	K73	S60-K73 PolarHBondContact N-O 3.47Å; S60-K73 PolarHBondContact O-N 2.86Å
61	I	95.1	Very high	90.3	Very high	8 Å²	8	56.5 Å²	56.5	4%	0.041	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.5	176.3	-58.9	164.6	0	0	0	108.3	I43 Y51 V70 F71 L72	I43-I61 HydrophobicContact CB-CG2 3.7Å; I43-I61 HydrophobicContact CG2-CG2 3.66Å; Y51-I61 HydrophobicContact CD1-CD1 4.19Å; Y51-I61 HydrophobicContact CE1-CB 4.3Å; Y51-I61 HydrophobicContact CE1-CD1 3.91Å; Y51-I61 HydrophobicContact CE1-CG1 3.9Å; Y51-I61 PolarHBondContact OH-N 2.74Å; I61-V70 HydrophobicContact CG2-CG1 4.09Å; I61-F71 WeakPolarHBondContact CA-O 3.5Å; I61-L72 HydrophobicContact CD1-CD1 4.35Å; I61-L72 HydrophobicContact CG1-CD1 3.73Å
62	S	95.4	Very high	90.5	Very high	57 Å²	57	53.9 Å²	53.9	40%	0.399	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	169	176	67.3	0	0	0	0	111.1	V70 F71	S62-V70 CarbonylContact O-C 3.54Å; S62-V70 WeakPolarHBondContact O-CA 3.34Å; S62-V70 WeakPolarHBondContact O-CG1 3.17Å; S62-F71 PolarHBondContact N-O 2.8Å; S62-F71 PolarHBondContact O-N 2.87Å
63	K	95.7	Very high	90.9	Very high	45 Å²	45	55.6 Å²	55.6	20%	0.196	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	151.4	178.5	69.5	-176.3	-174.9	-179.6	0	112.5	L21 I43 W44 G45 N65 Q69 V70	L21-K63 HydrophobicContact CB-CD 4.43Å; L21-K63 HydrophobicContact CD1-CB 4.38Å; L21-K63 PolarHBondContact O-NZ 3.16Å; I43-K63 HydrophobicContact CD1-CB 4.04Å; I43-K63 HydrophobicContact CD1-CD 3.87Å; I43-K63 HydrophobicContact CD1-CG 3.73Å; I43-K63 HydrophobicContact CG1-CD 4.09Å; I43-K63 HydrophobicContact CG1-CG 4.49Å; W44-K63 PolarHBondContact O-NZ 2.81Å; G45-K63 VanDerWaalsContact C-NZ 3.3Å; G45-K63 PolarHBondContact O-NZ 2.95Å; K63-N65 WeakPolarHBondContact CD-OD1 3.4Å; K63-N65 WeakPolarHBondContact CE-OD1 3.42Å; K63-Q69 CarbonylContact C-O 3.5Å; K63-Q69 VanDerWaalsContact CA-O 3.29Å; K63-Q69 WeakPolarHBondContact CA-O 3.49Å; K63-V70 HydrophobicContact CB-CG2 4.16Å
64	D	95.4	Very high	91.3	Very high	38 Å²	38	51 Å²	51	20%	0.203	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	100.6	169.3	-176.8	-15.4	0	0	0	108.3	S66 K67 S68 Q69 F71	D64-S66 PolarHBondContact O-N 2.63Å; D64-S66 WeakPolarHBondContact OD1-CB 3.01Å; D64-S66 PolarHBondContact OD1-N 3.04Å; D64-S66 PolarHBondContact OD1-OG 3.31Å; D64-K67 HydrophobicContact CB-CB 4.41Å; D64-K67 PolarHBondContact O-N 2.86Å; D64-K67 PolarHBondContact OD1-N 3.45Å; D64-K67 WeakPolarHBondContact OD2-CD 3.42Å; D64-K67 VanDerWaalsContact OD2-CE 3.31Å; D64-K67 WeakPolarHBondContact OD2-CE 3.43Å; D64-K67 WeakPolarHBondContact OD2-CG 3.31Å; D64-K67 IonicContact OD2-NZ 3.41Å; D64-K67 PolarHBondContact OD2-NZ 3.09Å; D64-S68 PolarHBondContact O-N 3.39Å; D64-Q69 PolarHBondContact N-O 3.36Å; D64-Q69 PolarHBondContact O-N 3.09Å; D64-F71 HydrophobicContact CB-CE2 3.85Å; D64-F71 HydrophobicContact CB-CZ 4.38Å
65	N	93.6	Very high	91.8	Very high	74 Å²	74	49.9 Å²	49.9	40%	0.396	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-63	-32.4	-179.3	-64.6	-19.9	0	0	0	111.9	L21 T22 K63 K67 S68	L21-N65 WeakPolarHBondContact CB-OD1 3.3Å; T22-N65 HydrophobicContact CG2-CB 4.5Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.37Å; K63-N65 WeakPolarHBondContact CD-OD1 3.4Å; K63-N65 WeakPolarHBondContact CE-OD1 3.42Å; N65-K67 PolarHBondContact O-N 3.39Å; N65-S68 PolarHBondContact O-N 3.2Å
66	S	93.2	Very high	92.3	Very high	105 Å²	105	52.7 Å²	52.7	73%	0.734	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-67.7	-29.2	-178.1	74.4	0	0	0	0	112.1	D64	D64-S66 PolarHBondContact O-N 2.63Å; D64-S66 WeakPolarHBondContact OD1-CB 3.01Å; D64-S66 PolarHBondContact OD1-N 3.04Å; D64-S66 PolarHBondContact OD1-OG 3.31Å
67	K	94.4	Very high	92.7	Very high	125 Å²	125	48 Å²	48	54%	0.543	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-101.4	-2	178.4	-62.4	-179.3	-168.2	155.8	0	113.5	D64 N65 Q69	D64-K67 HydrophobicContact CB-CB 4.41Å; D64-K67 PolarHBondContact O-N 2.86Å; D64-K67 PolarHBondContact OD1-N 3.45Å; D64-K67 WeakPolarHBondContact OD2-CD 3.42Å; D64-K67 VanDerWaalsContact OD2-CE 3.31Å; D64-K67 WeakPolarHBondContact OD2-CE 3.43Å; D64-K67 WeakPolarHBondContact OD2-CG 3.31Å; D64-K67 IonicContact OD2-NZ 3.41Å; D64-K67 PolarHBondContact OD2-NZ 3.09Å; N65-K67 PolarHBondContact O-N 3.39Å; K67-Q69 HydrophobicContact CB-CB 4.26Å; K67-Q69 HydrophobicContact CB-CG 4.03Å; K67-Q69 PolarHBondContact O-N 2.84Å
68	S	94.1	Very high	92.9	Very high	45 Å²	45	47.7 Å²	47.7	32%	0.315	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	44.3	-170.8	-58.8	0	0	0	0	111.9	T15 V16 D64 N65	T15-S68 WeakPolarHBondContact CA-O 3.28Å; V16-S68 WeakPolarHBondContact CG2-O 3.36Å; V16-S68 PolarHBondContact N-O 2.87Å; D64-S68 PolarHBondContact O-N 3.39Å; N65-S68 PolarHBondContact O-N 3.2Å
69	Q	96.1	Very high	92.6	Very high	47 Å²	47	49.9 Å²	49.9	22%	0.22	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	142.4	-177.2	-76.3	176.5	-15	0	0	112.3	T13 C14 T15 L21 K63 D64 K67 F71	T13-Q69 HydrophobicContact CG2-CB 4.21Å; T13-Q69 HydrophobicContact CG2-CG 3.96Å; C14-Q69 CarbonylContact O-C 3.56Å; C14-Q69 WeakPolarHBondContact O-CA 3.39Å; T15-Q69 HydrophobicContact CG2-CG 4.43Å; T15-Q69 PolarHBondContact OG1-NE2 3.08Å; L21-Q69 WeakPolarHBondContact CD1-O 3.31Å; K63-Q69 CarbonylContact C-O 3.5Å; K63-Q69 VanDerWaalsContact CA-O 3.29Å; K63-Q69 WeakPolarHBondContact CA-O 3.49Å; D64-Q69 PolarHBondContact N-O 3.36Å; D64-Q69 PolarHBondContact O-N 3.09Å; K67-Q69 HydrophobicContact CB-CB 4.26Å; K67-Q69 HydrophobicContact CB-CG 4.03Å; K67-Q69 PolarHBondContact O-N 2.84Å; Q69-F71 HydrophobicContact CB-CE1 4.25Å; Q69-F71 HydrophobicContact CB-CE2 3.94Å; Q69-F71 HydrophobicContact CB-CZ 3.6Å; Q69-F71 HydrophobicContact CG-CZ 4.5Å
70	V	95.9	Very high	92.4	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	138.9	171.6	-176.1	0	0	0	0	108.1	C14 L21 V26 W28 I43 I61 S62 K63	C14-V70 PolarHBondContact N-O 2.87Å; C14-V70 PolarHBondContact O-N 2.76Å; L21-V70 HydrophobicContact CD1-CG2 3.89Å; L21-V70 HydrophobicContact CD2-CG2 3.59Å; L21-V70 HydrophobicContact CG-CG2 4.43Å; V26-V70 HydrophobicContact CB-CG1 4.34Å; V26-V70 HydrophobicContact CB-CG2 3.93Å; V26-V70 HydrophobicContact CG1-CB 4.28Å; V26-V70 HydrophobicContact CG1-CG1 4.24Å; V26-V70 HydrophobicContact CG1-CG2 4.11Å; V26-V70 HydrophobicContact CG2-CG2 3.87Å; W28-V70 HydrophobicContact CZ2-CG1 4.32Å; I43-V70 HydrophobicContact CG2-CG1 3.7Å; I61-V70 HydrophobicContact CG2-CG1 4.09Å; S62-V70 CarbonylContact O-C 3.54Å; S62-V70 WeakPolarHBondContact O-CA 3.34Å; S62-V70 WeakPolarHBondContact O-CG1 3.17Å; K63-V70 HydrophobicContact CB-CG2 4.16Å
71	F	95.7	Very high	92.2	Very high	43 Å²	43	52.5 Å²	52.5	19%	0.189	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.3	-175.3	-51	-85.6	0	0	0	110	I12 T13 I61 S62 D64 Q69	I12-F71 CarbonylContact O-C 3.57Å; I12-F71 WeakPolarHBondContact O-CA 3.19Å; T13-F71 HydrophobicContact CG2-CD1 3.94Å; T13-F71 HydrophobicContact CG2-CE1 3.6Å; T13-F71 HydrophobicContact CG2-CZ 4.43Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.39Å; I61-F71 WeakPolarHBondContact CA-O 3.5Å; S62-F71 PolarHBondContact N-O 2.8Å; S62-F71 PolarHBondContact O-N 2.87Å; D64-F71 HydrophobicContact CB-CE2 3.85Å; D64-F71 HydrophobicContact CB-CZ 4.38Å; Q69-F71 HydrophobicContact CB-CE1 4.25Å; Q69-F71 HydrophobicContact CB-CE2 3.94Å; Q69-F71 HydrophobicContact CB-CZ 3.6Å; Q69-F71 HydrophobicContact CG-CZ 4.5Å
72	L	94.9	Very high	92	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	115	167.2	-177.3	72	0	0	0	108.1	S11 I12 W28 L40 L59 I61 Y85	S11-L72 CarbonylContact C-O 3.43Å; S11-L72 WeakPolarHBondContact CA-O 3.34Å; I12-L72 HydrophobicContact CB-CB 4.33Å; I12-L72 HydrophobicContact CD1-CD2 4.24Å; I12-L72 PolarHBondContact N-O 3.32Å; I12-L72 PolarHBondContact O-N 2.78Å; W28-L72 HydrophobicContact CB-CD1 4.14Å; W28-L72 HydrophobicContact CB-CD2 4.38Å; W28-L72 HydrophobicContact CD2-CB 3.69Å; W28-L72 HydrophobicContact CD2-CD1 4.33Å; W28-L72 HydrophobicContact CD2-CD2 4.05Å; W28-L72 HydrophobicContact CD2-CG 4.25Å; W28-L72 HydrophobicContact CE3-CB 4.05Å; W28-L72 HydrophobicContact CE3-CD2 3.94Å; W28-L72 HydrophobicContact CG-CB 4.14Å; W28-L72 HydrophobicContact CG-CD1 3.9Å; W28-L72 HydrophobicContact CG-CD2 4.25Å; W28-L72 HydrophobicContact CG-CG 4.34Å; W28-L72 HydrophobicContact CH2-CB 4.11Å; W28-L72 HydrophobicContact CZ2-CB 3.78Å; W28-L72 HydrophobicContact CZ3-CB 4.25Å; L40-L72 HydrophobicContact CD1-CD2 3.85Å; L59-L72 HydrophobicContact CD2-CD1 3.76Å; L59-L72 HydrophobicContact CD2-CG 4.28Å; I61-L72 HydrophobicContact CD1-CD1 4.35Å; I61-L72 HydrophobicContact CG1-CD1 3.73Å; L72-Y85 HydrophobicContact CD2-CD1 3.64Å; L72-Y85 HydrophobicContact CD2-CE1 4.01Å
73	K	93.3	Very high	91.9	Very high	98 Å²	98	50.9 Å²	50.9	43%	0.426	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.8	170.8	-170.3	176.9	-176.4	-174.9	0	109.4	L10 L59 S60 N75	L10-K73 CarbonylContact O-C 3.6Å; L10-K73 VanDerWaalsContact O-CA 3.3Å; L10-K73 WeakPolarHBondContact O-CA 3.45Å; L59-K73 CarbonylContact C-O 3.52Å; L59-K73 WeakPolarHBondContact CA-O 2.97Å; S60-K73 PolarHBondContact N-O 3.47Å; S60-K73 PolarHBondContact O-N 2.86Å; K73-N75 VanDerWaalsContact CE-OD1 3.23Å; K73-N75 WeakPolarHBondContact CE-OD1 3.32Å
74	L	90.9	Very high	91.9	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	118.7	174.4	-178.4	61.1	0	0	0	108.2	S9 L10 R58 L59 L77 D81	S9-L74 CarbonylContact C-O 3.59Å; S9-L74 VanDerWaalsContact CA-O 3.28Å; S9-L74 WeakPolarHBondContact CA-O 3.13Å; L10-L74 PolarHBondContact N-O 3.28Å; L10-L74 PolarHBondContact O-N 3.26Å; R58-L74 HydrophobicContact CB-CD1 3.85Å; R58-L74 WeakPolarHBondContact O-CA 3.28Å; L59-L74 HydrophobicContact CD2-CB 4.05Å; L59-L74 HydrophobicContact CD2-CD1 3.5Å; L59-L74 VanDerWaalsContact CD2-CD1 3.5Å; L59-L74 HydrophobicContact CD2-CG 4.25Å; L59-L74 HydrophobicContact CG-CD1 3.94Å; L74-L77 HydrophobicContact CB-CD2 4.27Å; L74-L77 HydrophobicContact CD2-CD2 3.49Å; L74-L77 VanDerWaalsContact CD2-CD2 3.49Å; L74-L77 HydrophobicContact CG-CD2 3.78Å; L74-D81 HydrophobicContact CD2-CB 3.86Å
75	N	90	Very high	91.9	Very high	48 Å²	48	48.7 Å²	48.7	26%	0.257	27%	0.265	S	S	.	.			trans	-96.8	155.1	178.9	-54.6	-56.6	0	0	0	110.3	S9 R58 K73	S9-N75 PolarHBondContact OG-OD1 2.82Å; R58-N75 PolarHBondContact O-N 2.8Å; K73-N75 VanDerWaalsContact CE-OD1 3.23Å; K73-N75 WeakPolarHBondContact CE-OD1 3.32Å
76	S	87.3	Confident	91.9	Very high	69 Å²	69	47.2 Å²	47.2	48%	0.483	26%	0.255	S	S	.	.	S	Bend	trans	52.6	60.1	176.8	-57.1	0	0	0	0	111.7	Q8 R58	Q8-S76 PolarHBondContact O-N 2.89Å; R58-S76 PolarHBondContact NH1-O 3.1Å
77	L	87.2	Confident	91.9	Very high	3 Å²	3	43 Å²	43	2%	0.016	23%	0.225	C	C	.	.			trans	-57	140.1	-179.7	-71.4	165.1	0	0	0	112	V4 P6 S7 Q8 L10 L74 D81 V108	V4-L77 HydrophobicContact CB-CD1 3.86Å; V4-L77 HydrophobicContact CG1-CD1 3.3Å; P6-L77 WeakPolarHBondContact CA-O 3.35Å; S7-L77 PolarHBondContact N-O 2.83Å; Q8-L77 HydrophobicContact CB-CD1 4.49Å; Q8-L77 VanDerWaalsContact O-CG 3.31Å; Q8-L77 WeakPolarHBondContact O-CG 3.3Å; Q8-L77 PolarHBondContact O-N 3.04Å; Q8-L77 VanDerWaalsContact O-N 3.09Å; L10-L77 HydrophobicContact CB-CD1 3.85Å; L10-L77 HydrophobicContact CB-CD2 4.14Å; L10-L77 HydrophobicContact CB-CG 4.42Å; L74-L77 HydrophobicContact CB-CD2 4.27Å; L74-L77 HydrophobicContact CD2-CD2 3.49Å; L74-L77 VanDerWaalsContact CD2-CD2 3.49Å; L74-L77 HydrophobicContact CG-CD2 3.78Å; L77-D81 HydrophobicContact CD2-CB 4.12Å; L77-V108 HydrophobicContact CB-CG1 4.14Å; L77-V108 HydrophobicContact CB-CG2 4.28Å; L77-V108 HydrophobicContact CD1-CG2 4.38Å; L77-V108 HydrophobicContact CD2-CG2 4.19Å
78	Q	88.1	Confident	91.8	Very high	100 Å²	100	37.1 Å²	37.1	47%	0.467	20%	0.2	S	C	.	.			trans	-117.6	158.3	175.1	-62.9	176.1	-9.3	0	0	108.9	D80 D81 V108	Q78-D80 PolarHBondContact O-N 2.87Å; Q78-D80 VanDerWaalsContact O-N 3.16Å; Q78-D81 PolarHBondContact N-OD2 2.86Å; Q78-D81 VanDerWaalsContact O-CB 3.3Å; Q78-D81 WeakPolarHBondContact O-CB 3.29Å; Q78-D81 PolarHBondContact O-N 3.04Å; Q78-V108 WeakPolarHBondContact O-CB 3.45Å; Q78-V108 WeakPolarHBondContact O-CG1 3.31Å
79	T	85.1	Confident	91.6	Very high	76 Å²	76	35.7 Å²	35.7	47%	0.466	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-55.5	-33.6	176.1	46.1	0	0	0	0	112.2	D81 T82	T79-D81 PolarHBondContact O-N 2.89Å; T79-T82 VanDerWaalsContact O-CB 3.29Å; T79-T82 WeakPolarHBondContact O-CB 3.26Å; T79-T82 PolarHBondContact O-N 2.79Å; T79-T82 VanDerWaalsContact O-N 3.08Å; T79-T82 PolarHBondContact O-OG1 2.89Å
80	D	86.3	Confident	91	Very high	116 Å²	116	33.9 Å²	33.9	62%	0.62	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-68.3	-12.2	178.1	-68.4	6.3	0	0	0	113.5	Q78 T82	Q78-D80 PolarHBondContact O-N 2.87Å; Q78-D80 VanDerWaalsContact O-N 3.16Å; D80-T82 PolarHBondContact O-N 3.24Å
81	D	89.1	Confident	90	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-82.3	0.1	173.1	-58.9	-45	0	0	0	112.4	R30 R58 L74 L77 Q78 T79 A83 Y85 V108	R30-D81 IonicContact NH1-OD1 3.26Å; R30-D81 PolarHBondContact NH1-OD1 3.47Å; R58-D81 IonicContact CZ-OD1 3.79Å; R58-D81 IonicContact CZ-OD2 3.56Å; R58-D81 IonicContact NH1-OD1 3.67Å; R58-D81 IonicContact NH1-OD2 2.71Å; R58-D81 PolarHBondContact NH1-OD2 3.33Å; R58-D81 IonicContact NH2-OD1 2.95Å; R58-D81 PolarHBondContact NH2-OD1 2.71Å; R58-D81 IonicContact NH2-OD2 3.46Å; R58-D81 PolarHBondContact NH2-OD2 2.89Å; L74-D81 HydrophobicContact CD2-CB 3.86Å; L77-D81 HydrophobicContact CD2-CB 4.12Å; Q78-D81 PolarHBondContact N-OD2 2.86Å; Q78-D81 VanDerWaalsContact O-CB 3.3Å; Q78-D81 WeakPolarHBondContact O-CB 3.29Å; Q78-D81 PolarHBondContact O-N 3.04Å; T79-D81 PolarHBondContact O-N 2.89Å; D81-A83 PolarHBondContact O-N 2.79Å; D81-A83 VanDerWaalsContact O-N 3.17Å; D81-Y85 WeakPolarHBondContact O-CE2 3.36Å; D81-Y85 PolarHBondContact O-OH 2.88Å; D81-V108 HydrophobicContact CB-CG2 4.43Å
82	T	91.3	Very high	88.3	Confident	30 Å²	30	41.7 Å²	41.7	18%	0.184	22%	0.218	C	C	.	.			trans	-64.2	111.7	169.7	-63.9	0	0	0	0	110.2	P33 T79 D80 V106 T107 V108	P33-T82 VanDerWaalsContact CD-O 3.3Å; P33-T82 WeakPolarHBondContact CD-O 3.46Å; P33-T82 HydrophobicContact CG-CG2 4.4Å; T79-T82 VanDerWaalsContact O-CB 3.29Å; T79-T82 WeakPolarHBondContact O-CB 3.26Å; T79-T82 PolarHBondContact O-N 2.79Å; T79-T82 VanDerWaalsContact O-N 3.08Å; T79-T82 PolarHBondContact O-OG1 2.89Å; D80-T82 PolarHBondContact O-N 3.24Å; T82-V106 WeakPolarHBondContact CA-O 3.29Å; T82-T107 HydrophobicContact CG2-CG2 4.48Å; T82-V108 PolarHBondContact OG1-N 2.02Å; T82-V108 PolarHBondContact OG1-O 2.84Å
83	A	93.4	Very high	86.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	165.7	-176.5	0	0	0	0	0	111	R30 Q31 P32 D81 Y85 V106	R30-A83 HydrophobicContact CB-CB 3.85Å; R30-A83 HydrophobicContact CG-CB 4.25Å; Q31-A83 WeakPolarHBondContact O-CA 3.24Å; Q31-A83 WeakPolarHBondContact O-CB 3.48Å; P32-A83 HydrophobicContact CG-CB 4.39Å; D81-A83 PolarHBondContact O-N 2.79Å; D81-A83 VanDerWaalsContact O-N 3.17Å; A83-Y85 HydrophobicContact CB-CD2 4.32Å; A83-Y85 HydrophobicContact CB-CE2 3.83Å; A83-Y85 VanDerWaalsContact O-CD2 3.32Å; A83-Y85 WeakPolarHBondContact O-CD2 3.23Å; A83-V106 PolarHBondContact N-O 3.24Å; A83-V106 PolarHBondContact O-N 3.35Å
84	T	94.7	Very high	84.3	Confident	35 Å²	35	52.3 Å²	52.3	22%	0.215	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.3	161.3	-51.9	0	0	0	0	109	R30 Q31 Y86 T104	R30-T84 CarbonylContact C-O 3.55Å; R30-T84 VanDerWaalsContact CA-O 3.25Å; R30-T84 WeakPolarHBondContact CA-O 3.02Å; Q31-T84 PolarHBondContact N-O 3.08Å; Q31-T84 PolarHBondContact O-N 2.64Å; T84-Y86 WeakPolarHBondContact CB-OH 3.42Å; T84-Y86 HydrophobicContact CG2-CD2 4.43Å; T84-Y86 HydrophobicContact CG2-CE1 3.81Å; T84-Y86 HydrophobicContact CG2-CE2 3.66Å; T84-Y86 VanDerWaalsContact CG2-OH 3.24Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.45Å; T84-Y86 WeakPolarHBondContact O-CD2 3.35Å; T84-Y86 VanDerWaalsContact O-CE2 3.27Å; T84-Y86 WeakPolarHBondContact O-CE2 3.45Å; T84-T104 WeakPolarHBondContact CA-O 3.4Å
85	Y	94.4	Very high	82.6	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.008	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	127.4	-178.6	-71	-101.1	0	0	0	110.4	I12 V29 R30 L40 L72 D81 A83 G103 T104 V106	I12-Y85 HydrophobicContact CD1-CD1 3.72Å; I12-Y85 HydrophobicContact CD1-CD2 3.82Å; I12-Y85 HydrophobicContact CD1-CE1 4.39Å; I12-Y85 HydrophobicContact CD1-CG 3.39Å; V29-Y85 CarbonylContact O-C 3.58Å; R30-Y85 HydrophobicContact CB-CD1 3.92Å; R30-Y85 HydrophobicContact CB-CE1 3.93Å; R30-Y85 HydrophobicContact CB-CG 4.3Å; L40-Y85 HydrophobicContact CD1-CD1 3.8Å; L40-Y85 HydrophobicContact CD1-CE1 3.71Å; L72-Y85 HydrophobicContact CD2-CD1 3.64Å; L72-Y85 HydrophobicContact CD2-CE1 4.01Å; D81-Y85 WeakPolarHBondContact O-CE2 3.36Å; D81-Y85 PolarHBondContact O-OH 2.88Å; A83-Y85 HydrophobicContact CB-CD2 4.32Å; A83-Y85 HydrophobicContact CB-CE2 3.83Å; A83-Y85 VanDerWaalsContact O-CD2 3.32Å; A83-Y85 WeakPolarHBondContact O-CD2 3.23Å; Y85-G103 CarbonylContact O-C 3.54Å; Y85-G103 WeakPolarHBondContact O-CA 3.49Å; Y85-T104 PolarHBondContact N-O 2.81Å; Y85-T104 PolarHBondContact O-N 3.29Å; Y85-V106 HydrophobicContact CD2-CB 3.86Å; Y85-V106 HydrophobicContact CD2-CG2 3.6Å; Y85-V106 HydrophobicContact CE2-CB 3.73Å; Y85-V106 HydrophobicContact CE2-CG1 4.28Å; Y85-V106 HydrophobicContact CE2-CG2 3.9Å
86	Y	93.8	Very high	81	Confident	44 Å²	44	57.9 Å²	57.9	17%	0.173	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144.1	-178.6	-54	-90.1	0	0	0	110	W28 V29 Q31 L37 T84 W100	W28-Y86 WeakPolarHBondContact CA-O 3.3Å; V29-Y86 PolarHBondContact N-O 2.82Å; V29-Y86 PolarHBondContact O-N 2.8Å; Q31-Y86 HydrophobicContact CB-CE2 3.87Å; L37-Y86 HydrophobicContact CD2-CD2 4.43Å; L37-Y86 HydrophobicContact CD2-CE2 4.35Å; T84-Y86 WeakPolarHBondContact CB-OH 3.42Å; T84-Y86 HydrophobicContact CG2-CD2 4.43Å; T84-Y86 HydrophobicContact CG2-CE1 3.81Å; T84-Y86 HydrophobicContact CG2-CE2 3.66Å; T84-Y86 VanDerWaalsContact CG2-OH 3.24Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.45Å; T84-Y86 WeakPolarHBondContact O-CD2 3.35Å; T84-Y86 VanDerWaalsContact O-CE2 3.27Å; T84-Y86 WeakPolarHBondContact O-CE2 3.45Å; Y86-W100 HydrophobicContact CD1-CE3 4.47Å; Y86-W100 HydrophobicContact CG-CE3 4.13Å; Y86-W100 HydrophobicContact CG-CZ3 4.22Å
87	C	93.4	Very high	79.9	Confident	16 Å²	16	57.2 Å²	57.2	11%	0.108	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	143.3	161.4	56.9	0	0	0	0	109.2	C14 V26 S27 W28 G101	C14-C87 HydrophobicContact CB-CB 3.45Å; C14-C87 VanDerWaalsContact CB-CB 3.45Å; C14-C87 WeakPolarHBondContact CB-SG 3.41Å; C14-C87 WeakPolarHBondContact SG-CB 3.32Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 3.36Å; V26-C87 HydrophobicContact CG1-CB 4Å; S27-C87 CarbonylContact O-C 3.58Å; S27-C87 VanDerWaalsContact O-CA 3.28Å; S27-C87 WeakPolarHBondContact O-CA 3.4Å; W28-C87 HydrophobicContact CD2-CB 4.42Å; W28-C87 HydrophobicContact CE3-CB 4.21Å; W28-C87 HydrophobicContact CH2-CB 4.27Å; W28-C87 HydrophobicContact CZ2-CB 4.45Å; W28-C87 HydrophobicContact CZ3-CB 4.13Å; C87-G101 PolarHBondContact O-N 3.02Å
88	A	91.9	Very high	78.9	Confident	2 Å²	2	59.6 Å²	59.6	2%	0.017	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	141.4	179.7	0	0	0	0	0	111.4	V26 S27 S90 F97 Y99 W100	V26-A88 CarbonylContact C-O 3.55Å; V26-A88 WeakPolarHBondContact CA-O 3.39Å; S27-A88 PolarHBondContact N-O 3.33Å; S27-A88 PolarHBondContact O-N 2.97Å; A88-S90 PolarHBondContact O-N 2.75Å; A88-F97 HydrophobicContact CB-CB 4.04Å; A88-F97 HydrophobicContact CB-CD1 3.56Å; A88-F97 HydrophobicContact CB-CE1 4.31Å; A88-F97 HydrophobicContact CB-CG 3.95Å; A88-Y99 CarbonylContact C-O 3.42Å; A88-Y99 WeakPolarHBondContact CA-O 3.49Å; A88-W100 HydrophobicContact CB-CD2 3.84Å; A88-W100 HydrophobicContact CB-CE3 3.99Å; A88-W100 HydrophobicContact CB-CG 4.27Å; A88-W100 HydrophobicContact CB-CZ2 4.41Å; A88-W100 HydrophobicContact CB-CZ3 4.34Å
89	K	90.4	Very high	78.4	Confident	15 Å²	15	62 Å²	62	7%	0.065	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	129.9	172.1	-173.2	-171.2	-179.8	-172.9	0	109.7	F19 Y91 Y99	F19-K89 HydrophobicContact CD1-CD 3.89Å; F19-K89 HydrophobicContact CD1-CG 4.27Å; F19-K89 HydrophobicContact CD2-CD 4.47Å; F19-K89 HydrophobicContact CD2-CG 4.4Å; F19-K89 HydrophobicContact CE1-CB 4Å; F19-K89 HydrophobicContact CE1-CD 4.09Å; F19-K89 HydrophobicContact CE1-CG 4.02Å; F19-K89 HydrophobicContact CE2-CG 4.14Å; F19-K89 HydrophobicContact CG-CD 4.09Å; F19-K89 HydrophobicContact CG-CG 4.45Å; F19-K89 HydrophobicContact CZ-CB 4Å; F19-K89 HydrophobicContact CZ-CD 4.45Å; F19-K89 HydrophobicContact CZ-CG 3.93Å; K89-Y91 HydrophobicContact CD-CE2 4.25Å; K89-Y91 WeakPolarHBondContact CE-OH 3.45Å; K89-Y91 PolarHBondContact NZ-OH 3.48Å; K89-Y99 HydrophobicContact CB-CD2 4.38Å; K89-Y99 HydrophobicContact CD-CD2 3.75Å; K89-Y99 HydrophobicContact CD-CE2 4.34Å; K89-Y99 PolarHBondContact N-O 2.8Å
90	S	84.6	Confident	78.4	Confident	8 Å²	8	63.1 Å²	63.1	6%	0.056	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.4	178.8	-149.6	0	0	0	0	111	G25 A88	G25-S90 PolarHBondContact N-O 3.43Å; G25-S90 PolarHBondContact O-N 2.73Å; A88-S90 PolarHBondContact O-N 2.75Å
91	Y	74.9	Confident	78.4	Confident	88 Å²	88	59 Å²	59	35%	0.345	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	153	165.4	-57.6	-92.4	0	0	0	107.9	Y24 K89 Y93 A98	Y24-Y91 AromaticContact CD1-CD1 3.91Å; Y24-Y91 HydrophobicContact CD1-CD1 3.91Å; Y24-Y91 AromaticContact CD1-CE1 3.83Å; Y24-Y91 HydrophobicContact CD1-CE1 3.83Å; Y24-Y91 AromaticContact CE1-CD1 3.72Å; Y24-Y91 HydrophobicContact CE1-CD1 3.72Å; Y24-Y91 AromaticContact CE1-CE1 3.42Å; Y24-Y91 HydrophobicContact CE1-CE1 3.42Å; Y24-Y91 VanDerWaalsContact CE1-CE1 3.42Å; K89-Y91 HydrophobicContact CD-CE2 4.25Å; K89-Y91 WeakPolarHBondContact CE-OH 3.45Å; K89-Y91 PolarHBondContact NZ-OH 3.48Å; Y91-Y93 PolarHBondContact O-N 2.87Å; Y91-A98 HydrophobicContact CE2-CB 3.44Å; Y91-A98 VanDerWaalsContact CE2-CB 3.44Å
92	D	59.7	Low	78.4	Confident	120 Å²	120	67.9 Å²	67.9	64%	0.642	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.5	129.4	-177.3	-99.3	-39.9	0	0	0	114	D94	D92-D94 WeakPolarHBondContact O-CB 3.45Å; D92-D94 PolarHBondContact O-N 3.11Å
93	Y	54.8	Low	78.2	Confident	202 Å²	202	67.9 Å²	67.9	79%	0.792	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.1	-5.7	170.9	-67.7	-85.7	0	0	0	119.6	Y91	Y91-Y93 PolarHBondContact O-N 2.87Å
94	D	50.2	Low	78.2	Confident	119 Å²	119	70.6 Å²	70.6	64%	0.636	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.4	-173.8	-146.9	-13.6	0	0	0	108.2	D92 G96	D92-D94 WeakPolarHBondContact O-CB 3.45Å; D92-D94 PolarHBondContact O-N 3.11Å; D94-G96 PolarHBondContact O-N 2.77Å
95	V	54.3	Low	78	Confident	127 Å²	127	73.1 Å²	73.1	77%	0.77	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	23.5	-168.4	-84.3	0	0	0	0	113.9	F97	V95-F97 PolarHBondContact O-N 3.23Å
96	G	56.7	Low	77.7	Confident	42 Å²	42	73.2 Å²	73.2	43%	0.433	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	100.1	176.5	0	0	0	0	0	112.2	D94 A98	D94-G96 PolarHBondContact O-N 2.77Å; G96-A98 PolarHBondContact O-N 3.23Å
97	F	63.6	Low	77.4	Confident	56 Å²	56	73.9 Å²	73.9	25%	0.246	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	105.6	170.4	-59.5	-64.4	0	0	0	110.5	S27 V29 A88 V95 W100	S27-F97 VanDerWaalsContact CB-CE1 3.42Å; V29-F97 HydrophobicContact CG2-CZ 4.26Å; A88-F97 HydrophobicContact CB-CB 4.04Å; A88-F97 HydrophobicContact CB-CD1 3.56Å; A88-F97 HydrophobicContact CB-CE1 4.31Å; A88-F97 HydrophobicContact CB-CG 3.95Å; V95-F97 PolarHBondContact O-N 3.23Å; F97-W100 HydrophobicContact CB-CZ2 3.73Å; F97-W100 VanDerWaalsContact CB-NE1 3.25Å; F97-W100 HydrophobicContact CD2-CH2 4.04Å; F97-W100 AromaticContact CD2-CZ2 3.34Å; F97-W100 HydrophobicContact CD2-CZ2 3.34Å; F97-W100 HydrophobicContact CE2-CH2 4.35Å; F97-W100 HydrophobicContact CE2-CZ2 4.07Å; F97-W100 AromaticContact CG-CE2 3.98Å; F97-W100 HydrophobicContact CG-CH2 4.42Å; F97-W100 AromaticContact CG-CZ2 3.63Å; F97-W100 HydrophobicContact CG-CZ2 3.63Å
98	A	66.1	Low	76.8	Confident	52 Å²	52	73.4 Å²	73.4	43%	0.43	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-28.2	-178.6	0	0	0	0	0	114.2	Y91 G96	Y91-A98 HydrophobicContact CE2-CB 3.44Å; Y91-A98 VanDerWaalsContact CE2-CB 3.44Å; G96-A98 PolarHBondContact O-N 3.23Å
99	Y	77.4	Confident	76.2	Confident	151 Å²	151	75.4 Å²	75.4	59%	0.592	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.8	126.7	-176.2	-62.6	-78.3	0	0	0	110.3	A88 K89	A88-Y99 CarbonylContact C-O 3.42Å; A88-Y99 WeakPolarHBondContact CA-O 3.49Å; K89-Y99 HydrophobicContact CB-CD2 4.38Å; K89-Y99 HydrophobicContact CD-CD2 3.75Å; K89-Y99 HydrophobicContact CD-CE2 4.34Å; K89-Y99 PolarHBondContact N-O 2.8Å
100	W	86.4	Confident	75.1	Confident	100 Å²	100	77.9 Å²	77.9	38%	0.379	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	139.5	179.5	-70.7	79.1	0	0	0	110.8	V29 L37 Y86 A88 F97	V29-W100 HydrophobicContact CB-CH2 3.97Å; V29-W100 HydrophobicContact CB-CZ3 3.75Å; V29-W100 HydrophobicContact CG1-CH2 3.92Å; V29-W100 HydrophobicContact CG1-CZ3 3.97Å; V29-W100 HydrophobicContact CG2-CH2 3.74Å; V29-W100 HydrophobicContact CG2-CZ3 3.91Å; L37-W100 HydrophobicContact CD1-CH2 4.02Å; L37-W100 HydrophobicContact CD1-CZ2 4.49Å; Y86-W100 HydrophobicContact CD1-CE3 4.47Å; Y86-W100 HydrophobicContact CG-CE3 4.13Å; Y86-W100 HydrophobicContact CG-CZ3 4.22Å; A88-W100 HydrophobicContact CB-CD2 3.84Å; A88-W100 HydrophobicContact CB-CE3 3.99Å; A88-W100 HydrophobicContact CB-CG 4.27Å; A88-W100 HydrophobicContact CB-CZ2 4.41Å; A88-W100 HydrophobicContact CB-CZ3 4.34Å; F97-W100 HydrophobicContact CB-CZ2 3.73Å; F97-W100 VanDerWaalsContact CB-NE1 3.25Å; F97-W100 HydrophobicContact CD2-CH2 4.04Å; F97-W100 AromaticContact CD2-CZ2 3.34Å; F97-W100 HydrophobicContact CD2-CZ2 3.34Å; F97-W100 HydrophobicContact CE2-CH2 4.35Å; F97-W100 HydrophobicContact CE2-CZ2 4.07Å; F97-W100 AromaticContact CG-CE2 3.98Å; F97-W100 HydrophobicContact CG-CH2 4.42Å; F97-W100 AromaticContact CG-CZ2 3.63Å; F97-W100 HydrophobicContact CG-CZ2 3.63Å
101	G	86	Confident	73.9	Confident	28 Å²	28	83.5 Å²	83.5	29%	0.289	45%	0.448	S	S	.	.			trans	-69.2	161.4	165.2	0	0	0	0	0	111.4	C87 G103	C87-G101 PolarHBondContact O-N 3.02Å; G101-G103 PolarHBondContact O-N 3.05Å; G101-G103 VanDerWaalsContact O-N 3.08Å
102	Q	88.3	Confident	72.7	Confident	189 Å²	189	84.5 Å²	84.5	88%	0.883	47%	0.468	S	S	*	.			trans	-62.5	-16.6	-179.9	-67.8	-65.8	-43.2	0	0	114
103	G	88.3	Confident	71.9	Confident	29 Å²	29	86.8 Å²	86.8	30%	0.299	48%	0.475	S	S	.	.			trans	86.5	151.7	-177.6	0	0	0	0	0	112.8	Y85 G101	Y85-G103 CarbonylContact O-C 3.54Å; Y85-G103 WeakPolarHBondContact O-CA 3.49Å; G101-G103 PolarHBondContact O-N 3.05Å; G101-G103 VanDerWaalsContact O-N 3.08Å
104	T	91.6	Very high	71.3	Confident	57 Å²	57	82.2 Å²	82.2	35%	0.35	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117.5	174.2	-61.1	0	0	0	0	109	T84 Y85 V106	T84-T104 WeakPolarHBondContact CA-O 3.4Å; Y85-T104 PolarHBondContact N-O 2.81Å; Y85-T104 PolarHBondContact O-N 3.29Å; T104-V106 HydrophobicContact CG2-CG2 4.38Å; T104-V106 PolarHBondContact O-N 3.36Å
105	L	91.1	Very high	71.1	Confident	89 Å²	89	89.9 Å²	89.9	47%	0.466	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	126.7	171.7	179.8	63	0	0	0	109.7	P1	P1-L105 WeakPolarHBondContact CB-O 3.33Å
106	V	88.2	Confident	71.9	Confident	4 Å²	4	88 Å²	88	2%	0.024	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.1	174.7	174.1	0	0	0	0	107.6	L10 I12 T82 A83 Y85 T104 V108	L10-V106 HydrophobicContact CD2-CB 4.18Å; L10-V106 HydrophobicContact CD2-CG1 3.48Å; L10-V106 VanDerWaalsContact CD2-CG1 3.48Å; L10-V106 HydrophobicContact CD2-CG2 3.66Å; I12-V106 HydrophobicContact CD1-CG2 3.91Å; T82-V106 WeakPolarHBondContact CA-O 3.29Å; A83-V106 PolarHBondContact N-O 3.24Å; A83-V106 PolarHBondContact O-N 3.35Å; Y85-V106 HydrophobicContact CD2-CB 3.86Å; Y85-V106 HydrophobicContact CD2-CG2 3.6Å; Y85-V106 HydrophobicContact CE2-CB 3.73Å; Y85-V106 HydrophobicContact CE2-CG1 4.28Å; Y85-V106 HydrophobicContact CE2-CG2 3.9Å; T104-V106 HydrophobicContact CG2-CG2 4.38Å; T104-V106 PolarHBondContact O-N 3.36Å; V106-V108 HydrophobicContact CG1-CG2 4.25Å
107	T	86.9	Confident	72.7	Confident	58 Å²	58	90.4 Å²	90.4	36%	0.356	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.7	177.1	-53.7	0	0	0	0	109.2	L3 V4 T82	L3-T107 HydrophobicContact CD1-CG2 4.12Å; V4-T107 PolarHBondContact N-O 3.28Å; V4-T107 VanDerWaalsContact N-O 3.1Å; T82-T107 HydrophobicContact CG2-CG2 4.48Å
108	V	82.3	Confident	73.2	Confident	5 Å²	5	92.3 Å²	92.3	3%	0.03	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	109	174	-174	0	0	0	0	108.2	V4 P6 L77 Q78 D81 T82 V106	V4-V108 WeakPolarHBondContact O-CA 3.44Å; P6-V108 HydrophobicContact CG-CG1 4.39Å; L77-V108 HydrophobicContact CB-CG1 4.14Å; L77-V108 HydrophobicContact CB-CG2 4.28Å; L77-V108 HydrophobicContact CD1-CG2 4.38Å; L77-V108 HydrophobicContact CD2-CG2 4.19Å; Q78-V108 WeakPolarHBondContact O-CB 3.45Å; Q78-V108 WeakPolarHBondContact O-CG1 3.31Å; D81-V108 HydrophobicContact CB-CG2 4.43Å; T82-V108 PolarHBondContact OG1-N 2.02Å; T82-V108 PolarHBondContact OG1-O 2.84Å; V106-V108 HydrophobicContact CG1-CG2 4.25Å
109	S	79.2	Confident	73.6	Confident	45 Å²	45	94.7 Å²	94.7	32%	0.315	51%	0.508	S	S	.	.			trans	-124.3	137	175.9	60.9	0	0	0	0	109.4	L3 P6 E111	L3-S109 WeakPolarHBondContact CD1-OG 3.39Å; P6-S109 WeakPolarHBondContact CD-O 3.21Å; S109-E111 PolarHBondContact O-N 3.36Å; S109-E111 VanDerWaalsContact O-N 3.09Å
110	A	65.9	Low	73.4	Confident	67 Å²	67	91.2 Å²	91.2	55%	0.554	50%	0.503	S	S	*	.			trans	-58.6	116.6	162.2	0	0	0	0	0	107.3	P6 S112	P6-A110 HydrophobicContact CG-CB 4.24Å; A110-S112 PolarHBondContact O-N 3.34Å
111	E	60.1	Low	72.5	Confident	125 Å²	125	90.6 Å²	90.6	58%	0.584	51%	0.511	S	S	*	.			trans	-59.5	108.2	165.9	-74.8	177.1	165.6	0	0	106.7	S109 Q113	S109-E111 PolarHBondContact O-N 3.36Å; S109-E111 VanDerWaalsContact O-N 3.09Å; E111-Q113 PolarHBondContact O-N 2.59Å
112	S	49.6	Very low	71.5	Confident	109 Å²	109	95.1 Å²	95.1	76%	0.762	53%	0.527	S	S	*	.			trans	-67	96.1	148.8	36.9	0	0	0	0	105.2	A110 S114	A110-S112 PolarHBondContact O-N 3.34Å; S112-S114 PolarHBondContact O-N 2.97Å
113	Q	43.5	Very low	70.3	Confident	168 Å²	168	87.8 Å²	87.8	79%	0.785	50%	0.5	S	S	*	.			trans	-59	96.4	155.7	-69.2	-175.9	-3.3	0	0	105.3	E111 F115	E111-Q113 PolarHBondContact O-N 2.59Å; Q113-F115 PolarHBondContact O-N 3.41Å
114	S	41.3	Very low	68.8	Low	106 Å²	106	92.8 Å²	92.8	74%	0.741	52%	0.516	S	S	*	.			trans	-62.7	114.9	168.4	42.1	0	0	0	0	107.4	S112	S112-S114 PolarHBondContact O-N 2.97Å
115	F	45.4	Very low	66.7	Low	280 Å²	280	96 Å²	96	100%	1.228	53%	0.531	S	S	*	.			trans	2.4	0	169.3	-66.5	-86.7	0	0	0	119	Q113	Q113-F115 PolarHBondContact O-N 3.41Å

Retrieved 115 of 115 residues in 22.7 ms (Link to these results)

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