X5J4F2_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4F2, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 113 aa.

						>X5J4F2_MOUSE|X5J4F2
PGLVAPSQSLSITCTVSGFSLTSYGVSWVRQPPGKGLEWLGVIWGDGSTNYHSALISRLSISKDNSKSQVFLKLNSLQTDDTATYYCAKQDDYSWFAYWGQGTLVTVSAESQS
					

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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	58.7	Low	83.9	Confident	101 Å²	101	63.5 Å²	63.5	66%	0.656	42%	0.415	S	S	*	.				0	148	0	-41.1	38.9	0	0	0	109.3	T103 L104 V105	P1-T103 HydrophobicContact CB-CG2 3.54Å; P1-T103 HydrophobicContact CG-CG2 3.38Å; P1-L104 VanDerWaalsContact O-O 3.12Å; P1-V105 HydrophobicContact CB-CG2 4.16Å
2	G	73.6	Confident	84.9	Confident	46 Å²	46	58.6 Å²	58.6	47%	0.474	38%	0.383	S	S	.	.			trans	-128.2	-153.8	-166.2	0	0	0	0	0	112.1
3	L	79.7	Confident	85.8	Confident	82 Å²	82	59.5 Å²	59.5	43%	0.429	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	128.2	176.3	-179.3	63.7	0	0	0	110.8	T106 S108	L3-T106 CarbonylContact C-O 3.52Å; L3-T106 WeakPolarHBondContact CA-O 3.44Å; L3-T106 HydrophobicContact CD1-CG2 3.91Å; L3-S108 VanDerWaalsContact CD1-OG 3.28Å; L3-S108 WeakPolarHBondContact CD1-OG 3.35Å
4	V	83.4	Confident	86.6	Confident	20 Å²	20	56 Å²	56	12%	0.121	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.9	178.6	-166.4	0	0	0	0	109.6	Q8 L10 L77 T106 V107 S108	V4-Q8 HydrophobicContact CG1-CB 3.94Å; V4-Q8 VanDerWaalsContact CG1-OE1 3.31Å; V4-L10 HydrophobicContact CG2-CD1 4.49Å; V4-L77 HydrophobicContact CB-CD1 4.01Å; V4-L77 HydrophobicContact CG1-CD1 3.41Å; V4-L77 VanDerWaalsContact CG1-CD1 3.41Å; V4-T106 PolarHBondContact N-O 3.27Å; V4-V107 VanDerWaalsContact O-CA 3.29Å; V4-V107 WeakPolarHBondContact O-CA 3.28Å; V4-S108 PolarHBondContact O-N 3.36Å
5	A	85.4	Confident	87.2	Confident	40 Å²	40	58.6 Å²	58.6	33%	0.331	38%	0.379	S	S	.	.			trans	-80.4	153.9	177.1	0	0	0	0	0	111.7	Q8	A5-Q8 HydrophobicContact CB-CG 4.27Å; A5-Q8 WeakPolarHBondContact O-CB 3.43Å; A5-Q8 PolarHBondContact O-N 3.38Å
6	P	87.5	Confident	87.6	Confident	47 Å²	47	55.9 Å²	55.9	31%	0.305	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	156.1	171.8	-24.8	34.1	0	0	0	112.8	Q8 L77 V107 S108 A109	P6-Q8 PolarHBondContact O-N 3.04Å; P6-L77 WeakPolarHBondContact CA-O 3.33Å; P6-V107 HydrophobicContact CG-CG1 4.27Å; P6-S108 WeakPolarHBondContact CD-O 3.43Å; P6-A109 HydrophobicContact CG-CB 4.31Å
7	S	87.3	Confident	87.8	Confident	99 Å²	99	58.9 Å²	58.9	69%	0.692	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	-7.9	-178.8	-54.8	0	0	0	0	116	L77	S7-L77 PolarHBondContact N-O 2.87Å
8	Q	89.2	Confident	87.9	Confident	104 Å²	104	60.6 Å²	60.6	49%	0.486	41%	0.413	S	S	.	.			trans	-74.1	168.8	171.4	-64	-169.1	-22.8	0	0	111.6	V4 A5 P6 S76 L77	V4-Q8 HydrophobicContact CG1-CB 3.94Å; V4-Q8 VanDerWaalsContact CG1-OE1 3.31Å; A5-Q8 HydrophobicContact CB-CG 4.27Å; A5-Q8 WeakPolarHBondContact O-CB 3.43Å; A5-Q8 PolarHBondContact O-N 3.38Å; P6-Q8 PolarHBondContact O-N 3.04Å; Q8-S76 PolarHBondContact O-N 2.81Å; Q8-L77 HydrophobicContact CB-CD1 4.47Å; Q8-L77 WeakPolarHBondContact O-CD1 3.34Å; Q8-L77 VanDerWaalsContact O-CG 3.27Å; Q8-L77 WeakPolarHBondContact O-CG 3.32Å; Q8-L77 PolarHBondContact O-N 2.82Å
9	S	91.6	Very high	88	Confident	69 Å²	69	59.2 Å²	59.2	48%	0.483	40%	0.399	S	S	.	.			trans	-104.7	143.1	170.2	-64	0	0	0	0	110.3	L74 N75	S9-L74 CarbonylContact C-O 3.59Å; S9-L74 VanDerWaalsContact CA-O 3.26Å; S9-L74 WeakPolarHBondContact CA-O 3.34Å; S9-N75 PolarHBondContact OG-OD1 3.38Å
10	L	91.5	Very high	88.2	Confident	23 Å²	23	59.1 Å²	59.1	12%	0.12	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.7	172.3	172.5	67.3	0	0	0	109.8	V4 I12 K73 L74 L77 V105	V4-L10 HydrophobicContact CG2-CD1 4.49Å; L10-I12 HydrophobicContact CD1-CG1 4.44Å; L10-I12 HydrophobicContact CD2-CD1 3.88Å; L10-I12 HydrophobicContact CD2-CG1 3.77Å; L10-I12 HydrophobicContact CG-CG1 3.87Å; L10-K73 CarbonylContact O-C 3.5Å; L10-K73 WeakPolarHBondContact O-CA 3.38Å; L10-L74 PolarHBondContact N-O 3.26Å; L10-L74 PolarHBondContact O-N 3.3Å; L10-L77 HydrophobicContact CB-CD1 3.85Å; L10-L77 HydrophobicContact CB-CD2 4.35Å; L10-V105 HydrophobicContact CD2-CB 4.18Å; L10-V105 HydrophobicContact CD2-CG1 3.5Å; L10-V105 VanDerWaalsContact CD2-CG1 3.5Å; L10-V105 HydrophobicContact CD2-CG2 3.59Å
11	S	94.8	Very high	88.5	Confident	67 Å²	67	56.5 Å²	56.5	47%	0.469	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.3	166.1	-169.7	0	0	0	0	109.3	L72	S11-L72 CarbonylContact C-O 3.49Å; S11-L72 WeakPolarHBondContact CA-O 2.98Å
12	I	95.8	Very high	90.2	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.1	175.5	-48.6	-178.8	0	0	0	107.9	L10 W28 F71 L72 Y85 V105	L10-I12 HydrophobicContact CD1-CG1 4.44Å; L10-I12 HydrophobicContact CD2-CD1 3.88Å; L10-I12 HydrophobicContact CD2-CG1 3.77Å; L10-I12 HydrophobicContact CG-CG1 3.87Å; I12-W28 HydrophobicContact CB-CH2 4.05Å; I12-W28 HydrophobicContact CB-CZ3 4.2Å; I12-W28 HydrophobicContact CG2-CH2 3.77Å; I12-W28 HydrophobicContact CG2-CZ3 3.79Å; I12-F71 CarbonylContact O-C 3.57Å; I12-F71 WeakPolarHBondContact O-CA 3.4Å; I12-L72 HydrophobicContact CB-CB 4.38Å; I12-L72 HydrophobicContact CD1-CD2 4.34Å; I12-L72 PolarHBondContact N-O 2.86Å; I12-L72 PolarHBondContact O-N 2.84Å; I12-Y85 HydrophobicContact CD1-CD1 3.77Å; I12-Y85 HydrophobicContact CD1-CD2 3.86Å; I12-Y85 HydrophobicContact CD1-CE1 4.42Å; I12-Y85 HydrophobicContact CD1-CG 3.44Å; I12-Y85 VanDerWaalsContact CD1-CG 3.44Å; I12-V105 HydrophobicContact CD1-CG2 3.9Å
13	T	97.1	Very high	91	Very high	70 Å²	70	57 Å²	57	43%	0.429	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	131.9	177.4	-55	0	0	0	0	110	Q69 F71	T13-Q69 HydrophobicContact CG2-CB 4.22Å; T13-Q69 HydrophobicContact CG2-CG 3.96Å; T13-F71 HydrophobicContact CG2-CD1 4Å; T13-F71 HydrophobicContact CG2-CE1 3.65Å; T13-F71 HydrophobicContact CG2-CZ 4.45Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.32Å; T13-F71 WeakPolarHBondContact OG1-CE1 3.37Å
14	C	96.3	Very high	91.6	Very high	11 Å²	11	57.1 Å²	57.1	7%	0.074	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.9	166.7	174.1	0	0	0	0	109.1	W28 Q69 V70 C87	C14-W28 HydrophobicContact CB-CH2 3.6Å; C14-W28 HydrophobicContact CB-CZ2 3.72Å; C14-W28 HydrophobicContact CB-CZ3 4.5Å; C14-Q69 CarbonylContact O-C 3.4Å; C14-Q69 WeakPolarHBondContact O-CA 3.32Å; C14-V70 PolarHBondContact N-O 3.27Å; C14-V70 PolarHBondContact O-N 2.76Å; C14-C87 HydrophobicContact CB-CB 3.44Å; C14-C87 VanDerWaalsContact CB-CB 3.44Å; C14-C87 WeakPolarHBondContact CB-SG 3.49Å; C14-C87 WeakPolarHBondContact SG-CB 3.43Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 2.8Å
15	T	96.1	Very high	92	Very high	95 Å²	95	56.2 Å²	56.2	58%	0.583	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.5	170.2	-54.4	0	0	0	0	108.3	S68 Q69	T15-S68 WeakPolarHBondContact CA-O 3.4Å; T15-Q69 HydrophobicContact CG2-CG 4.43Å; T15-Q69 PolarHBondContact OG1-NE2 2.86Å
16	V	93.1	Very high	92.5	Very high	15 Å²	15	54.4 Å²	54.4	9%	0.091	35%	0.352	C	S	.	.			trans	-97.1	150.8	179.2	-55.8	0	0	0	0	111	F19 L21 V26 S68	V16-F19 HydrophobicContact CB-CE1 3.84Å; V16-F19 HydrophobicContact CB-CE2 4.26Å; V16-F19 HydrophobicContact CB-CZ 3.63Å; V16-F19 HydrophobicContact CG1-CE1 4.22Å; V16-F19 HydrophobicContact CG1-CE2 4.35Å; V16-F19 HydrophobicContact CG1-CZ 3.63Å; V16-F19 HydrophobicContact CG2-CE1 4.46Å; V16-F19 HydrophobicContact CG2-CE2 4.17Å; V16-F19 HydrophobicContact CG2-CZ 4.04Å; V16-L21 HydrophobicContact CB-CD2 4.47Å; V16-L21 HydrophobicContact CG1-CD2 4.16Å; V16-L21 HydrophobicContact CG2-CD1 4.18Å; V16-L21 HydrophobicContact CG2-CD2 3.54Å; V16-L21 HydrophobicContact CG2-CG 3.69Å; V16-V26 HydrophobicContact CG1-CG2 4.13Å; V16-S68 WeakPolarHBondContact CG2-O 3.27Å; V16-S68 PolarHBondContact N-O 3Å
17	S	91.5	Very high	92.9	Very high	107 Å²	107	52.2 Å²	52.2	75%	0.748	34%	0.338	S	S	*	.			trans	-140.2	156.6	172.5	62.8	0	0	0	0	109.6	F19	S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 WeakPolarHBondContact O-CD1 3.28Å; S17-F19 PolarHBondContact O-N 3.17Å
18	G	89.1	Confident	93.3	Very high	89 Å²	89	47.7 Å²	47.7	92%	0.918	31%	0.305	S	S	*	.	S	Bend	trans	81	1	178.7	0	0	0	0	0	115.8
19	F	89.6	Confident	93.6	Very high	35 Å²	35	43 Å²	43	15%	0.154	28%	0.283	C	S	.	.	S	Bend	trans	-156	161.7	171.3	65.4	-85.9	0	0	0	112.2	V16 S17 L21 Y24 V26 K89	V16-F19 HydrophobicContact CB-CE1 3.84Å; V16-F19 HydrophobicContact CB-CE2 4.26Å; V16-F19 HydrophobicContact CB-CZ 3.63Å; V16-F19 HydrophobicContact CG1-CE1 4.22Å; V16-F19 HydrophobicContact CG1-CE2 4.35Å; V16-F19 HydrophobicContact CG1-CZ 3.63Å; V16-F19 HydrophobicContact CG2-CE1 4.46Å; V16-F19 HydrophobicContact CG2-CE2 4.17Å; V16-F19 HydrophobicContact CG2-CZ 4.04Å; S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 WeakPolarHBondContact O-CD1 3.28Å; S17-F19 PolarHBondContact O-N 3.17Å; F19-L21 HydrophobicContact CE2-CD2 4.01Å; F19-Y24 HydrophobicContact CB-CD2 3.81Å; F19-Y24 HydrophobicContact CB-CE2 4.18Å; F19-Y24 HydrophobicContact CD2-CD2 4.03Å; F19-Y24 HydrophobicContact CD2-CG 4.25Å; F19-Y24 HydrophobicContact CG-CD2 4.3Å; F19-V26 HydrophobicContact CE2-CG2 3.92Å; F19-V26 HydrophobicContact CZ-CG2 3.95Å; F19-K89 HydrophobicContact CD1-CD 3.97Å; F19-K89 HydrophobicContact CD1-CG 4.24Å; F19-K89 HydrophobicContact CD2-CG 4.4Å; F19-K89 HydrophobicContact CE1-CB 3.96Å; F19-K89 HydrophobicContact CE1-CD 4.13Å; F19-K89 HydrophobicContact CE1-CG 3.95Å; F19-K89 HydrophobicContact CE2-CG 4.1Å; F19-K89 HydrophobicContact CG-CD 4.19Å; F19-K89 HydrophobicContact CG-CG 4.45Å; F19-K89 HydrophobicContact CZ-CB 3.95Å; F19-K89 HydrophobicContact CZ-CD 4.48Å; F19-K89 HydrophobicContact CZ-CG 3.86Å
20	S	92.7	Very high	93.8	Very high	56 Å²	56	40.5 Å²	40.5	39%	0.392	26%	0.264	S	S	.	.			trans	-89.3	134.4	174.4	-178.3	0	0	0	0	111.8	T22 S23 Y24	S20-T22 PolarHBondContact O-N 3.25Å; S20-T22 PolarHBondContact OG-N 3.41Å; S20-T22 PolarHBondContact OG-OG1 2.81Å; S20-S23 PolarHBondContact O-N 2.97Å; S20-S23 VanDerWaalsContact O-N 3.08Å; S20-Y24 PolarHBondContact O-N 2.8Å
21	L	94.6	Very high	94.1	Very high	5 Å²	5	43 Å²	43	3%	0.026	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-10.2	173.6	-69.6	-177.9	0	0	0	114.1	V16 F19 V26 G45 K63 N65 V70	V16-L21 HydrophobicContact CB-CD2 4.47Å; V16-L21 HydrophobicContact CG1-CD2 4.16Å; V16-L21 HydrophobicContact CG2-CD1 4.18Å; V16-L21 HydrophobicContact CG2-CD2 3.54Å; V16-L21 HydrophobicContact CG2-CG 3.69Å; F19-L21 HydrophobicContact CE2-CD2 4.01Å; L21-V26 HydrophobicContact CD2-CG2 3.6Å; L21-G45 WeakPolarHBondContact O-CA 3.31Å; L21-K63 HydrophobicContact CB-CD 4.42Å; L21-K63 HydrophobicContact CD1-CB 4.39Å; L21-K63 PolarHBondContact O-NZ 3.14Å; L21-N65 VanDerWaalsContact CB-OD1 3.3Å; L21-N65 WeakPolarHBondContact CB-OD1 3.44Å; L21-V70 HydrophobicContact CD1-CG2 3.87Å; L21-V70 HydrophobicContact CD2-CG2 3.6Å; L21-V70 HydrophobicContact CG-CG2 4.42Å
22	T	94.3	Very high	94.1	Very high	81 Å²	81	40.4 Å²	40.4	50%	0.497	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-19.6	171.4	56.6	0	0	0	0	112.7	S20 G45 N65	S20-T22 PolarHBondContact O-N 3.25Å; S20-T22 PolarHBondContact OG-N 3.41Å; S20-T22 PolarHBondContact OG-OG1 2.81Å; T22-G45 CarbonylContact O-C 3.53Å; T22-G45 WeakPolarHBondContact O-CA 3.36Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.34Å
23	S	91.2	Very high	94.1	Very high	78 Å²	78	44.7 Å²	44.7	55%	0.545	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-23.6	-174.8	-53.7	0	0	0	0	113.3	S20	S20-S23 PolarHBondContact O-N 2.97Å; S20-S23 VanDerWaalsContact O-N 3.08Å
24	Y	91.1	Very high	94	Very high	84 Å²	84	45.8 Å²	45.8	33%	0.329	31%	0.31	S	S	.	.	S	Bend	trans	-133.5	152.8	-176.7	-63.1	-84.5	0	0	0	111.5	F19 S20	F19-Y24 HydrophobicContact CB-CD2 3.81Å; F19-Y24 HydrophobicContact CB-CE2 4.18Å; F19-Y24 HydrophobicContact CD2-CD2 4.03Å; F19-Y24 HydrophobicContact CD2-CG 4.25Å; F19-Y24 HydrophobicContact CG-CD2 4.3Å; S20-Y24 PolarHBondContact O-N 2.8Å
25	G	93.3	Very high	94	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	163.2	171.6	0	0	0	0	0	112.6	I43 Q90	G25-I43 CarbonylContact C-O 3.55Å; G25-I43 WeakPolarHBondContact CA-O 3.43Å; G25-Q90 PolarHBondContact N-O 2.94Å; G25-Q90 PolarHBondContact O-N 2.8Å
26	V	95.5	Very high	93.9	Very high	2 Å²	2	50 Å²	50	1%	0.012	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	120.8	170.7	179.9	0	0	0	0	108.9	V16 F19 L21 V42 I43 V70 C87 A88	V16-V26 HydrophobicContact CG1-CG2 4.13Å; F19-V26 HydrophobicContact CE2-CG2 3.92Å; F19-V26 HydrophobicContact CZ-CG2 3.95Å; L21-V26 HydrophobicContact CD2-CG2 3.6Å; V26-V42 WeakPolarHBondContact O-CA 3.24Å; V26-I43 PolarHBondContact N-O 2.71Å; V26-I43 PolarHBondContact O-N 3.46Å; V26-V70 HydrophobicContact CB-CB 4.48Å; V26-V70 HydrophobicContact CB-CG1 4.31Å; V26-V70 HydrophobicContact CB-CG2 3.93Å; V26-V70 HydrophobicContact CG1-CB 4.29Å; V26-V70 HydrophobicContact CG1-CG1 4.24Å; V26-V70 HydrophobicContact CG1-CG2 4.15Å; V26-V70 HydrophobicContact CG2-CG2 3.86Å; V26-C87 HydrophobicContact CG1-CB 3.96Å; V26-A88 CarbonylContact C-O 3.56Å; V26-A88 WeakPolarHBondContact CA-O 3.39Å
27	S	95.3	Very high	93.9	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.007	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	146.3	177.1	-75.2	0	0	0	0	110.9	W39 G41 V42 C87 A88 Q90 F96	S27-W39 PolarHBondContact OG-NE1 3.11Å; S27-G41 CarbonylContact C-O 3.6Å; S27-G41 VanDerWaalsContact CA-O 3.32Å; S27-G41 WeakPolarHBondContact CA-O 3.44Å; S27-V42 WeakPolarHBondContact OG-CB 3.45Å; S27-V42 WeakPolarHBondContact OG-CG2 3.28Å; S27-C87 CarbonylContact O-C 3.56Å; S27-C87 VanDerWaalsContact O-CA 3.27Å; S27-C87 WeakPolarHBondContact O-CA 3.29Å; S27-A88 PolarHBondContact N-O 2.78Å; S27-A88 PolarHBondContact O-N 3.22Å; S27-Q90 PolarHBondContact OG-OE1 3.32Å; S27-F96 VanDerWaalsContact CB-CE1 3.47Å
28	W	96.2	Very high	94.1	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.015	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.5	168.4	-73.6	98	0	0	0	109.9	I12 C14 L40 G41 V70 L72 Y86 C87	I12-W28 HydrophobicContact CB-CH2 4.05Å; I12-W28 HydrophobicContact CB-CZ3 4.2Å; I12-W28 HydrophobicContact CG2-CH2 3.77Å; I12-W28 HydrophobicContact CG2-CZ3 3.79Å; C14-W28 HydrophobicContact CB-CH2 3.6Å; C14-W28 HydrophobicContact CB-CZ2 3.72Å; C14-W28 HydrophobicContact CB-CZ3 4.5Å; W28-L40 HydrophobicContact CB-CB 4.15Å; W28-L40 HydrophobicContact CB-CD1 4.41Å; W28-L40 WeakPolarHBondContact O-CB 3.43Å; W28-L40 PolarHBondContact O-N 2.83Å; W28-G41 PolarHBondContact N-O 3.17Å; W28-V70 HydrophobicContact CZ2-CG1 4.44Å; W28-L72 HydrophobicContact CB-CD1 4.13Å; W28-L72 HydrophobicContact CB-CD2 4.3Å; W28-L72 HydrophobicContact CD2-CB 3.64Å; W28-L72 HydrophobicContact CD2-CD1 4.37Å; W28-L72 HydrophobicContact CD2-CD2 4.02Å; W28-L72 HydrophobicContact CD2-CG 4.24Å; W28-L72 HydrophobicContact CE3-CB 4.03Å; W28-L72 HydrophobicContact CE3-CD2 3.93Å; W28-L72 HydrophobicContact CG-CB 4.05Å; W28-L72 HydrophobicContact CG-CD1 3.91Å; W28-L72 HydrophobicContact CG-CD2 4.19Å; W28-L72 HydrophobicContact CG-CG 4.29Å; W28-L72 HydrophobicContact CH2-CB 4.16Å; W28-L72 HydrophobicContact CZ2-CB 3.8Å; W28-L72 HydrophobicContact CZ3-CB 4.27Å; W28-Y86 WeakPolarHBondContact CA-O 3.29Å; W28-C87 HydrophobicContact CD2-CB 4.4Å; W28-C87 HydrophobicContact CE3-CB 4.21Å; W28-C87 HydrophobicContact CH2-CB 4.25Å; W28-C87 HydrophobicContact CZ2-CB 4.41Å; W28-C87 HydrophobicContact CZ3-CB 4.14Å
29	V	95.4	Very high	94.3	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.8	-179.6	-177.8	0	0	0	0	107.4	L37 E38 Y86 W99	V29-L37 HydrophobicContact CG1-CB 3.86Å; V29-L37 HydrophobicContact CG1-CD2 3.93Å; V29-L37 HydrophobicContact CG1-CG 4.37Å; V29-E38 CarbonylContact C-O 3.47Å; V29-E38 VanDerWaalsContact CA-O 3.31Å; V29-E38 WeakPolarHBondContact CA-O 3.41Å; V29-E38 WeakPolarHBondContact CG1-O 3.25Å; V29-Y86 PolarHBondContact N-O 3.34Å; V29-Y86 PolarHBondContact O-N 2.85Å; V29-W99 HydrophobicContact CB-CH2 3.99Å; V29-W99 HydrophobicContact CB-CZ3 3.77Å; V29-W99 HydrophobicContact CG1-CH2 3.96Å; V29-W99 HydrophobicContact CG1-CZ3 3.96Å; V29-W99 HydrophobicContact CG2-CH2 3.75Å; V29-W99 HydrophobicContact CG2-CZ3 3.93Å
30	R	95.7	Very high	94.5	Very high	18 Å²	18	49.5 Å²	49.5	7%	0.068	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	154.6	171.1	71.6	177.6	179.5	-177.1	2.4	111.6	E38 L40 D81 A83 T84 Y85	R30-E38 HydrophobicContact CG-CB 4.15Å; R30-E38 IonicContact CZ-OE2 3.62Å; R30-E38 VanDerWaalsContact CZ-OE2 3.25Å; R30-E38 PolarHBondContact N-O 2.92Å; R30-E38 IonicContact NE-OE2 3.56Å; R30-E38 PolarHBondContact NE-OE2 2.92Å; R30-E38 IonicContact NH2-OE1 2.85Å; R30-E38 IonicContact NH2-OE2 3.99Å; R30-E38 PolarHBondContact NH2-OE2 3.32Å; R30-E38 PolarHBondContact O-N 2.84Å; R30-L40 HydrophobicContact CB-CD1 4.11Å; R30-L40 HydrophobicContact CB-CG 4.47Å; R30-L40 HydrophobicContact CG-CD1 4.21Å; R30-L40 HydrophobicContact CG-CD2 3.85Å; R30-L40 HydrophobicContact CG-CG 4.2Å; R30-D81 IonicContact CZ-OD1 2.86Å; R30-D81 IonicContact NH1-OD1 3.74Å; R30-D81 PolarHBondContact NH1-OD1 2.85Å; R30-A83 HydrophobicContact CB-CB 3.87Å; R30-A83 HydrophobicContact CG-CB 4.24Å; R30-T84 CarbonylContact C-O 3.54Å; R30-T84 VanDerWaalsContact CA-O 3.24Å; R30-T84 WeakPolarHBondContact CA-O 3.45Å; R30-Y85 HydrophobicContact CB-CD1 3.87Å; R30-Y85 HydrophobicContact CB-CE1 3.88Å; R30-Y85 HydrophobicContact CB-CG 4.25Å
31	Q	96.7	Very high	94.6	Very high	75 Å²	75	46.9 Å²	46.9	35%	0.35	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	102.2	171.7	-165.4	177.2	20.1	0	0	109.6	K35 L37 A83 T84 Y86	Q31-K35 WeakPolarHBondContact CG-O 3.28Å; Q31-K35 PolarHBondContact NE2-O 3.37Å; Q31-L37 HydrophobicContact CB-CD2 3.95Å; Q31-L37 HydrophobicContact CG-CD2 4.27Å; Q31-A83 WeakPolarHBondContact O-CA 3.45Å; Q31-A83 WeakPolarHBondContact O-CB 3.34Å; Q31-T84 PolarHBondContact N-O 3.48Å; Q31-T84 PolarHBondContact O-N 3.05Å; Q31-Y86 HydrophobicContact CB-CE2 3.89Å
32	P	95.8	Very high	94.6	Very high	13 Å²	13	46.8 Å²	46.8	8%	0.084	28%	0.276	C	S	.	.			trans	-65.5	151.6	170.5	-18.3	31.3	0	0	0	111.1	G34 K35 A83	P32-G34 PolarHBondContact O-N 2.64Å; P32-K35 HydrophobicContact CB-CB 4.07Å; P32-K35 HydrophobicContact CB-CD 3.97Å; P32-K35 HydrophobicContact CB-CG 4.2Å; P32-K35 HydrophobicContact CG-CB 4.3Å; P32-K35 HydrophobicContact CG-CD 4.24Å; P32-K35 PolarHBondContact O-N 2.92Å; P32-A83 HydrophobicContact CG-CB 4.41Å
33	P	95.1	Very high	94.8	Very high	95 Å²	95	43.4 Å²	43.4	62%	0.617	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	127.9	177	-25.7	34.2	0	0	0	112.1	K35 T82	P33-K35 PolarHBondContact O-N 3.21Å; P33-T82 VanDerWaalsContact CD-O 3.32Å; P33-T82 WeakPolarHBondContact CD-O 3.01Å; P33-T82 HydrophobicContact CG-CG2 4.35Å
34	G	95.9	Very high	95	Very high	93 Å²	93	42.4 Å²	42.4	96%	0.959	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.5	8.5	179.9	0	0	0	0	0	115.5	P32	P32-G34 PolarHBondContact O-N 2.64Å
35	K	95.3	Very high	95.1	Very high	139 Å²	139	39.2 Å²	39.2	60%	0.604	23%	0.232	S	C	*	.	S	Bend	trans	-117.2	166.6	178.3	-58.9	-170.3	-174	174.1	0	112.1	Q31 P32 P33	Q31-K35 WeakPolarHBondContact CG-O 3.28Å; Q31-K35 PolarHBondContact NE2-O 3.37Å; P32-K35 HydrophobicContact CB-CB 4.07Å; P32-K35 HydrophobicContact CB-CD 3.97Å; P32-K35 HydrophobicContact CB-CG 4.2Å; P32-K35 HydrophobicContact CG-CB 4.3Å; P32-K35 HydrophobicContact CG-CD 4.24Å; P32-K35 PolarHBondContact O-N 2.92Å; P33-K35 PolarHBondContact O-N 3.21Å
36	G	94.3	Very high	95.1	Very high	55 Å²	55	45.4 Å²	45.4	57%	0.567	27%	0.265	S	S	*	.			trans	-72.4	175.9	173.1	0	0	0	0	0	113.2
37	L	94.4	Very high	95.1	Very high	102 Å²	102	47 Å²	47	53%	0.534	28%	0.281	S	S	.	.			trans	-68.5	132.5	173.7	-66.2	173.2	0	0	0	110.7	V29 Q31 Y86 W99	V29-L37 HydrophobicContact CG1-CB 3.86Å; V29-L37 HydrophobicContact CG1-CD2 3.93Å; V29-L37 HydrophobicContact CG1-CG 4.37Å; Q31-L37 HydrophobicContact CB-CD2 3.95Å; Q31-L37 HydrophobicContact CG-CD2 4.27Å; L37-Y86 HydrophobicContact CD2-CD2 4.48Å; L37-Y86 HydrophobicContact CD2-CE2 4.36Å; L37-W99 HydrophobicContact CD1-CH2 4.05Å
38	E	93.9	Very high	95.1	Very high	49 Å²	49	49.4 Å²	49.4	23%	0.229	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.3	175.1	-176.1	-175	-175.9	0	0	109.1	V29 R30 H52	V29-E38 CarbonylContact C-O 3.47Å; V29-E38 VanDerWaalsContact CA-O 3.31Å; V29-E38 WeakPolarHBondContact CA-O 3.41Å; V29-E38 WeakPolarHBondContact CG1-O 3.25Å; R30-E38 HydrophobicContact CG-CB 4.15Å; R30-E38 IonicContact CZ-OE2 3.62Å; R30-E38 VanDerWaalsContact CZ-OE2 3.25Å; R30-E38 PolarHBondContact N-O 2.92Å; R30-E38 IonicContact NE-OE2 3.56Å; R30-E38 PolarHBondContact NE-OE2 2.92Å; R30-E38 IonicContact NH2-OE1 2.85Å; R30-E38 IonicContact NH2-OE2 3.99Å; R30-E38 PolarHBondContact NH2-OE2 3.32Å; R30-E38 PolarHBondContact O-N 2.84Å; E38-H52 IonicContact OE1-CE1 3.25Å; E38-H52 IonicContact OE1-ND1 2.76Å
39	W	93.8	Very high	95.1	Very high	84 Å²	84	51.5 Å²	51.5	32%	0.318	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	133.5	173.5	178.9	83.8	0	0	0	110.3	S27 G41 V42 N50 Y51 H52	S27-W39 PolarHBondContact OG-NE1 3.11Å; W39-G41 PolarHBondContact NE1-O 3.24Å; W39-V42 HydrophobicContact CZ2-CB 4Å; W39-V42 HydrophobicContact CZ2-CG1 3.83Å; W39-N50 HydrophobicContact CH2-CB 4.05Å; W39-Y51 VanDerWaalsContact CZ3-C 3.49Å; W39-H52 HydrophobicContact CE3-CB 4.05Å; W39-H52 HydrophobicContact CZ3-CB 4.22Å; W39-H52 VanDerWaalsContact O-CB 3.28Å; W39-H52 WeakPolarHBondContact O-CB 3.45Å
40	L	94.7	Very high	95	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-36.8	-176.3	-61.6	-176.1	0	0	0	112.8	W28 R30 H52 L55 L59 L72 Y85	W28-L40 HydrophobicContact CB-CB 4.15Å; W28-L40 HydrophobicContact CB-CD1 4.41Å; W28-L40 WeakPolarHBondContact O-CB 3.43Å; W28-L40 PolarHBondContact O-N 2.83Å; R30-L40 HydrophobicContact CB-CD1 4.11Å; R30-L40 HydrophobicContact CB-CG 4.47Å; R30-L40 HydrophobicContact CG-CD1 4.21Å; R30-L40 HydrophobicContact CG-CD2 3.85Å; R30-L40 HydrophobicContact CG-CG 4.2Å; L40-H52 PolarHBondContact O-N 3.29Å; L40-L55 HydrophobicContact CD2-CD1 3.38Å; L40-L59 HydrophobicContact CB-CD1 4.01Å; L40-L59 HydrophobicContact CD2-CD1 4.4Å; L40-L72 HydrophobicContact CD1-CD2 3.82Å; L40-Y85 HydrophobicContact CD1-CD1 3.83Å; L40-Y85 HydrophobicContact CD1-CE1 3.71Å
41	G	94.9	Very high	94.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.7	173.7	-174.6	0	0	0	0	0	112.2	S27 W28 W39 N50 I61	S27-G41 CarbonylContact C-O 3.6Å; S27-G41 VanDerWaalsContact CA-O 3.32Å; S27-G41 WeakPolarHBondContact CA-O 3.44Å; W28-G41 PolarHBondContact N-O 3.17Å; W39-G41 PolarHBondContact NE1-O 3.24Å; G41-N50 CarbonylContact C-O 3.46Å; G41-N50 WeakPolarHBondContact CA-O 3.35Å; G41-I61 VanDerWaalsContact C-CD1 3.5Å
42	V	95.1	Very high	94.5	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.018	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	147.2	178.7	65.6	0	0	0	0	109.6	V26 S27 W39 W44 T49 N50 Q90	V26-V42 WeakPolarHBondContact O-CA 3.24Å; S27-V42 WeakPolarHBondContact OG-CB 3.45Å; S27-V42 WeakPolarHBondContact OG-CG2 3.28Å; W39-V42 HydrophobicContact CZ2-CB 4Å; W39-V42 HydrophobicContact CZ2-CG1 3.83Å; V42-W44 HydrophobicContact CG1-CD2 4.42Å; V42-W44 HydrophobicContact CG1-CZ2 3.85Å; V42-W44 HydrophobicContact CG2-CD2 4.25Å; V42-W44 HydrophobicContact CG2-CZ2 4.35Å; V42-T49 VanDerWaalsContact O-CA 3.25Å; V42-T49 WeakPolarHBondContact O-CA 3.44Å; V42-N50 HydrophobicContact CG1-CB 3.95Å; V42-N50 PolarHBondContact N-O 2.85Å; V42-N50 PolarHBondContact O-N 3.14Å; V42-Q90 HydrophobicContact CG2-CB 4.09Å; V42-Q90 HydrophobicContact CG2-CG 4.16Å
43	I	96.4	Very high	94	Very high	10 Å²	10	60.7 Å²	60.7	5%	0.051	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.3	161.5	-172.4	163.1	0	0	0	109.1	G25 V26 S48 T49 I61 K63 V70	G25-I43 CarbonylContact C-O 3.55Å; 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 3.42Å; I43-T49 HydrophobicContact CB-CG2 3.94Å; I43-T49 HydrophobicContact CD1-CG2 4.01Å; I43-T49 HydrophobicContact CG1-CG2 3.8Å; I43-I61 HydrophobicContact CB-CG2 3.68Å; I43-I61 HydrophobicContact CG2-CG2 3.64Å; I43-K63 HydrophobicContact CD1-CB 4.06Å; I43-K63 HydrophobicContact CD1-CD 3.85Å; I43-K63 HydrophobicContact CD1-CG 3.72Å; I43-K63 HydrophobicContact CG1-CD 4.09Å; I43-V70 HydrophobicContact CG2-CG1 3.69Å
44	W	95.6	Very high	93.4	Very high	57 Å²	57	59.6 Å²	59.6	22%	0.216	37%	0.365	C	S	.	.			trans	-86.6	170.5	-176.9	-63.7	106.7	0	0	0	112.3	V42 D46 G47 S48 N50 K63 Q90	V42-W44 HydrophobicContact CG1-CD2 4.42Å; V42-W44 HydrophobicContact CG1-CZ2 3.85Å; V42-W44 HydrophobicContact CG2-CD2 4.25Å; V42-W44 HydrophobicContact CG2-CZ2 4.35Å; W44-D46 VanDerWaalsContact C-N 3.26Å; W44-D46 VanDerWaalsContact CB-OD1 3.32Å; W44-D46 WeakPolarHBondContact CB-OD1 3.33Å; W44-D46 PolarHBondContact O-N 2.87Å; W44-G47 WeakPolarHBondContact O-CA 3.45Å; W44-G47 PolarHBondContact O-N 2.97Å; W44-S48 VanDerWaalsContact CD1-OG 3.24Å; W44-S48 PolarHBondContact N-O 2.82Å; W44-N50 PolarHBondContact NE1-ND2 3.25Å; W44-K63 PolarHBondContact O-NZ 2.91Å; W44-Q90 HydrophobicContact CE3-CG 4.27Å; W44-Q90 HydrophobicContact CH2-CG 3.46Å; W44-Q90 VanDerWaalsContact CH2-CG 3.46Å; W44-Q90 HydrophobicContact CZ2-CG 4.43Å; W44-Q90 HydrophobicContact CZ3-CB 4.3Å; W44-Q90 HydrophobicContact CZ3-CG 3.37Å
45	G	93.8	Very high	92.5	Very high	17 Å²	17	55.7 Å²	55.7	18%	0.175	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-38	179.9	0	0	0	0	0	113.4	L21 T22 G47 K63	L21-G45 WeakPolarHBondContact O-CA 3.31Å; T22-G45 CarbonylContact O-C 3.53Å; T22-G45 WeakPolarHBondContact O-CA 3.36Å; G45-G47 PolarHBondContact O-N 3.05Å; G45-K63 VanDerWaalsContact C-NZ 3.29Å; G45-K63 PolarHBondContact O-NZ 3.11Å
46	D	94.3	Very high	91.8	Very high	131 Å²	131	53.9 Å²	53.9	70%	0.701	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-9.4	175.6	68.6	-6.9	0	0	0	114.1	W44 S48	W44-D46 VanDerWaalsContact C-N 3.26Å; W44-D46 VanDerWaalsContact CB-OD1 3.32Å; W44-D46 WeakPolarHBondContact CB-OD1 3.33Å; W44-D46 PolarHBondContact O-N 2.87Å; D46-S48 WeakPolarHBondContact OD1-CB 3.33Å; D46-S48 PolarHBondContact OD1-N 3.23Å; D46-S48 PolarHBondContact OD1-OG 3.43Å; D46-S48 PolarHBondContact OD2-OG 3.13Å
47	G	95.1	Very high	91.6	Very high	35 Å²	35	56.3 Å²	56.3	36%	0.361	33%	0.326	S	S	.	.	S	Bend	trans	91.5	-1	-178.8	0	0	0	0	0	114.7	W44 G45	W44-G47 WeakPolarHBondContact O-CA 3.45Å; W44-G47 PolarHBondContact O-N 2.97Å; G45-G47 PolarHBondContact O-N 3.05Å
48	S	95.3	Very high	91.4	Very high	52 Å²	52	53 Å²	53	36%	0.364	31%	0.306	S	S	.	.			trans	-64.6	151.5	171.1	65.9	0	0	0	0	110.9	I43 W44 D46	I43-S48 WeakPolarHBondContact CA-O 3.42Å; W44-S48 VanDerWaalsContact CD1-OG 3.24Å; W44-S48 PolarHBondContact N-O 2.82Å; D46-S48 WeakPolarHBondContact OD1-CB 3.33Å; D46-S48 PolarHBondContact OD1-N 3.23Å; D46-S48 PolarHBondContact OD1-OG 3.43Å; D46-S48 PolarHBondContact OD2-OG 3.13Å
49	T	95.4	Very high	91.3	Very high	48 Å²	48	51.2 Å²	51.2	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.6	-177.1	54.3	0	0	0	0	111.6	V42 I43 Y51	V42-T49 VanDerWaalsContact O-CA 3.25Å; V42-T49 WeakPolarHBondContact O-CA 3.44Å; I43-T49 HydrophobicContact CB-CG2 3.94Å; I43-T49 HydrophobicContact CD1-CG2 4.01Å; I43-T49 HydrophobicContact CG1-CG2 3.8Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.42Å; T49-Y51 PolarHBondContact OG1-OH 2.74Å
50	N	93.9	Very high	91.4	Very high	89 Å²	89	49.7 Å²	49.7	48%	0.476	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147	167.1	-65.5	-36.3	0	0	0	108.9	W39 G41 V42 W44	W39-N50 HydrophobicContact CH2-CB 4.05Å; G41-N50 CarbonylContact C-O 3.46Å; G41-N50 WeakPolarHBondContact CA-O 3.35Å; V42-N50 HydrophobicContact CG1-CB 3.95Å; V42-N50 PolarHBondContact N-O 2.85Å; V42-N50 PolarHBondContact O-N 3.14Å; W44-N50 PolarHBondContact NE1-ND2 3.25Å
51	Y	93.1	Very high	91.5	Very high	53 Å²	53	50 Å²	50	21%	0.208	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	154.6	-176.9	-60.6	-85.9	0	0	0	111.1	W39 T49 S53 I56 L59 I61	W39-Y51 VanDerWaalsContact CZ3-C 3.49Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.42Å; T49-Y51 PolarHBondContact OG1-OH 2.74Å; Y51-S53 PolarHBondContact O-N 3.5Å; Y51-I56 HydrophobicContact CD2-CD1 4.15Å; Y51-I56 HydrophobicContact CD2-CG1 3.99Å; Y51-I56 HydrophobicContact CG-CD1 4.48Å; Y51-I56 HydrophobicContact CG-CG1 4.04Å; Y51-L59 HydrophobicContact CD1-CB 4.07Å; Y51-L59 HydrophobicContact CE1-CB 4.29Å; Y51-I61 HydrophobicContact CD1-CD1 4.2Å; Y51-I61 HydrophobicContact CE1-CB 4.29Å; Y51-I61 HydrophobicContact CE1-CD1 3.91Å; Y51-I61 HydrophobicContact CE1-CG1 3.89Å; Y51-I61 PolarHBondContact OH-N 2.87Å
52	H	89.5	Confident	91.6	Very high	62 Å²	62	52.6 Å²	52.6	29%	0.287	32%	0.321	S	S	.	.			trans	-67.2	124.3	164.2	-170.8	-119.3	0	0	0	109.3	E38 W39 L40 A54 L55 I56	E38-H52 IonicContact OE1-CE1 3.25Å; E38-H52 IonicContact OE1-ND1 2.76Å; W39-H52 HydrophobicContact CE3-CB 4.05Å; W39-H52 HydrophobicContact CZ3-CB 4.22Å; W39-H52 VanDerWaalsContact O-CB 3.28Å; W39-H52 WeakPolarHBondContact O-CB 3.45Å; L40-H52 PolarHBondContact O-N 3.29Å; H52-A54 PolarHBondContact O-N 3.22Å; H52-A54 VanDerWaalsContact O-N 3.14Å; H52-L55 PolarHBondContact O-N 2.83Å; H52-I56 PolarHBondContact O-N 2.94Å
53	S	84.1	Confident	91.7	Very high	100 Å²	100	54.6 Å²	54.6	70%	0.699	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-57.7	-34.1	-169.3	54.1	0	0	0	0	113.4	Y51 L55 I56	Y51-S53 PolarHBondContact O-N 3.5Å; S53-L55 PolarHBondContact O-N 2.78Å; S53-I56 WeakPolarHBondContact O-CG2 3.01Å
54	A	81.9	Confident	91.8	Very high	72 Å²	72	56 Å²	56	60%	0.595	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18.5	179	0	0	0	0	0	114.1	H52	H52-A54 PolarHBondContact O-N 3.22Å; H52-A54 VanDerWaalsContact O-N 3.14Å
55	L	77.8	Confident	91.8	Very high	11 Å²	11	56.7 Å²	56.7	6%	0.058	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-121.9	0.2	-171.4	-61.5	173.2	0	0	0	113.5	L40 H52 S53 S57 R58 L59	L40-L55 HydrophobicContact CD2-CD1 3.38Å; H52-L55 PolarHBondContact O-N 2.83Å; S53-L55 PolarHBondContact O-N 2.78Å; L55-S57 PolarHBondContact O-N 3.07Å; L55-S57 VanDerWaalsContact O-N 3.14Å; L55-R58 PolarHBondContact O-N 3.39Å; L55-L59 HydrophobicContact CB-CD1 3.46Å; L55-L59 VanDerWaalsContact CB-CD1 3.46Å; L55-L59 HydrophobicContact CB-CG 4.05Å; L55-L59 HydrophobicContact CD1-CD1 4.19Å; L55-L59 HydrophobicContact CG-CD1 4.47Å; L55-L59 PolarHBondContact O-N 3Å; L55-L59 VanDerWaalsContact O-N 3.13Å
56	I	81.4	Confident	91.9	Very high	100 Å²	100	60.9 Å²	60.9	51%	0.513	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.7	-173.4	-164	166.5	0	0	0	113.9	Y51 H52 S53 R58	Y51-I56 HydrophobicContact CD2-CD1 4.15Å; Y51-I56 HydrophobicContact CD2-CG1 3.99Å; Y51-I56 HydrophobicContact CG-CD1 4.48Å; Y51-I56 HydrophobicContact CG-CG1 4.04Å; H52-I56 PolarHBondContact O-N 2.94Å; S53-I56 WeakPolarHBondContact O-CG2 3.01Å; I56-R58 VanDerWaalsContact C-N 3.29Å; I56-R58 PolarHBondContact O-N 2.9Å
57	S	88.3	Confident	92	Very high	107 Å²	107	60.5 Å²	60.5	75%	0.748	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.9	-179.7	59.4	0	0	0	0	113.9	L55	L55-S57 PolarHBondContact O-N 3.07Å; L55-S57 VanDerWaalsContact O-N 3.14Å
58	R	91.8	Very high	92.1	Very high	31 Å²	31	61 Å²	61	12%	0.117	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-17.1	-174.1	-59.2	-167.3	-58.8	121.7	0.6	113.3	L55 I56 L74 N75 S76 D81	L55-R58 PolarHBondContact O-N 3.39Å; I56-R58 VanDerWaalsContact C-N 3.29Å; I56-R58 PolarHBondContact O-N 2.9Å; R58-L74 HydrophobicContact CB-CD1 4.02Å; R58-L74 WeakPolarHBondContact O-CA 3.49Å; R58-N75 PolarHBondContact O-N 2.85Å; R58-S76 PolarHBondContact NH1-O 2.81Å; R58-S76 VanDerWaalsContact NH1-O 3.11Å; R58-D81 IonicContact CZ-OD1 3.75Å; R58-D81 IonicContact CZ-OD2 3.56Å; R58-D81 IonicContact NH1-OD1 3.62Å; R58-D81 IonicContact NH1-OD2 2.71Å; R58-D81 PolarHBondContact NH1-OD2 2.9Å; R58-D81 IonicContact NH2-OD1 2.91Å; R58-D81 PolarHBondContact NH2-OD1 2.89Å; R58-D81 IonicContact NH2-OD2 3.46Å; R58-D81 PolarHBondContact NH2-OD2 2.89Å
59	L	92	Very high	92.2	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.068	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	145.4	-176.3	-74.6	176.6	0	0	0	113	L40 Y51 L55 L72 K73 L74	L40-L59 HydrophobicContact CB-CD1 4.01Å; L40-L59 HydrophobicContact CD2-CD1 4.4Å; Y51-L59 HydrophobicContact CD1-CB 4.07Å; Y51-L59 HydrophobicContact CE1-CB 4.29Å; L55-L59 HydrophobicContact CB-CD1 3.46Å; L55-L59 VanDerWaalsContact CB-CD1 3.46Å; L55-L59 HydrophobicContact CB-CG 4.05Å; L55-L59 HydrophobicContact CD1-CD1 4.19Å; L55-L59 HydrophobicContact CG-CD1 4.47Å; L55-L59 PolarHBondContact O-N 3Å; L55-L59 VanDerWaalsContact O-N 3.13Å; L59-L72 HydrophobicContact CD2-CD1 3.72Å; L59-L72 HydrophobicContact CD2-CG 4.26Å; L59-K73 CarbonylContact C-O 3.59Å; L59-K73 WeakPolarHBondContact CA-O 3.08Å; L59-L74 HydrophobicContact CD2-CB 4.11Å; L59-L74 HydrophobicContact CD2-CD1 3.38Å; L59-L74 HydrophobicContact CD2-CG 4.24Å; L59-L74 HydrophobicContact CG-CD1 3.89Å
60	S	95.1	Very high	92.3	Very high	51 Å²	51	58.4 Å²	58.4	36%	0.357	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	130.4	166.1	173.7	0	0	0	0	109	K73	S60-K73 PolarHBondContact N-O 2.82Å; S60-K73 PolarHBondContact O-N 2.81Å
61	I	97.1	Very high	92.5	Very high	8 Å²	8	56 Å²	56	4%	0.041	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.6	175.7	-59.5	164.4	0	0	0	108.2	G41 I43 Y51 V70 F71 L72	G41-I61 VanDerWaalsContact C-CD1 3.5Å; I43-I61 HydrophobicContact CB-CG2 3.68Å; I43-I61 HydrophobicContact CG2-CG2 3.64Å; Y51-I61 HydrophobicContact CD1-CD1 4.2Å; Y51-I61 HydrophobicContact CE1-CB 4.29Å; Y51-I61 HydrophobicContact CE1-CD1 3.91Å; Y51-I61 HydrophobicContact CE1-CG1 3.89Å; Y51-I61 PolarHBondContact OH-N 2.87Å; I61-V70 HydrophobicContact CG2-CG1 4.08Å; I61-F71 WeakPolarHBondContact CA-O 3.27Å; I61-L72 HydrophobicContact CD1-CD1 4.35Å; I61-L72 HydrophobicContact CG1-CD1 3.72Å
62	S	97.4	Very high	92.7	Very high	55 Å²	55	53.6 Å²	53.6	39%	0.385	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	169.3	175.9	67.2	0	0	0	0	110.9	V70 F71	S62-V70 CarbonylContact O-C 3.54Å; S62-V70 WeakPolarHBondContact O-CA 3.2Å; S62-V70 WeakPolarHBondContact O-CG1 3.41Å; S62-F71 PolarHBondContact N-O 3.32Å; S62-F71 PolarHBondContact O-N 2.99Å
63	K	97.6	Very high	93	Very high	45 Å²	45	55.3 Å²	55.3	20%	0.196	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	151.8	178.3	69.1	-175.8	-174.6	180	0	112.5	L21 I43 W44 G45 N65 Q69 V70	L21-K63 HydrophobicContact CB-CD 4.42Å; L21-K63 HydrophobicContact CD1-CB 4.39Å; L21-K63 PolarHBondContact O-NZ 3.14Å; I43-K63 HydrophobicContact CD1-CB 4.06Å; I43-K63 HydrophobicContact CD1-CD 3.85Å; I43-K63 HydrophobicContact CD1-CG 3.72Å; I43-K63 HydrophobicContact CG1-CD 4.09Å; W44-K63 PolarHBondContact O-NZ 2.91Å; G45-K63 VanDerWaalsContact C-NZ 3.29Å; G45-K63 PolarHBondContact O-NZ 3.11Å; K63-N65 WeakPolarHBondContact CD-OD1 3.27Å; K63-N65 WeakPolarHBondContact CE-OD1 3.43Å; K63-Q69 CarbonylContact C-O 3.58Å; K63-Q69 VanDerWaalsContact CA-O 3.28Å; K63-Q69 WeakPolarHBondContact CA-O 3.2Å; K63-V70 HydrophobicContact CB-CG2 4.13Å
64	D	97.4	Very high	93.4	Very high	38 Å²	38	50.8 Å²	50.8	20%	0.203	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	100.2	169.2	-176.2	-16	0	0	0	108.3	S66 K67 S68 Q69 F71	D64-S66 PolarHBondContact O-N 3.22Å; D64-S66 WeakPolarHBondContact OD1-CB 3.33Å; D64-S66 PolarHBondContact OD1-N 3.05Å; D64-S66 PolarHBondContact OD1-OG 2.86Å; D64-K67 HydrophobicContact CB-CB 4.39Å; D64-K67 PolarHBondContact O-N 2.85Å; D64-K67 PolarHBondContact OD1-N 2.87Å; D64-K67 WeakPolarHBondContact OD2-CD 3.5Å; D64-K67 WeakPolarHBondContact OD2-CE 3.26Å; D64-K67 WeakPolarHBondContact OD2-CG 3.44Å; D64-K67 IonicContact OD2-NZ 2.76Å; D64-K67 PolarHBondContact OD2-NZ 3.02Å; D64-S68 PolarHBondContact O-N 3.37Å; D64-Q69 PolarHBondContact N-O 3.01Å; D64-Q69 PolarHBondContact O-N 3.31Å; D64-F71 HydrophobicContact CB-CE2 3.89Å; D64-F71 HydrophobicContact CB-CZ 4.42Å
65	N	96.3	Very high	93.9	Very high	73 Å²	73	49.6 Å²	49.6	39%	0.39	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-62.5	-33.1	-179.3	-64.8	-16.9	0	0	0	111.9	L21 T22 K63 K67 S68	L21-N65 VanDerWaalsContact CB-OD1 3.3Å; L21-N65 WeakPolarHBondContact CB-OD1 3.44Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.34Å; K63-N65 WeakPolarHBondContact CD-OD1 3.27Å; K63-N65 WeakPolarHBondContact CE-OD1 3.43Å; N65-K67 PolarHBondContact O-N 3.49Å; N65-S68 PolarHBondContact O-N 3.35Å
66	S	95.7	Very high	94.6	Very high	105 Å²	105	52.3 Å²	52.3	73%	0.734	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-67.3	-27.9	-178.3	74.4	0	0	0	0	112.4	D64	D64-S66 PolarHBondContact O-N 3.22Å; D64-S66 WeakPolarHBondContact OD1-CB 3.33Å; D64-S66 PolarHBondContact OD1-N 3.05Å; D64-S66 PolarHBondContact OD1-OG 2.86Å
67	K	96.8	Very high	95	Very high	123 Å²	123	47.7 Å²	47.7	54%	0.535	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-102.1	-1.8	178.2	-61.1	-172.7	-169.9	113.1	0	113.5	D64 N65 Q69	D64-K67 HydrophobicContact CB-CB 4.39Å; D64-K67 PolarHBondContact O-N 2.85Å; D64-K67 PolarHBondContact OD1-N 2.87Å; D64-K67 WeakPolarHBondContact OD2-CD 3.5Å; D64-K67 WeakPolarHBondContact OD2-CE 3.26Å; D64-K67 WeakPolarHBondContact OD2-CG 3.44Å; D64-K67 IonicContact OD2-NZ 2.76Å; D64-K67 PolarHBondContact OD2-NZ 3.02Å; N65-K67 PolarHBondContact O-N 3.49Å; K67-Q69 HydrophobicContact CB-CB 4.26Å; K67-Q69 HydrophobicContact CB-CG 4.05Å; K67-Q69 PolarHBondContact O-N 3.48Å
68	S	96.3	Very high	95.2	Very high	44 Å²	44	47.3 Å²	47.3	31%	0.308	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	44.3	-170.5	-58.3	0	0	0	0	112	T15 V16 D64 N65	T15-S68 WeakPolarHBondContact CA-O 3.4Å; V16-S68 WeakPolarHBondContact CG2-O 3.27Å; V16-S68 PolarHBondContact N-O 3Å; D64-S68 PolarHBondContact O-N 3.37Å; N65-S68 PolarHBondContact O-N 3.35Å
69	Q	97.8	Very high	95.1	Very high	46 Å²	46	49.5 Å²	49.5	22%	0.215	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.8	-176.8	-76.4	176.1	-14.4	0	0	112.3	T13 C14 T15 K63 D64 K67 F71	T13-Q69 HydrophobicContact CG2-CB 4.22Å; T13-Q69 HydrophobicContact CG2-CG 3.96Å; C14-Q69 CarbonylContact O-C 3.4Å; C14-Q69 WeakPolarHBondContact O-CA 3.32Å; T15-Q69 HydrophobicContact CG2-CG 4.43Å; T15-Q69 PolarHBondContact OG1-NE2 2.86Å; K63-Q69 CarbonylContact C-O 3.58Å; K63-Q69 VanDerWaalsContact CA-O 3.28Å; K63-Q69 WeakPolarHBondContact CA-O 3.2Å; D64-Q69 PolarHBondContact N-O 3.01Å; D64-Q69 PolarHBondContact O-N 3.31Å; K67-Q69 HydrophobicContact CB-CB 4.26Å; K67-Q69 HydrophobicContact CB-CG 4.05Å; K67-Q69 PolarHBondContact O-N 3.48Å; Q69-F71 HydrophobicContact CB-CE1 4.28Å; Q69-F71 HydrophobicContact CB-CE2 3.92Å; Q69-F71 HydrophobicContact CB-CZ 3.61Å
70	V	97.7	Very high	95	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.6	171.8	-175.5	0	0	0	0	108.1	C14 L21 V26 W28 I43 I61 S62 K63	C14-V70 PolarHBondContact N-O 3.27Å; C14-V70 PolarHBondContact O-N 2.76Å; L21-V70 HydrophobicContact CD1-CG2 3.87Å; L21-V70 HydrophobicContact CD2-CG2 3.6Å; L21-V70 HydrophobicContact CG-CG2 4.42Å; V26-V70 HydrophobicContact CB-CB 4.48Å; V26-V70 HydrophobicContact CB-CG1 4.31Å; V26-V70 HydrophobicContact CB-CG2 3.93Å; V26-V70 HydrophobicContact CG1-CB 4.29Å; V26-V70 HydrophobicContact CG1-CG1 4.24Å; V26-V70 HydrophobicContact CG1-CG2 4.15Å; V26-V70 HydrophobicContact CG2-CG2 3.86Å; W28-V70 HydrophobicContact CZ2-CG1 4.44Å; I43-V70 HydrophobicContact CG2-CG1 3.69Å; I61-V70 HydrophobicContact CG2-CG1 4.08Å; S62-V70 CarbonylContact O-C 3.54Å; S62-V70 WeakPolarHBondContact O-CA 3.2Å; S62-V70 WeakPolarHBondContact O-CG1 3.41Å; K63-V70 HydrophobicContact CB-CG2 4.13Å
71	F	97.7	Very high	94.9	Very high	40 Å²	40	52 Å²	52	18%	0.175	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.7	-174.8	-51.4	-86.6	0	0	0	110.1	I12 T13 I61 S62 D64 Q69	I12-F71 CarbonylContact O-C 3.57Å; I12-F71 WeakPolarHBondContact O-CA 3.4Å; T13-F71 HydrophobicContact CG2-CD1 4Å; T13-F71 HydrophobicContact CG2-CE1 3.65Å; T13-F71 HydrophobicContact CG2-CZ 4.45Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.32Å; T13-F71 WeakPolarHBondContact OG1-CE1 3.37Å; I61-F71 WeakPolarHBondContact CA-O 3.27Å; S62-F71 PolarHBondContact N-O 3.32Å; S62-F71 PolarHBondContact O-N 2.99Å; D64-F71 HydrophobicContact CB-CE2 3.89Å; D64-F71 HydrophobicContact CB-CZ 4.42Å; Q69-F71 HydrophobicContact CB-CE1 4.28Å; Q69-F71 HydrophobicContact CB-CE2 3.92Å; Q69-F71 HydrophobicContact CB-CZ 3.61Å
72	L	96.9	Very high	94.8	Very high	1 Å²	1	53 Å²	53	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.1	166.4	-177.7	71.4	0	0	0	108.3	S11 I12 W28 L40 L59 I61 Y85	S11-L72 CarbonylContact C-O 3.49Å; S11-L72 WeakPolarHBondContact CA-O 2.98Å; I12-L72 HydrophobicContact CB-CB 4.38Å; I12-L72 HydrophobicContact CD1-CD2 4.34Å; I12-L72 PolarHBondContact N-O 2.86Å; I12-L72 PolarHBondContact O-N 2.84Å; W28-L72 HydrophobicContact CB-CD1 4.13Å; W28-L72 HydrophobicContact CB-CD2 4.3Å; W28-L72 HydrophobicContact CD2-CB 3.64Å; W28-L72 HydrophobicContact CD2-CD1 4.37Å; W28-L72 HydrophobicContact CD2-CD2 4.02Å; W28-L72 HydrophobicContact CD2-CG 4.24Å; W28-L72 HydrophobicContact CE3-CB 4.03Å; W28-L72 HydrophobicContact CE3-CD2 3.93Å; W28-L72 HydrophobicContact CG-CB 4.05Å; W28-L72 HydrophobicContact CG-CD1 3.91Å; W28-L72 HydrophobicContact CG-CD2 4.19Å; W28-L72 HydrophobicContact CG-CG 4.29Å; W28-L72 HydrophobicContact CH2-CB 4.16Å; W28-L72 HydrophobicContact CZ2-CB 3.8Å; W28-L72 HydrophobicContact CZ3-CB 4.27Å; L40-L72 HydrophobicContact CD1-CD2 3.82Å; L59-L72 HydrophobicContact CD2-CD1 3.72Å; L59-L72 HydrophobicContact CD2-CG 4.26Å; I61-L72 HydrophobicContact CD1-CD1 4.35Å; I61-L72 HydrophobicContact CG1-CD1 3.72Å; L72-Y85 HydrophobicContact CD2-CD1 3.67Å; L72-Y85 HydrophobicContact CD2-CE1 4.04Å
73	K	95.5	Very high	94.8	Very high	99 Å²	99	50.4 Å²	50.4	43%	0.43	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.6	170.5	-171.8	176.2	-176.5	-177.6	0	109.3	L10 L59 S60 N75	L10-K73 CarbonylContact O-C 3.5Å; L10-K73 WeakPolarHBondContact O-CA 3.38Å; L59-K73 CarbonylContact C-O 3.59Å; L59-K73 WeakPolarHBondContact CA-O 3.08Å; S60-K73 PolarHBondContact N-O 2.82Å; S60-K73 PolarHBondContact O-N 2.81Å; K73-N75 VanDerWaalsContact CE-OD1 3.25Å; K73-N75 WeakPolarHBondContact CE-OD1 3.34Å
74	L	93.1	Very high	94.8	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.3	174.4	-175.3	62.3	0	0	0	108	S9 L10 R58 L59 L77 D81	S9-L74 CarbonylContact C-O 3.59Å; S9-L74 VanDerWaalsContact CA-O 3.26Å; S9-L74 WeakPolarHBondContact CA-O 3.34Å; L10-L74 PolarHBondContact N-O 3.26Å; L10-L74 PolarHBondContact O-N 3.3Å; R58-L74 HydrophobicContact CB-CD1 4.02Å; R58-L74 WeakPolarHBondContact O-CA 3.49Å; L59-L74 HydrophobicContact CD2-CB 4.11Å; L59-L74 HydrophobicContact CD2-CD1 3.38Å; L59-L74 HydrophobicContact CD2-CG 4.24Å; L59-L74 HydrophobicContact CG-CD1 3.89Å; L74-L77 HydrophobicContact CB-CD2 4.24Å; L74-L77 HydrophobicContact CD2-CD2 3.44Å; L74-L77 VanDerWaalsContact CD2-CD2 3.44Å; L74-L77 HydrophobicContact CG-CD2 3.75Å; L74-D81 HydrophobicContact CD2-CB 3.86Å
75	N	92.8	Very high	94.7	Very high	47 Å²	47	48.2 Å²	48.2	25%	0.251	26%	0.263	S	S	.	.			trans	-102.7	154.7	-179.8	-59.3	-57.1	0	0	0	110.8	S9 R58 K73 L77	S9-N75 PolarHBondContact OG-OD1 3.38Å; R58-N75 PolarHBondContact O-N 2.85Å; K73-N75 VanDerWaalsContact CE-OD1 3.25Å; K73-N75 WeakPolarHBondContact CE-OD1 3.34Å; N75-L77 PolarHBondContact O-N 2.83Å
76	S	91.1	Very high	94.7	Very high	69 Å²	69	46.9 Å²	46.9	48%	0.483	25%	0.253	S	S	.	.	S	Bend	trans	52	59.2	177.2	-55.8	0	0	0	0	111.1	Q8 R58	Q8-S76 PolarHBondContact O-N 2.81Å; R58-S76 PolarHBondContact NH1-O 2.81Å; R58-S76 VanDerWaalsContact NH1-O 3.11Å
77	L	91.1	Very high	94.7	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	22%	0.223	C	C	.	.			trans	-56.1	140	-178.5	-73.1	165	0	0	0	111.6	V4 P6 S7 Q8 L10 L74 N75 D81 V107	V4-L77 HydrophobicContact CB-CD1 4.01Å; V4-L77 HydrophobicContact CG1-CD1 3.41Å; V4-L77 VanDerWaalsContact CG1-CD1 3.41Å; P6-L77 WeakPolarHBondContact CA-O 3.33Å; S7-L77 PolarHBondContact N-O 2.87Å; Q8-L77 HydrophobicContact CB-CD1 4.47Å; Q8-L77 WeakPolarHBondContact O-CD1 3.34Å; Q8-L77 VanDerWaalsContact O-CG 3.27Å; Q8-L77 WeakPolarHBondContact O-CG 3.32Å; Q8-L77 PolarHBondContact O-N 2.82Å; L10-L77 HydrophobicContact CB-CD1 3.85Å; L10-L77 HydrophobicContact CB-CD2 4.35Å; L74-L77 HydrophobicContact CB-CD2 4.24Å; L74-L77 HydrophobicContact CD2-CD2 3.44Å; L74-L77 VanDerWaalsContact CD2-CD2 3.44Å; L74-L77 HydrophobicContact CG-CD2 3.75Å; N75-L77 PolarHBondContact O-N 2.83Å; L77-D81 HydrophobicContact CD2-CB 4.06Å; L77-V107 HydrophobicContact CB-CG1 4.15Å; L77-V107 HydrophobicContact CB-CG2 4.29Å; L77-V107 HydrophobicContact CD1-CG2 4.45Å; L77-V107 HydrophobicContact CD2-CG2 4.2Å
78	Q	91.6	Very high	94.6	Very high	99 Å²	99	36.9 Å²	36.9	46%	0.463	20%	0.198	S	C	.	.			trans	-116.1	158	174.6	-62	176.5	-10	0	0	108.8	D80 D81 V107	Q78-D80 PolarHBondContact O-N 3.04Å; Q78-D80 VanDerWaalsContact O-N 3.17Å; Q78-D81 PolarHBondContact N-OD2 2.71Å; Q78-D81 VanDerWaalsContact O-CB 3.29Å; Q78-D81 WeakPolarHBondContact O-CB 3.25Å; Q78-D81 PolarHBondContact O-N 3.05Å; Q78-V107 WeakPolarHBondContact O-CB 3.4Å; Q78-V107 WeakPolarHBondContact O-CG1 3.42Å
79	T	90.6	Very high	94.4	Very high	77 Å²	77	35.8 Å²	35.8	47%	0.472	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-55.3	-34	176.1	47	0	0	0	0	112.1	D81 T82	T79-D81 PolarHBondContact O-N 2.8Å; T79-T82 VanDerWaalsContact O-CB 3.27Å; T79-T82 WeakPolarHBondContact O-CB 3.25Å; T79-T82 PolarHBondContact O-N 3.39Å; T79-T82 PolarHBondContact O-OG1 2.87Å
80	D	90.3	Very high	93.8	Very high	114 Å²	114	34.8 Å²	34.8	61%	0.61	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-68.2	-11.5	177.9	-69.6	7.4	0	0	0	113.7	Q78 T82	Q78-D80 PolarHBondContact O-N 3.04Å; Q78-D80 VanDerWaalsContact O-N 3.17Å; D80-T82 PolarHBondContact O-N 2.88Å
81	D	92.4	Very high	92.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-81.6	-0.5	171.9	-59.5	-44.1	0	0	0	112.5	R30 R58 L74 L77 Q78 T79 A83 Y85 V107	R30-D81 IonicContact CZ-OD1 2.86Å; R30-D81 IonicContact NH1-OD1 3.74Å; R30-D81 PolarHBondContact NH1-OD1 2.85Å; R58-D81 IonicContact CZ-OD1 3.75Å; R58-D81 IonicContact CZ-OD2 3.56Å; R58-D81 IonicContact NH1-OD1 3.62Å; R58-D81 IonicContact NH1-OD2 2.71Å; R58-D81 PolarHBondContact NH1-OD2 2.9Å; R58-D81 IonicContact NH2-OD1 2.91Å; R58-D81 PolarHBondContact NH2-OD1 2.89Å; 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 4.06Å; Q78-D81 PolarHBondContact N-OD2 2.71Å; Q78-D81 VanDerWaalsContact O-CB 3.29Å; Q78-D81 WeakPolarHBondContact O-CB 3.25Å; Q78-D81 PolarHBondContact O-N 3.05Å; T79-D81 PolarHBondContact O-N 2.8Å; D81-A83 PolarHBondContact O-N 3.4Å; D81-A83 VanDerWaalsContact O-N 3.17Å; D81-Y85 WeakPolarHBondContact O-CE2 3.43Å; D81-Y85 PolarHBondContact O-OH 2.84Å; D81-V107 HydrophobicContact CB-CG2 4.34Å
82	T	95.2	Very high	91.2	Very high	30 Å²	30	40.3 Å²	40.3	18%	0.184	22%	0.215	C	C	.	.			trans	-62.8	112.7	169.1	-64.1	0	0	0	0	110.2	P33 T79 D80 V105 V107	P33-T82 VanDerWaalsContact CD-O 3.32Å; P33-T82 WeakPolarHBondContact CD-O 3.01Å; P33-T82 HydrophobicContact CG-CG2 4.35Å; T79-T82 VanDerWaalsContact O-CB 3.27Å; T79-T82 WeakPolarHBondContact O-CB 3.25Å; T79-T82 PolarHBondContact O-N 3.39Å; T79-T82 PolarHBondContact O-OG1 2.87Å; D80-T82 PolarHBondContact O-N 2.88Å; T82-V105 WeakPolarHBondContact CA-O 3.3Å; T82-V107 PolarHBondContact OG1-N 3.26Å; T82-V107 PolarHBondContact OG1-O 3.35Å
83	A	96.2	Very high	89.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	165.5	-176.7	0	0	0	0	0	111.1	R30 Q31 P32 D81 Y85 V105	R30-A83 HydrophobicContact CB-CB 3.87Å; R30-A83 HydrophobicContact CG-CB 4.24Å; Q31-A83 WeakPolarHBondContact O-CA 3.45Å; Q31-A83 WeakPolarHBondContact O-CB 3.34Å; P32-A83 HydrophobicContact CG-CB 4.41Å; D81-A83 PolarHBondContact O-N 3.4Å; D81-A83 VanDerWaalsContact O-N 3.17Å; A83-Y85 HydrophobicContact CB-CD2 4.28Å; A83-Y85 HydrophobicContact CB-CE2 3.79Å; A83-Y85 WeakPolarHBondContact O-CD2 3.48Å; A83-V105 PolarHBondContact N-O 2.81Å; A83-V105 VanDerWaalsContact N-O 3.11Å; A83-V105 PolarHBondContact O-N 3.03Å
84	T	97.5	Very high	87.9	Confident	35 Å²	35	49.4 Å²	49.4	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	123	160.6	-52.3	0	0	0	0	109	R30 Q31 Y86 T103	R30-T84 CarbonylContact C-O 3.54Å; R30-T84 VanDerWaalsContact CA-O 3.24Å; R30-T84 WeakPolarHBondContact CA-O 3.45Å; Q31-T84 PolarHBondContact N-O 3.48Å; Q31-T84 PolarHBondContact O-N 3.05Å; T84-Y86 HydrophobicContact CG2-CD2 4.43Å; T84-Y86 HydrophobicContact CG2-CE1 3.84Å; T84-Y86 HydrophobicContact CG2-CE2 3.66Å; T84-Y86 VanDerWaalsContact CG2-OH 3.25Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.49Å; T84-Y86 WeakPolarHBondContact O-CD2 3.42Å; T84-Y86 VanDerWaalsContact O-CE2 3.28Å; T84-Y86 WeakPolarHBondContact O-CE2 3.33Å; T84-T103 WeakPolarHBondContact CA-O 3.41Å
85	Y	96.8	Very high	86.4	Confident	3 Å²	3	55.7 Å²	55.7	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.3	-179.7	-70.7	-101.5	0	0	0	110.5	I12 R30 L40 L72 D81 A83 G102 T103 V105	I12-Y85 HydrophobicContact CD1-CD1 3.77Å; I12-Y85 HydrophobicContact CD1-CD2 3.86Å; I12-Y85 HydrophobicContact CD1-CE1 4.42Å; I12-Y85 HydrophobicContact CD1-CG 3.44Å; I12-Y85 VanDerWaalsContact CD1-CG 3.44Å; R30-Y85 HydrophobicContact CB-CD1 3.87Å; R30-Y85 HydrophobicContact CB-CE1 3.88Å; R30-Y85 HydrophobicContact CB-CG 4.25Å; L40-Y85 HydrophobicContact CD1-CD1 3.83Å; L40-Y85 HydrophobicContact CD1-CE1 3.71Å; L72-Y85 HydrophobicContact CD2-CD1 3.67Å; L72-Y85 HydrophobicContact CD2-CE1 4.04Å; D81-Y85 WeakPolarHBondContact O-CE2 3.43Å; D81-Y85 PolarHBondContact O-OH 2.84Å; A83-Y85 HydrophobicContact CB-CD2 4.28Å; A83-Y85 HydrophobicContact CB-CE2 3.79Å; A83-Y85 WeakPolarHBondContact O-CD2 3.48Å; Y85-G102 CarbonylContact O-C 3.58Å; Y85-G102 WeakPolarHBondContact O-CA 3.48Å; Y85-T103 PolarHBondContact N-O 2.02Å; Y85-T103 PolarHBondContact O-N 2.8Å; Y85-V105 HydrophobicContact CD2-CB 3.91Å; Y85-V105 HydrophobicContact CD2-CG2 3.64Å; Y85-V105 HydrophobicContact CE2-CB 3.76Å; Y85-V105 HydrophobicContact CE2-CG1 4.38Å; Y85-V105 HydrophobicContact CE2-CG2 3.94Å
86	Y	96.6	Very high	85.1	Confident	45 Å²	45	56.9 Å²	56.9	18%	0.176	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	143.6	-178.5	-53.8	-91	0	0	0	109.8	W28 V29 Q31 L37 T84 W99	W28-Y86 WeakPolarHBondContact CA-O 3.29Å; V29-Y86 PolarHBondContact N-O 3.34Å; V29-Y86 PolarHBondContact O-N 2.85Å; Q31-Y86 HydrophobicContact CB-CE2 3.89Å; L37-Y86 HydrophobicContact CD2-CD2 4.48Å; L37-Y86 HydrophobicContact CD2-CE2 4.36Å; T84-Y86 HydrophobicContact CG2-CD2 4.43Å; T84-Y86 HydrophobicContact CG2-CE1 3.84Å; T84-Y86 HydrophobicContact CG2-CE2 3.66Å; T84-Y86 VanDerWaalsContact CG2-OH 3.25Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.49Å; T84-Y86 WeakPolarHBondContact O-CD2 3.42Å; T84-Y86 VanDerWaalsContact O-CE2 3.28Å; T84-Y86 WeakPolarHBondContact O-CE2 3.33Å; Y86-W99 HydrophobicContact CD1-CE3 4.45Å; Y86-W99 HydrophobicContact CG-CE3 4.13Å; Y86-W99 HydrophobicContact CG-CZ3 4.26Å
87	C	95.4	Very high	84	Confident	15 Å²	15	54.8 Å²	54.8	10%	0.101	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	144.6	159.9	57.2	0	0	0	0	109.1	C14 V26 S27 W28 G100	C14-C87 HydrophobicContact CB-CB 3.44Å; C14-C87 VanDerWaalsContact CB-CB 3.44Å; C14-C87 WeakPolarHBondContact CB-SG 3.49Å; C14-C87 WeakPolarHBondContact SG-CB 3.43Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 2.8Å; V26-C87 HydrophobicContact CG1-CB 3.96Å; S27-C87 CarbonylContact O-C 3.56Å; S27-C87 VanDerWaalsContact O-CA 3.27Å; S27-C87 WeakPolarHBondContact O-CA 3.29Å; W28-C87 HydrophobicContact CD2-CB 4.4Å; W28-C87 HydrophobicContact CE3-CB 4.21Å; W28-C87 HydrophobicContact CH2-CB 4.25Å; W28-C87 HydrophobicContact CZ2-CB 4.41Å; W28-C87 HydrophobicContact CZ3-CB 4.14Å; C87-G100 PolarHBondContact O-N 3.25Å
88	A	94.4	Very high	83.6	Confident	2 Å²	2	61.8 Å²	61.8	2%	0.017	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	138.5	177.7	0	0	0	0	0	110.6	V26 S27 Q90 F96 Y98 W99	V26-A88 CarbonylContact C-O 3.56Å; V26-A88 WeakPolarHBondContact CA-O 3.39Å; S27-A88 PolarHBondContact N-O 2.78Å; S27-A88 PolarHBondContact O-N 3.22Å; A88-Q90 PolarHBondContact O-N 3.36Å; A88-F96 HydrophobicContact CB-CB 4.15Å; A88-F96 HydrophobicContact CB-CD1 3.59Å; A88-F96 HydrophobicContact CB-CE1 4.32Å; A88-F96 HydrophobicContact CB-CG 4.12Å; A88-Y98 CarbonylContact C-O 3.42Å; A88-Y98 WeakPolarHBondContact CA-O 3.48Å; A88-W99 HydrophobicContact CB-CD2 3.79Å; A88-W99 HydrophobicContact CB-CE3 4.03Å; A88-W99 HydrophobicContact CB-CG 4.2Å; A88-W99 HydrophobicContact CB-CH2 4.44Å; A88-W99 HydrophobicContact CB-CZ2 4.23Å; A88-W99 HydrophobicContact CB-CZ3 4.36Å
89	K	92.6	Very high	83.6	Confident	21 Å²	21	61.8 Å²	61.8	9%	0.091	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	129.5	171.9	-175.9	-167	174.4	-164.8	0	108.8	F19 F96 A97 Y98	F19-K89 HydrophobicContact CD1-CD 3.97Å; F19-K89 HydrophobicContact CD1-CG 4.24Å; F19-K89 HydrophobicContact CD2-CG 4.4Å; F19-K89 HydrophobicContact CE1-CB 3.96Å; F19-K89 HydrophobicContact CE1-CD 4.13Å; F19-K89 HydrophobicContact CE1-CG 3.95Å; F19-K89 HydrophobicContact CE2-CG 4.1Å; F19-K89 HydrophobicContact CG-CD 4.19Å; F19-K89 HydrophobicContact CG-CG 4.45Å; F19-K89 HydrophobicContact CZ-CB 3.95Å; F19-K89 HydrophobicContact CZ-CD 4.48Å; F19-K89 HydrophobicContact CZ-CG 3.86Å; K89-F96 WeakPolarHBondContact O-CA 3.47Å; K89-A97 HydrophobicContact CD-CB 4.36Å; K89-Y98 HydrophobicContact CB-CD2 4.36Å; K89-Y98 HydrophobicContact CD-CD2 3.71Å; K89-Y98 HydrophobicContact CD-CE2 4.26Å; K89-Y98 PolarHBondContact N-O 3.08Å
90	Q	85.2	Confident	83.7	Confident	26 Å²	26	59.5 Å²	59.5	12%	0.121	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.5	173.5	-173.3	69.4	40.8	0	0	109.5	G25 S27 V42 W44 A88	G25-Q90 PolarHBondContact N-O 2.94Å; G25-Q90 PolarHBondContact O-N 2.8Å; S27-Q90 PolarHBondContact OG-OE1 3.32Å; V42-Q90 HydrophobicContact CG2-CB 4.09Å; V42-Q90 HydrophobicContact CG2-CG 4.16Å; W44-Q90 HydrophobicContact CE3-CG 4.27Å; W44-Q90 HydrophobicContact CH2-CG 3.46Å; W44-Q90 VanDerWaalsContact CH2-CG 3.46Å; W44-Q90 HydrophobicContact CZ2-CG 4.43Å; W44-Q90 HydrophobicContact CZ3-CB 4.3Å; W44-Q90 HydrophobicContact CZ3-CG 3.37Å; A88-Q90 PolarHBondContact O-N 3.36Å
91	D	75.1	Confident	83.8	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.144	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-103.8	151.7	168.2	-158.8	-5.2	0	0	0	109.8	Y93 S94 W95	D91-Y93 PolarHBondContact O-N 2.73Å; D91-Y93 VanDerWaalsContact O-N 3.07Å; D91-S94 PolarHBondContact O-N 2.75Å; D91-W95 WeakPolarHBondContact OD2-CZ2 3.43Å; D91-W95 PolarHBondContact OD2-NE1 3.41Å
92	D	64	Low	83.9	Confident	129 Å²	129	64.4 Å²	64.4	69%	0.69	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21	-178.8	-71.4	-21.9	0	0	0	111.8
93	Y	65	Low	83.9	Confident	191 Å²	191	64.9 Å²	64.9	75%	0.749	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	25.6	-177.6	-59.5	-81.5	0	0	0	114.7	D91	D91-Y93 PolarHBondContact O-N 2.73Å; D91-Y93 VanDerWaalsContact O-N 3.07Å
94	S	58.2	Low	83.9	Confident	100 Å²	100	69.5 Å²	69.5	70%	0.699	34%	0.344	S	S	*	.	S	Bend	trans	84.4	2.1	160.4	82.1	0	0	0	0	120.6	D91	D91-S94 PolarHBondContact O-N 2.75Å
95	W	61.4	Low	83.7	Confident	135 Å²	135	67.9 Å²	67.9	51%	0.511	33%	0.334	S	S	.	.			trans	-101	122.4	179.2	56.4	-66.6	0	0	0	111.6	D91 A97	D91-W95 WeakPolarHBondContact OD2-CZ2 3.43Å; D91-W95 PolarHBondContact OD2-NE1 3.41Å; W95-A97 HydrophobicContact CD2-CB 3.99Å; W95-A97 VanDerWaalsContact CE3-CA 3.47Å; W95-A97 HydrophobicContact CE3-CB 3.25Å; W95-A97 HydrophobicContact CH2-CB 3.67Å; W95-A97 HydrophobicContact CZ2-CB 4.35Å; W95-A97 HydrophobicContact CZ3-CB 3.08Å; W95-A97 PolarHBondContact O-N 2.87Å
96	F	66.1	Low	83.6	Confident	73 Å²	73	70.2 Å²	70.2	32%	0.32	35%	0.348	S	S	.	.			trans	-69.8	79.5	166.6	-65.6	-64.3	0	0	0	109.4	S27 A88 K89 Y98 W99	S27-F96 VanDerWaalsContact CB-CE1 3.47Å; A88-F96 HydrophobicContact CB-CB 4.15Å; A88-F96 HydrophobicContact CB-CD1 3.59Å; A88-F96 HydrophobicContact CB-CE1 4.32Å; A88-F96 HydrophobicContact CB-CG 4.12Å; K89-F96 WeakPolarHBondContact O-CA 3.47Å; F96-Y98 VanDerWaalsContact C-N 3.29Å; F96-Y98 PolarHBondContact O-N 3.48Å; F96-W99 HydrophobicContact CB-CZ2 3.71Å; F96-W99 VanDerWaalsContact CB-NE1 3.27Å; F96-W99 HydrophobicContact CD1-CZ2 4.47Å; F96-W99 HydrophobicContact CD2-CH2 4.43Å; F96-W99 AromaticContact CD2-CZ2 3.67Å; F96-W99 HydrophobicContact CD2-CZ2 3.67Å; F96-W99 HydrophobicContact CE2-CZ2 4.4Å; F96-W99 AromaticContact CG-CZ2 3.71Å; F96-W99 HydrophobicContact CG-CZ2 3.71Å; F96-W99 PolarHBondContact O-NE1 2.79Å
97	A	68.6	Low	83.3	Confident	25 Å²	25	68.2 Å²	68.2	21%	0.207	34%	0.341	C	S	.	.			trans	-59.6	-37.3	-171.9	0	0	0	0	0	113.8	K89 W95	K89-A97 HydrophobicContact CD-CB 4.36Å; W95-A97 HydrophobicContact CD2-CB 3.99Å; W95-A97 VanDerWaalsContact CE3-CA 3.47Å; W95-A97 HydrophobicContact CE3-CB 3.25Å; W95-A97 HydrophobicContact CH2-CB 3.67Å; W95-A97 HydrophobicContact CZ2-CB 4.35Å; W95-A97 HydrophobicContact CZ3-CB 3.08Å; W95-A97 PolarHBondContact O-N 2.87Å
98	Y	83.3	Confident	83	Confident	150 Å²	150	68.6 Å²	68.6	59%	0.588	34%	0.344	S	S	*	.			trans	-141.4	129.2	-172.1	-59.7	-76.2	0	0	0	110.2	A88 K89 F96	A88-Y98 CarbonylContact C-O 3.42Å; A88-Y98 WeakPolarHBondContact CA-O 3.48Å; K89-Y98 HydrophobicContact CB-CD2 4.36Å; K89-Y98 HydrophobicContact CD-CD2 3.71Å; K89-Y98 HydrophobicContact CD-CE2 4.26Å; K89-Y98 PolarHBondContact N-O 3.08Å; F96-Y98 VanDerWaalsContact C-N 3.29Å; F96-Y98 PolarHBondContact O-N 3.48Å
99	W	91.4	Very high	82	Confident	99 Å²	99	72.5 Å²	72.5	38%	0.375	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-112.7	140.5	178.8	-69.8	73.3	0	0	0	110.4	V29 L37 Y86 A88 F96	V29-W99 HydrophobicContact CB-CH2 3.99Å; V29-W99 HydrophobicContact CB-CZ3 3.77Å; V29-W99 HydrophobicContact CG1-CH2 3.96Å; V29-W99 HydrophobicContact CG1-CZ3 3.96Å; V29-W99 HydrophobicContact CG2-CH2 3.75Å; V29-W99 HydrophobicContact CG2-CZ3 3.93Å; L37-W99 HydrophobicContact CD1-CH2 4.05Å; Y86-W99 HydrophobicContact CD1-CE3 4.45Å; Y86-W99 HydrophobicContact CG-CE3 4.13Å; Y86-W99 HydrophobicContact CG-CZ3 4.26Å; A88-W99 HydrophobicContact CB-CD2 3.79Å; A88-W99 HydrophobicContact CB-CE3 4.03Å; A88-W99 HydrophobicContact CB-CG 4.2Å; A88-W99 HydrophobicContact CB-CH2 4.44Å; A88-W99 HydrophobicContact CB-CZ2 4.23Å; A88-W99 HydrophobicContact CB-CZ3 4.36Å; F96-W99 HydrophobicContact CB-CZ2 3.71Å; F96-W99 VanDerWaalsContact CB-NE1 3.27Å; F96-W99 HydrophobicContact CD1-CZ2 4.47Å; F96-W99 HydrophobicContact CD2-CH2 4.43Å; F96-W99 AromaticContact CD2-CZ2 3.67Å; F96-W99 HydrophobicContact CD2-CZ2 3.67Å; F96-W99 HydrophobicContact CE2-CZ2 4.4Å; F96-W99 AromaticContact CG-CZ2 3.71Å; F96-W99 HydrophobicContact CG-CZ2 3.71Å; F96-W99 PolarHBondContact O-NE1 2.79Å
100	G	91.6	Very high	80.7	Confident	29 Å²	29	78.1 Å²	78.1	30%	0.299	40%	0.403	S	S	.	.			trans	-67.3	160.2	163.9	0	0	0	0	0	111.1	C87 G102	C87-G100 PolarHBondContact O-N 3.25Å; G100-G102 PolarHBondContact O-N 3.23Å
101	Q	93	Very high	79.3	Confident	193 Å²	193	81.6 Å²	81.6	90%	0.902	43%	0.43	S	S	*	.			trans	-62.1	-13.2	-179.8	-67.2	-64.1	-44.5	0	0	114.1
102	G	94.1	Very high	78.1	Confident	24 Å²	24	88.9 Å²	88.9	25%	0.247	46%	0.463	C	S	.	.			trans	85.8	162.4	-175.7	0	0	0	0	0	112.2	Y85 G100	Y85-G102 CarbonylContact O-C 3.58Å; Y85-G102 WeakPolarHBondContact O-CA 3.48Å; G100-G102 PolarHBondContact O-N 3.23Å
103	T	95.6	Very high	77.1	Confident	40 Å²	40	91.2 Å²	91.2	25%	0.245	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	116.3	178.5	-75.5	0	0	0	0	108.5	P1 T84 Y85 V105	P1-T103 HydrophobicContact CB-CG2 3.54Å; P1-T103 HydrophobicContact CG-CG2 3.38Å; T84-T103 WeakPolarHBondContact CA-O 3.41Å; Y85-T103 PolarHBondContact N-O 2.02Å; Y85-T103 PolarHBondContact O-N 2.8Å; T103-V105 HydrophobicContact CG2-CG2 4.36Å; T103-V105 PolarHBondContact O-N 3.07Å
104	L	95.5	Very high	77.7	Confident	98 Å²	98	86.2 Å²	86.2	51%	0.513	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	131	173.9	-178.2	61.9	0	0	0	109.7	P1	P1-L104 VanDerWaalsContact O-O 3.12Å
105	V	94.3	Very high	78.8	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.2	171.4	174.7	0	0	0	0	106.9	P1 L10 I12 T82 A83 Y85 T103 V107	P1-V105 HydrophobicContact CB-CG2 4.16Å; L10-V105 HydrophobicContact CD2-CB 4.18Å; L10-V105 HydrophobicContact CD2-CG1 3.5Å; L10-V105 VanDerWaalsContact CD2-CG1 3.5Å; L10-V105 HydrophobicContact CD2-CG2 3.59Å; I12-V105 HydrophobicContact CD1-CG2 3.9Å; T82-V105 WeakPolarHBondContact CA-O 3.3Å; A83-V105 PolarHBondContact N-O 2.81Å; A83-V105 VanDerWaalsContact N-O 3.11Å; A83-V105 PolarHBondContact O-N 3.03Å; Y85-V105 HydrophobicContact CD2-CB 3.91Å; Y85-V105 HydrophobicContact CD2-CG2 3.64Å; Y85-V105 HydrophobicContact CE2-CB 3.76Å; Y85-V105 HydrophobicContact CE2-CG1 4.38Å; Y85-V105 HydrophobicContact CE2-CG2 3.94Å; T103-V105 HydrophobicContact CG2-CG2 4.36Å; T103-V105 PolarHBondContact O-N 3.07Å; V105-V107 HydrophobicContact CG1-CG2 4.25Å
106	T	93.9	Very high	79.7	Confident	52 Å²	52	82.7 Å²	82.7	32%	0.319	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.2	175.6	-55.4	0	0	0	0	108.6	L3 V4	L3-T106 CarbonylContact C-O 3.52Å; L3-T106 WeakPolarHBondContact CA-O 3.44Å; L3-T106 HydrophobicContact CD1-CG2 3.91Å; V4-T106 PolarHBondContact N-O 3.27Å
107	V	91	Very high	80.5	Confident	4 Å²	4	83.3 Å²	83.3	2%	0.024	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	104.9	173.2	-173.3	0	0	0	0	108.2	V4 P6 L77 Q78 D81 T82 V105	V4-V107 VanDerWaalsContact O-CA 3.29Å; V4-V107 WeakPolarHBondContact O-CA 3.28Å; P6-V107 HydrophobicContact CG-CG1 4.27Å; L77-V107 HydrophobicContact CB-CG1 4.15Å; L77-V107 HydrophobicContact CB-CG2 4.29Å; L77-V107 HydrophobicContact CD1-CG2 4.45Å; L77-V107 HydrophobicContact CD2-CG2 4.2Å; Q78-V107 WeakPolarHBondContact O-CB 3.4Å; Q78-V107 WeakPolarHBondContact O-CG1 3.42Å; D81-V107 HydrophobicContact CB-CG2 4.34Å; T82-V107 PolarHBondContact OG1-N 3.26Å; T82-V107 PolarHBondContact OG1-O 3.35Å; V105-V107 HydrophobicContact CG1-CG2 4.25Å
108	S	87.9	Confident	81.3	Confident	23 Å²	23	86.9 Å²	86.9	16%	0.161	49%	0.487	C	S	.	.			trans	-130.6	150	176.7	92.3	0	0	0	0	110.1	L3 V4 P6 E110	L3-S108 VanDerWaalsContact CD1-OG 3.28Å; L3-S108 WeakPolarHBondContact CD1-OG 3.35Å; V4-S108 PolarHBondContact O-N 3.36Å; P6-S108 WeakPolarHBondContact CD-O 3.43Å; S108-E110 PolarHBondContact O-N 2.99Å; S108-E110 WeakPolarHBondContact OG-CB 3.41Å; S108-E110 PolarHBondContact OG-N 3.25Å; S108-E110 PolarHBondContact OG-OE2 3.35Å
109	A	73.9	Confident	81.1	Confident	84 Å²	84	82.7 Å²	82.7	69%	0.694	48%	0.48	S	S	*	.			trans	-80.5	11.2	176.1	0	0	0	0	0	112.8	P6 S111	P6-A109 HydrophobicContact CG-CB 4.31Å; A109-S111 PolarHBondContact O-N 3.33Å
110	E	66.6	Low	80.4	Confident	138 Å²	138	81.6 Å²	81.6	65%	0.645	49%	0.488	S	S	*	.			trans	-63.2	125.8	-175.8	-75.4	164.7	146.7	0	0	110.3	S108 Q112	S108-E110 PolarHBondContact O-N 2.99Å; S108-E110 WeakPolarHBondContact OG-CB 3.41Å; S108-E110 PolarHBondContact OG-N 3.25Å; S108-E110 PolarHBondContact OG-OE2 3.35Å; E110-Q112 PolarHBondContact O-N 2.6Å
111	S	54.3	Low	79.5	Confident	99 Å²	99	85.6 Å²	85.6	69%	0.692	50%	0.502	S	S	*	.			trans	-54.6	122.5	161.1	43.6	0	0	0	0	107.5	A109 S113	A109-S111 PolarHBondContact O-N 3.33Å; S111-S113 PolarHBondContact O-N 2.76Å
112	Q	49.7	Very low	78.4	Confident	181 Å²	181	76.7 Å²	76.7	85%	0.846	47%	0.469	S	S	*	.			trans	-61.1	92.1	163.5	-68.4	179.9	6.6	0	0	106.8	E110	E110-Q112 PolarHBondContact O-N 2.6Å
113	S	44	Very low	77	Confident	177 Å²	177	81.5 Å²	81.5	100%	1.238	49%	0.489	S	S	*	.			trans	-83.6	0	170.6	57.2	0	0	0	0	109.8	S111	S111-S113 PolarHBondContact O-N 2.76Å

Retrieved 113 of 113 residues in 26.4 ms (Link to these results)

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