X5J4C8_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4C8, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 108 aa.

						>X5J4C8_MOUSE|X5J4C8
PGLVAPSQSLSITCTVSGFSLTSYGVHWVRQPPGKGLEWLVVIWSDGSTTYNSALKSRLSISEDNSKSQVFLKMNSLQTDDTAMYYCASDGYYAMDYWGQGTSVTVSS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	P	56.4	Low	79.4	Confident	121 Å²	121	69.5 Å²	69.5	79%	0.786	45%	0.449	S	S	*	.				0	130.7	0	-3.5	24.6	0	0	0	109.4	T102 S103	P1-T102 HydrophobicContact CB-CG2 3.4Å; P1-T102 VanDerWaalsContact CB-CG2 3.4Å; P1-T102 HydrophobicContact CG-CG2 3.32Å; P1-S103 WeakPolarHBondContact CB-O 3.32Å
2	G	67.2	Low	80.7	Confident	46 Å²	46	64.3 Å²	64.3	47%	0.474	41%	0.414	S	S	.	.			trans	-130.1	176.8	-158.6	0	0	0	0	0	114.3	V4	G2-V4 PolarHBondContact O-N 3.25Å
3	L	70.2	Confident	81.9	Confident	133 Å²	133	64.4 Å²	64.4	70%	0.696	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	124.1	174.7	-163.1	98.8	0	0	0	109.8	T105 S107	L3-T105 HydrophobicContact CD1-CG2 4.36Å; L3-S107 WeakPolarHBondContact CD1-OG 3.45Å
4	V	76.2	Confident	82.8	Confident	14 Å²	14	60.4 Å²	60.4	9%	0.085	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.1	177.9	-105.4	0	0	0	0	109.8	G2 L10 L77 V104 T105 V106 S107	G2-V4 PolarHBondContact O-N 3.25Å; V4-L10 HydrophobicContact CG2-CD2 4.28Å; V4-L77 HydrophobicContact CB-CD1 3.94Å; V4-L77 HydrophobicContact CG1-CD1 4.27Å; V4-L77 HydrophobicContact CG2-CD1 3.77Å; V4-V104 HydrophobicContact CG2-CG1 4.13Å; V4-T105 PolarHBondContact N-O 3.31Å; V4-T105 VanDerWaalsContact N-O 3.07Å; V4-V106 HydrophobicContact CG2-CG2 4.14Å; V4-V106 WeakPolarHBondContact O-CA 3.4Å; V4-S107 PolarHBondContact O-N 2.74Å
5	A	79.9	Confident	83.5	Confident	41 Å²	41	62.4 Å²	62.4	34%	0.339	40%	0.399	S	S	.	.			trans	-77.1	153.3	175.1	0	0	0	0	0	110.5	Q8	A5-Q8 HydrophobicContact CB-CG 4.24Å; A5-Q8 WeakPolarHBondContact O-CB 3.47Å; A5-Q8 WeakPolarHBondContact O-CG 3.37Å; A5-Q8 PolarHBondContact O-N 3.04Å
6	P	77.8	Confident	83.8	Confident	50 Å²	50	59.3 Å²	59.3	33%	0.325	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	152.4	173.9	-24.2	33.9	0	0	0	112.2	Q8 L77 V106 S107	P6-Q8 PolarHBondContact O-N 3.3Å; P6-Q8 VanDerWaalsContact O-N 3.12Å; P6-L77 WeakPolarHBondContact CA-O 3.42Å; P6-V106 HydrophobicContact CG-CG1 4.3Å; P6-S107 WeakPolarHBondContact CD-O 3.33Å
7	S	80.7	Confident	84	Confident	97 Å²	97	62.1 Å²	62.1	68%	0.678	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	-5.3	-177.5	-48.5	0	0	0	0	116	L77	S7-L77 PolarHBondContact N-O 2.81Å
8	Q	86.9	Confident	83.9	Confident	100 Å²	100	63.8 Å²	63.8	47%	0.467	43%	0.431	S	S	.	.			trans	-73.6	163.4	170.6	-65.5	-170.8	-18.5	0	0	111.5	A5 P6 S76 L77	A5-Q8 HydrophobicContact CB-CG 4.24Å; A5-Q8 WeakPolarHBondContact O-CB 3.47Å; A5-Q8 WeakPolarHBondContact O-CG 3.37Å; A5-Q8 PolarHBondContact O-N 3.04Å; P6-Q8 PolarHBondContact O-N 3.3Å; P6-Q8 VanDerWaalsContact O-N 3.12Å; Q8-S76 PolarHBondContact O-N 3.04Å; Q8-L77 WeakPolarHBondContact O-CB 3.21Å; Q8-L77 WeakPolarHBondContact O-CG 3.24Å; Q8-L77 PolarHBondContact O-N 2.78Å
9	S	91.1	Very high	83.8	Confident	68 Å²	68	63 Å²	63	48%	0.476	42%	0.42	S	S	.	.			trans	-106.5	140.7	171.3	-55.4	0	0	0	0	109.6	M74 N75	S9-M74 CarbonylContact C-O 3.44Å; S9-M74 WeakPolarHBondContact CA-O 3.41Å; S9-M74 WeakPolarHBondContact CB-O 3.39Å; S9-N75 PolarHBondContact OG-OD1 3.03Å
10	L	92.6	Very high	83.8	Confident	31 Å²	31	62.5 Å²	62.5	16%	0.162	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.6	175.8	178.5	65.7	0	0	0	109.1	V4 I12 K73 M74 L77 V104	V4-L10 HydrophobicContact CG2-CD2 4.28Å; L10-I12 HydrophobicContact CD2-CG2 3.86Å; L10-I12 HydrophobicContact CG-CG2 4.01Å; L10-K73 WeakPolarHBondContact O-CA 3.06Å; L10-M74 HydrophobicContact CB-CE 4.36Å; L10-M74 HydrophobicContact CD2-CE 3.93Å; L10-M74 HydrophobicContact CG-CE 4.31Å; L10-M74 PolarHBondContact N-O 3.05Å; L10-M74 PolarHBondContact O-N 2.8Å; L10-L77 HydrophobicContact CB-CD1 3.72Å; L10-V104 HydrophobicContact CD2-CB 4.37Å; L10-V104 HydrophobicContact CD2-CG1 3.65Å; L10-V104 HydrophobicContact CD2-CG2 3.75Å
11	S	94.7	Very high	83.9	Confident	64 Å²	64	59.7 Å²	59.7	45%	0.448	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.6	166.8	-168.6	0	0	0	0	108.6	L72	S11-L72 WeakPolarHBondContact CA-O 3.46Å
12	I	95.1	Very high	85.3	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.036	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142	172.1	61	177.1	0	0	0	109.5	L10 W28 F71 L72 M74 Y85 T102 V104	L10-I12 HydrophobicContact CD2-CG2 3.86Å; L10-I12 HydrophobicContact CG-CG2 4.01Å; I12-W28 HydrophobicContact CB-CH2 4.31Å; I12-W28 HydrophobicContact CD1-CE3 3.82Å; I12-W28 HydrophobicContact CD1-CH2 3.73Å; I12-W28 HydrophobicContact CD1-CZ3 3.31Å; I12-W28 HydrophobicContact CG1-CE3 4.41Å; I12-W28 HydrophobicContact CG1-CH2 3.64Å; I12-W28 HydrophobicContact CG1-CZ2 4.18Å; I12-W28 HydrophobicContact CG1-CZ3 3.79Å; I12-F71 WeakPolarHBondContact O-CA 3.42Å; I12-L72 HydrophobicContact CD1-CB 4.38Å; I12-L72 HydrophobicContact CD1-CD2 4.07Å; I12-L72 HydrophobicContact CG1-CB 3.8Å; I12-L72 HydrophobicContact CG1-CD2 4.36Å; I12-L72 HydrophobicContact CG1-CG 4.39Å; I12-L72 PolarHBondContact N-O 3.15Å; I12-L72 PolarHBondContact O-N 3.01Å; I12-M74 HydrophobicContact CD1-CE 4.16Å; I12-M74 HydrophobicContact CG1-CE 4.39Å; I12-M74 HydrophobicContact CG2-CE 4.25Å; I12-Y85 VanDerWaalsContact CD1-CB 3.43Å; I12-Y85 HydrophobicContact CD1-CD1 3.75Å; I12-Y85 HydrophobicContact CD1-CG 3.68Å; I12-T102 HydrophobicContact CB-CG2 4.5Å; I12-T102 HydrophobicContact CG2-CG2 3.99Å; I12-V104 HydrophobicContact CG2-CG2 4.22Å
13	T	95.9	Very high	86.2	Confident	65 Å²	65	59 Å²	59	40%	0.399	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.1	-174.7	-52.6	0	0	0	0	110.1	Q69 F71	T13-Q69 HydrophobicContact CG2-CB 4.08Å; T13-Q69 HydrophobicContact CG2-CG 3.91Å; T13-F71 HydrophobicContact CG2-CD1 3.88Å; T13-F71 HydrophobicContact CG2-CE1 3.58Å; T13-F71 HydrophobicContact CG2-CZ 4.22Å; T13-F71 VanDerWaalsContact OG1-CD1 3.3Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.2Å; T13-F71 WeakPolarHBondContact OG1-CE1 3.25Å
14	C	94.4	Very high	87	Confident	9 Å²	9	56.4 Å²	56.4	6%	0.061	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.6	165.2	177.8	0	0	0	0	108.7	W28 Q69 V70 C87	C14-W28 HydrophobicContact CB-CH2 3.85Å; C14-W28 HydrophobicContact CB-CZ2 3.6Å; C14-Q69 CarbonylContact O-C 3.39Å; C14-Q69 VanDerWaalsContact O-CA 3.3Å; C14-Q69 WeakPolarHBondContact O-CA 3.39Å; C14-V70 PolarHBondContact N-O 2.74Å; C14-V70 PolarHBondContact O-N 2.77Å; C14-C87 HydrophobicContact CB-CB 3.41Å; C14-C87 VanDerWaalsContact CB-CB 3.41Å; C14-C87 WeakPolarHBondContact CB-SG 3.39Å; C14-C87 WeakPolarHBondContact SG-CB 3.47Å; C14-C87 CovalentContact SG-SG 2.03Å; C14-C87 PolarHBondContact SG-SG 3.05Å
15	T	93.8	Very high	87.7	Confident	90 Å²	90	55.9 Å²	55.9	55%	0.552	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	120.6	170.1	-54.4	0	0	0	0	108	S68 Q69	T15-S68 WeakPolarHBondContact CA-O 3.44Å; T15-Q69 HydrophobicContact CG2-CG 4.33Å; T15-Q69 PolarHBondContact OG1-NE2 3.13Å
16	V	88.5	Confident	88.4	Confident	13 Å²	13	54 Å²	54	8%	0.079	35%	0.349	C	S	.	.			trans	-89.8	146.2	176.8	-57	0	0	0	0	110.4	F19 L21 V26 S68	V16-F19 HydrophobicContact CB-CE1 3.95Å; V16-F19 HydrophobicContact CB-CE2 3.95Å; V16-F19 HydrophobicContact CB-CZ 3.54Å; V16-F19 HydrophobicContact CG1-CE1 4.27Å; V16-F19 HydrophobicContact CG1-CE2 4Å; V16-F19 HydrophobicContact CG1-CZ 3.49Å; V16-F19 VanDerWaalsContact CG1-CZ 3.49Å; V16-F19 HydrophobicContact CG2-CE2 4.08Å; V16-F19 HydrophobicContact CG2-CZ 4.19Å; V16-L21 HydrophobicContact CB-CD2 4.29Å; V16-L21 HydrophobicContact CG1-CD2 3.83Å; V16-L21 HydrophobicContact CG2-CD1 4.35Å; V16-L21 HydrophobicContact CG2-CD2 3.5Å; V16-L21 VanDerWaalsContact CG2-CD2 3.5Å; V16-L21 HydrophobicContact CG2-CG 3.69Å; V16-V26 HydrophobicContact CG1-CG2 4.19Å; V16-S68 WeakPolarHBondContact CG2-O 3.37Å; V16-S68 PolarHBondContact N-O 2.91Å
17	S	86.7	Confident	89.2	Confident	107 Å²	107	52.1 Å²	52.1	75%	0.748	34%	0.336	S	S	*	.			trans	-143.5	146.3	176	65.4	0	0	0	0	109
18	G	82.6	Confident	89.9	Confident	92 Å²	92	47.7 Å²	47.7	95%	0.948	30%	0.304	S	S	*	.	S	Bend	trans	88.5	-7.5	-177.9	0	0	0	0	0	115.4
19	F	80.8	Confident	90.3	Very high	49 Å²	49	43.1 Å²	43.1	22%	0.215	28%	0.283	C	S	.	.	S	Bend	trans	-150.5	165.7	172.7	65.3	-89	0	0	0	111.7	V16 L21 Y24 V26 S89	V16-F19 HydrophobicContact CB-CE1 3.95Å; V16-F19 HydrophobicContact CB-CE2 3.95Å; V16-F19 HydrophobicContact CB-CZ 3.54Å; V16-F19 HydrophobicContact CG1-CE1 4.27Å; V16-F19 HydrophobicContact CG1-CE2 4Å; V16-F19 HydrophobicContact CG1-CZ 3.49Å; V16-F19 VanDerWaalsContact CG1-CZ 3.49Å; V16-F19 HydrophobicContact CG2-CE2 4.08Å; V16-F19 HydrophobicContact CG2-CZ 4.19Å; F19-L21 HydrophobicContact CE2-CD2 4.3Å; F19-Y24 HydrophobicContact CB-CD2 3.85Å; F19-Y24 HydrophobicContact CB-CE2 4.07Å; F19-Y24 AromaticContact CD2-CD2 3.91Å; F19-Y24 HydrophobicContact CD2-CD2 3.91Å; F19-Y24 HydrophobicContact CD2-CG 4.42Å; F19-Y24 HydrophobicContact CG-CD2 4.12Å; F19-V26 HydrophobicContact CE2-CG2 4.25Å; F19-V26 HydrophobicContact CZ-CG2 4.42Å; F19-S89 VanDerWaalsContact CZ-CB 3.47Å; F19-S89 WeakPolarHBondContact CZ-OG 3.3Å
20	S	84.2	Confident	90.6	Very high	53 Å²	53	40.8 Å²	40.8	37%	0.371	26%	0.264	S	S	.	.			trans	-94.3	137.2	173	-176.3	0	0	0	0	110.8	T22 S23	S20-T22 PolarHBondContact O-N 3.09Å; S20-T22 PolarHBondContact OG-N 2.85Å; S20-T22 PolarHBondContact OG-OG1 2.79Å; S20-S23 WeakPolarHBondContact O-CB 3.33Å; S20-S23 PolarHBondContact O-N 2.75Å
21	L	85.4	Confident	90.8	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-24	172.9	-67.3	177.6	0	0	0	112.7	V16 F19 S23 Y24 V26 E63 N65 V70	V16-L21 HydrophobicContact CB-CD2 4.29Å; V16-L21 HydrophobicContact CG1-CD2 3.83Å; V16-L21 HydrophobicContact CG2-CD1 4.35Å; V16-L21 HydrophobicContact CG2-CD2 3.5Å; V16-L21 VanDerWaalsContact CG2-CD2 3.5Å; V16-L21 HydrophobicContact CG2-CG 3.69Å; F19-L21 HydrophobicContact CE2-CD2 4.3Å; L21-S23 PolarHBondContact O-N 2.83Å; L21-Y24 VanDerWaalsContact O-O 3.13Å; L21-V26 HydrophobicContact CD2-CG2 3.52Å; L21-E63 HydrophobicContact CD1-CB 4.27Å; L21-N65 WeakPolarHBondContact CB-OD1 3.49Å; L21-N65 WeakPolarHBondContact CD1-OD1 3.36Å; L21-V70 HydrophobicContact CD1-CG2 3.91Å; L21-V70 HydrophobicContact CD2-CG2 3.55Å; L21-V70 HydrophobicContact CG-CG2 4.41Å
22	T	86.4	Confident	90.9	Very high	82 Å²	82	40.6 Å²	40.6	50%	0.503	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-1.1	174.4	61.5	0	0	0	0	114	S20 S45	S20-T22 PolarHBondContact O-N 3.09Å; S20-T22 PolarHBondContact OG-N 2.85Å; S20-T22 PolarHBondContact OG-OG1 2.79Å; T22-S45 WeakPolarHBondContact O-CB 3.37Å
23	S	86.8	Confident	90.8	Very high	70 Å²	70	45.1 Å²	45.1	49%	0.49	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-23	-179	-55.5	0	0	0	0	113.4	S20 L21	S20-S23 WeakPolarHBondContact O-CB 3.33Å; S20-S23 PolarHBondContact O-N 2.75Å; L21-S23 PolarHBondContact O-N 2.83Å
24	Y	87.4	Confident	90.8	Very high	79 Å²	79	46.4 Å²	46.4	31%	0.31	31%	0.312	S	S	.	.	S	Bend	trans	-141.8	147.4	-174.7	-62.8	-81.9	0	0	0	111.5	F19 L21 S89 D90	F19-Y24 HydrophobicContact CB-CD2 3.85Å; F19-Y24 HydrophobicContact CB-CE2 4.07Å; F19-Y24 AromaticContact CD2-CD2 3.91Å; F19-Y24 HydrophobicContact CD2-CD2 3.91Å; F19-Y24 HydrophobicContact CD2-CG 4.42Å; F19-Y24 HydrophobicContact CG-CD2 4.12Å; L21-Y24 VanDerWaalsContact O-O 3.13Å; Y24-S89 WeakPolarHBondContact CB-OG 3.38Å; Y24-D90 WeakPolarHBondContact CD1-O 3.49Å
25	G	90.3	Very high	90.9	Very high	4 Å²	4	52.7 Å²	52.7	4%	0.041	34%	0.338	C	S	.	.			trans	-71.4	151.7	169.7	0	0	0	0	0	112.1	I43 S89 D90	G25-I43 CarbonylContact C-O 3.57Å; G25-I43 WeakPolarHBondContact CA-O 3.32Å; G25-S89 WeakPolarHBondContact O-CA 3.4Å; G25-S89 PolarHBondContact O-OG 3.04Å; G25-D90 PolarHBondContact O-N 2.93Å
26	V	93.6	Very high	90.9	Very high	2 Å²	2	51 Å²	51	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	121.5	172.9	-179.3	0	0	0	0	109.8	V16 F19 L21 V42 I43 V70 C87 A88	V16-V26 HydrophobicContact CG1-CG2 4.19Å; F19-V26 HydrophobicContact CE2-CG2 4.25Å; F19-V26 HydrophobicContact CZ-CG2 4.42Å; L21-V26 HydrophobicContact CD2-CG2 3.52Å; V26-V42 WeakPolarHBondContact O-CA 3.33Å; V26-I43 HydrophobicContact CB-CG2 4.31Å; V26-I43 PolarHBondContact N-O 3.06Å; V26-I43 PolarHBondContact O-N 2.98Å; V26-V70 HydrophobicContact CB-CG2 3.99Å; V26-V70 HydrophobicContact CG1-CB 4.21Å; V26-V70 HydrophobicContact CG1-CG1 4.26Å; V26-V70 HydrophobicContact CG1-CG2 4.04Å; V26-V70 HydrophobicContact CG2-CG2 3.99Å; V26-C87 HydrophobicContact CG1-CB 4.19Å; V26-A88 CarbonylContact C-O 3.53Å; V26-A88 WeakPolarHBondContact CA-O 3.3Å
27	H	94.7	Very high	91.2	Very high	9 Å²	9	55 Å²	55	4%	0.042	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	146	179.7	-59.2	-106	0	0	0	109.8	W39 V41 V42 C87 A88 D90 M95	H27-W39 AromaticContact CG-NE1 3.88Å; H27-W39 AromaticContact ND1-CD1 3.94Å; H27-W39 AromaticContact ND1-NE1 3.17Å; H27-W39 PolarHBondContact ND1-NE1 3.14Å; H27-W39 VanDerWaalsContact ND1-NE1 3.17Å; H27-V41 CarbonylContact C-O 3.51Å; H27-V41 WeakPolarHBondContact CA-O 3.09Å; H27-V42 WeakPolarHBondContact CE1-CG2 3.41Å; H27-V42 WeakPolarHBondContact ND1-CB 3.48Å; H27-V42 VanDerWaalsContact NE2-CG2 3.33Å; H27-V42 WeakPolarHBondContact NE2-CG2 3.43Å; H27-C87 CarbonylContact O-C 3.56Å; H27-C87 WeakPolarHBondContact O-CA 3.01Å; H27-A88 PolarHBondContact N-O 3.29Å; H27-A88 PolarHBondContact O-N 2.88Å; H27-D90 IonicContact CD2-OD1 3.05Å; H27-D90 IonicContact CE1-OD1 3.56Å; H27-D90 IonicContact CE1-OD2 3.64Å; H27-D90 IonicContact NE2-OD1 3.78Å; H27-D90 PolarHBondContact NE2-OD1 2.77Å; H27-D90 VanDerWaalsContact NE2-OD1 3.08Å; H27-D90 IonicContact NE2-OD2 2.74Å; H27-D90 PolarHBondContact NE2-OD2 3.17Å; H27-M95 HydrophobicContact CB-CE 3.72Å; H27-M95 HydrophobicContact CB-SD 4.22Å; H27-M95 WeakPolarHBondContact ND1-CE 3.43Å
28	W	96.3	Very high	91.6	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.2	162.6	-77.3	92.5	0	0	0	109.9	I12 C14 L40 V41 L72 Y86 C87	I12-W28 HydrophobicContact CB-CH2 4.31Å; I12-W28 HydrophobicContact CD1-CE3 3.82Å; I12-W28 HydrophobicContact CD1-CH2 3.73Å; I12-W28 HydrophobicContact CD1-CZ3 3.31Å; I12-W28 HydrophobicContact CG1-CE3 4.41Å; I12-W28 HydrophobicContact CG1-CH2 3.64Å; I12-W28 HydrophobicContact CG1-CZ2 4.18Å; I12-W28 HydrophobicContact CG1-CZ3 3.79Å; C14-W28 HydrophobicContact CB-CH2 3.85Å; C14-W28 HydrophobicContact CB-CZ2 3.6Å; W28-L40 HydrophobicContact CB-CB 4.29Å; W28-L40 HydrophobicContact CB-CD1 4.45Å; W28-L40 WeakPolarHBondContact O-CB 3.46Å; W28-L40 PolarHBondContact O-N 2.92Å; W28-V41 HydrophobicContact CB-CG1 3.9Å; W28-V41 HydrophobicContact CG-CG1 4.41Å; W28-V41 PolarHBondContact N-O 3.25Å; W28-V41 PolarHBondContact O-N 2.92Å; W28-L72 HydrophobicContact CB-CD2 3.96Å; W28-L72 HydrophobicContact CD2-CB 3.76Å; W28-L72 HydrophobicContact CD2-CD2 3.89Å; W28-L72 HydrophobicContact CD2-CG 4.43Å; W28-L72 HydrophobicContact CE3-CB 4.4Å; W28-L72 HydrophobicContact CE3-CD2 4.09Å; W28-L72 HydrophobicContact CG-CB 3.96Å; W28-L72 HydrophobicContact CG-CD2 3.85Å; W28-L72 HydrophobicContact CG-CG 4.35Å; W28-L72 HydrophobicContact CZ2-CB 4.03Å; W28-Y86 WeakPolarHBondContact CA-O 3.25Å; W28-C87 HydrophobicContact CD2-CB 4.39Å; W28-C87 HydrophobicContact CE3-CB 4.37Å; W28-C87 HydrophobicContact CH2-CB 4.31Å; W28-C87 HydrophobicContact CZ2-CB 4.33Å; W28-C87 HydrophobicContact CZ3-CB 4.31Å
29	V	96.1	Very high	92.2	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.024	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	143.3	179.7	-176.6	0	0	0	0	107.4	L37 E38 Y85 Y86 M95 W98	V29-L37 HydrophobicContact CG1-CB 3.87Å; V29-L37 HydrophobicContact CG1-CD2 3.79Å; V29-L37 HydrophobicContact CG1-CG 4.35Å; V29-E38 CarbonylContact C-O 3.56Å; V29-E38 WeakPolarHBondContact CA-O 3.48Å; V29-E38 WeakPolarHBondContact CG1-O 3.43Å; V29-Y85 CarbonylContact O-C 3.49Å; V29-Y86 PolarHBondContact N-O 2.97Å; V29-Y86 PolarHBondContact O-N 3.41Å; V29-M95 HydrophobicContact CG2-SD 4.39Å; V29-W98 HydrophobicContact CB-CH2 4.04Å; V29-W98 HydrophobicContact CB-CZ3 3.86Å; V29-W98 HydrophobicContact CG1-CH2 3.98Å; V29-W98 HydrophobicContact CG1-CZ3 4.01Å; V29-W98 HydrophobicContact CG2-CH2 3.82Å; V29-W98 HydrophobicContact CG2-CZ3 4.04Å
30	R	96.3	Very high	92.9	Very high	20 Å²	20	49.6 Å²	49.6	8%	0.075	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	155.2	170.7	71.5	178	-178.6	-178.8	0.7	112	E38 L40 D81 A83 M84 Y85	R30-E38 HydrophobicContact CG-CB 4.11Å; R30-E38 IonicContact CZ-OE2 3.42Å; R30-E38 VanDerWaalsContact CZ-OE2 3.23Å; R30-E38 PolarHBondContact N-O 2.83Å; R30-E38 IonicContact NE-OE2 2.83Å; R30-E38 PolarHBondContact NE-OE2 2.83Å; R30-E38 IonicContact NH2-OE1 3.23Å; R30-E38 IonicContact NH2-OE2 2.69Å; R30-E38 PolarHBondContact NH2-OE2 2.83Å; R30-E38 PolarHBondContact O-N 2.69Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CG 4.49Å; R30-L40 HydrophobicContact CG-CD1 4.17Å; R30-L40 HydrophobicContact CG-CD2 3.87Å; R30-L40 HydrophobicContact CG-CG 4.21Å; R30-D81 IonicContact NH1-OD1 3.73Å; R30-D81 PolarHBondContact NH1-OD1 3.35Å; R30-A83 HydrophobicContact CB-CB 3.97Å; R30-A83 HydrophobicContact CG-CB 4.39Å; R30-M84 CarbonylContact C-O 3.6Å; R30-M84 WeakPolarHBondContact CA-O 3.46Å; R30-Y85 HydrophobicContact CB-CD1 3.88Å; R30-Y85 HydrophobicContact CB-CE1 3.84Å; R30-Y85 HydrophobicContact CB-CE2 4.46Å; R30-Y85 HydrophobicContact CB-CG 4.23Å
31	Q	97	Very high	93.5	Very high	79 Å²	79	47.1 Å²	47.1	37%	0.369	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	100.2	172.3	-167.7	178.3	25.4	0	0	109.5	L37 A83 M84 Y86	Q31-L37 HydrophobicContact CB-CD2 3.96Å; Q31-L37 HydrophobicContact CG-CD2 4.38Å; Q31-A83 WeakPolarHBondContact O-CA 3.42Å; Q31-A83 WeakPolarHBondContact O-CB 3.3Å; Q31-M84 PolarHBondContact N-O 3.35Å; Q31-M84 PolarHBondContact O-N 3.14Å; Q31-Y86 HydrophobicContact CB-CE2 3.96Å
32	P	95.9	Very high	93.9	Very high	11 Å²	11	47 Å²	47	7%	0.071	28%	0.277	C	S	.	.			trans	-66	151.9	171.5	-18.4	31.6	0	0	0	111.2	G34 K35 A83	P32-G34 PolarHBondContact O-N 3.36Å; P32-K35 HydrophobicContact CB-CB 4.09Å; P32-K35 HydrophobicContact CB-CD 3.98Å; P32-K35 HydrophobicContact CB-CG 4.22Å; P32-K35 HydrophobicContact CG-CB 4.3Å; P32-K35 HydrophobicContact CG-CD 4.2Å; P32-K35 PolarHBondContact O-N 2.88Å; P32-A83 HydrophobicContact CB-CB 4.49Å; P32-A83 HydrophobicContact CG-CB 4.4Å
33	P	94.7	Very high	94.3	Very high	103 Å²	103	43.5 Å²	43.5	67%	0.669	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	127.1	176.5	-25.6	33.8	0	0	0	112.1	K35 T82	P33-K35 PolarHBondContact O-N 3.42Å; P33-T82 WeakPolarHBondContact CD-O 3.48Å; P33-T82 HydrophobicContact CG-CG2 4.49Å
34	G	95.4	Very high	94.7	Very high	91 Å²	91	44.5 Å²	44.5	94%	0.938	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.6	9	179.6	0	0	0	0	0	115.5	P32	P32-G34 PolarHBondContact O-N 3.36Å
35	K	95.1	Very high	94.8	Very high	141 Å²	141	43.3 Å²	43.3	61%	0.613	25%	0.252	S	S	*	.	S	Bend	trans	-117.6	165.1	177.4	-60.3	-170.7	-174.6	174.3	0	111.9	P32 P33	P32-K35 HydrophobicContact CB-CB 4.09Å; P32-K35 HydrophobicContact CB-CD 3.98Å; P32-K35 HydrophobicContact CB-CG 4.22Å; P32-K35 HydrophobicContact CG-CB 4.3Å; P32-K35 HydrophobicContact CG-CD 4.2Å; P32-K35 PolarHBondContact O-N 2.88Å; P33-K35 PolarHBondContact O-N 3.42Å
36	G	94.8	Very high	94.8	Very high	54 Å²	54	49 Å²	49	56%	0.557	28%	0.281	S	S	*	.			trans	-71.8	175.9	171.9	0	0	0	0	0	113
37	L	95.1	Very high	94.7	Very high	99 Å²	99	50.8 Å²	50.8	52%	0.518	30%	0.299	S	S	.	.			trans	-67	133.3	173.3	-69.3	167.8	0	0	0	110.5	V29 Q31 Y86 W98	V29-L37 HydrophobicContact CG1-CB 3.87Å; V29-L37 HydrophobicContact CG1-CD2 3.79Å; V29-L37 HydrophobicContact CG1-CG 4.35Å; Q31-L37 HydrophobicContact CB-CD2 3.96Å; Q31-L37 HydrophobicContact CG-CD2 4.38Å; L37-Y86 HydrophobicContact CD2-CD2 4.36Å; L37-Y86 HydrophobicContact CD2-CE2 4.41Å; L37-W98 HydrophobicContact CD1-CH2 3.98Å; L37-W98 HydrophobicContact CD1-CZ3 4.39Å; L37-W98 HydrophobicContact CD2-CZ3 4.3Å
38	E	95.1	Very high	94.6	Very high	56 Å²	56	52.8 Å²	52.8	26%	0.262	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	116.2	176.6	-176.2	-178.5	-168.6	0	0	109.2	V29 R30 L40	V29-E38 CarbonylContact C-O 3.56Å; V29-E38 WeakPolarHBondContact CA-O 3.48Å; V29-E38 WeakPolarHBondContact CG1-O 3.43Å; R30-E38 HydrophobicContact CG-CB 4.11Å; R30-E38 IonicContact CZ-OE2 3.42Å; R30-E38 VanDerWaalsContact CZ-OE2 3.23Å; R30-E38 PolarHBondContact N-O 2.83Å; R30-E38 IonicContact NE-OE2 2.83Å; R30-E38 PolarHBondContact NE-OE2 2.83Å; R30-E38 IonicContact NH2-OE1 3.23Å; R30-E38 IonicContact NH2-OE2 2.69Å; R30-E38 PolarHBondContact NH2-OE2 2.83Å; R30-E38 PolarHBondContact O-N 2.69Å; E38-L40 HydrophobicContact CG-CD2 4.5Å
39	W	95.1	Very high	94.6	Very high	77 Å²	77	55.5 Å²	55.5	29%	0.292	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	136	175	178.3	80.1	0	0	0	111	H27 V41 V42 T50 N52	H27-W39 AromaticContact CG-NE1 3.88Å; H27-W39 AromaticContact ND1-CD1 3.94Å; H27-W39 AromaticContact ND1-NE1 3.17Å; H27-W39 PolarHBondContact ND1-NE1 3.14Å; H27-W39 VanDerWaalsContact ND1-NE1 3.17Å; W39-V41 VanDerWaalsContact CZ2-C 3.48Å; W39-V42 HydrophobicContact CZ2-CB 3.97Å; W39-V42 HydrophobicContact CZ2-CG1 3.82Å; W39-T50 HydrophobicContact CH2-CG2 4.06Å; W39-T50 VanDerWaalsContact CH2-O 3.25Å; W39-T50 WeakPolarHBondContact CH2-O 3.2Å; W39-T50 WeakPolarHBondContact CZ2-O 3.41Å; W39-N52 HydrophobicContact CE3-CB 3.99Å; W39-N52 HydrophobicContact CZ3-CB 3.99Å; W39-N52 VanDerWaalsContact CZ3-N 3.34Å; W39-N52 WeakPolarHBondContact O-CB 3.46Å; W39-N52 PolarHBondContact O-ND2 2.94Å
40	L	95.6	Very high	94.6	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-56.7	-172.7	-60.3	-176	0	0	0	113	W28 R30 E38 N52 L55 L59 L72 Y85	W28-L40 HydrophobicContact CB-CB 4.29Å; W28-L40 HydrophobicContact CB-CD1 4.45Å; W28-L40 WeakPolarHBondContact O-CB 3.46Å; W28-L40 PolarHBondContact O-N 2.92Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CG 4.49Å; R30-L40 HydrophobicContact CG-CD1 4.17Å; R30-L40 HydrophobicContact CG-CD2 3.87Å; R30-L40 HydrophobicContact CG-CG 4.21Å; E38-L40 HydrophobicContact CG-CD2 4.5Å; L40-N52 VanDerWaalsContact O-CB 3.3Å; L40-N52 WeakPolarHBondContact O-CB 3.32Å; L40-N52 PolarHBondContact O-N 2.88Å; L40-L55 HydrophobicContact CD2-CD1 3.29Å; L40-L59 HydrophobicContact CB-CD1 3.96Å; L40-L59 HydrophobicContact CD2-CD1 4.4Å; L40-L72 HydrophobicContact CD1-CD2 3.91Å; L40-Y85 HydrophobicContact CD1-CD1 3.89Å; L40-Y85 HydrophobicContact CD1-CE1 3.68Å
41	V	96.1	Very high	94.6	Very high	0 Å²	0	60 Å²	60	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	154.7	-171.2	57	0	0	0	0	109.8	H27 W28 W39 T50 Y51 I61 L72	H27-V41 CarbonylContact C-O 3.51Å; H27-V41 WeakPolarHBondContact CA-O 3.09Å; W28-V41 HydrophobicContact CB-CG1 3.9Å; W28-V41 HydrophobicContact CG-CG1 4.41Å; W28-V41 PolarHBondContact N-O 3.25Å; W28-V41 PolarHBondContact O-N 2.92Å; W39-V41 VanDerWaalsContact CZ2-C 3.48Å; V41-T50 CarbonylContact C-O 3.54Å; V41-T50 VanDerWaalsContact CA-O 3.25Å; V41-T50 WeakPolarHBondContact CA-O 3.33Å; V41-T50 WeakPolarHBondContact CG2-O 3.3Å; V41-Y51 HydrophobicContact CB-CD1 3.92Å; V41-Y51 HydrophobicContact CB-CE1 4.28Å; V41-Y51 HydrophobicContact CB-CG 4.45Å; V41-Y51 HydrophobicContact CG2-CD1 3.53Å; V41-Y51 HydrophobicContact CG2-CD2 4.29Å; V41-Y51 HydrophobicContact CG2-CE1 3.58Å; V41-Y51 HydrophobicContact CG2-CE2 4.32Å; V41-Y51 HydrophobicContact CG2-CG 3.91Å; V41-I61 HydrophobicContact CG1-CB 4.36Å; V41-I61 HydrophobicContact CG1-CD1 4Å; V41-I61 HydrophobicContact CG2-CB 4.03Å; V41-I61 HydrophobicContact CG2-CD1 4.13Å; V41-I61 HydrophobicContact CG2-CG2 3.67Å; V41-L72 HydrophobicContact CG1-CD1 3.82Å
42	V	95.1	Very high	94.4	Very high	1 Å²	1	58 Å²	58	1%	0.006	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.5	167	63.5	0	0	0	0	109.8	V26 H27 W39 W44 T49 T50	V26-V42 WeakPolarHBondContact O-CA 3.33Å; H27-V42 WeakPolarHBondContact CE1-CG2 3.41Å; H27-V42 WeakPolarHBondContact ND1-CB 3.48Å; H27-V42 VanDerWaalsContact NE2-CG2 3.33Å; H27-V42 WeakPolarHBondContact NE2-CG2 3.43Å; W39-V42 HydrophobicContact CZ2-CB 3.97Å; W39-V42 HydrophobicContact CZ2-CG1 3.82Å; V42-W44 HydrophobicContact CG1-CD2 4.3Å; V42-W44 HydrophobicContact CG1-CZ2 3.77Å; V42-W44 HydrophobicContact CG2-CD2 4Å; V42-W44 HydrophobicContact CG2-CE3 4.18Å; V42-W44 HydrophobicContact CG2-CG 4.49Å; V42-W44 HydrophobicContact CG2-CH2 4.39Å; V42-W44 HydrophobicContact CG2-CZ2 4.23Å; V42-W44 HydrophobicContact CG2-CZ3 4.37Å; V42-T49 VanDerWaalsContact O-CA 3.27Å; V42-T49 WeakPolarHBondContact O-CA 3.25Å; V42-T50 PolarHBondContact N-O 3.32Å; V42-T50 PolarHBondContact O-N 2.83Å
43	I	94.9	Very high	94.2	Very high	9 Å²	9	62.7 Å²	62.7	5%	0.046	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.1	158.4	-172.3	161.7	0	0	0	107.9	G25 V26 T49 I61 E63 V70	G25-I43 CarbonylContact C-O 3.57Å; G25-I43 WeakPolarHBondContact CA-O 3.32Å; V26-I43 HydrophobicContact CB-CG2 4.31Å; V26-I43 PolarHBondContact N-O 3.06Å; V26-I43 PolarHBondContact O-N 2.98Å; I43-T49 HydrophobicContact CB-CG2 4.1Å; I43-T49 HydrophobicContact CD1-CG2 4.2Å; I43-T49 HydrophobicContact CG1-CG2 3.94Å; I43-I61 HydrophobicContact CB-CD1 3.78Å; I43-I61 HydrophobicContact CB-CG1 4.23Å; I43-I61 HydrophobicContact CB-CG2 4.28Å; I43-I61 HydrophobicContact CG2-CD1 3.64Å; I43-I61 HydrophobicContact CG2-CG1 4.17Å; I43-E63 HydrophobicContact CD1-CB 4.11Å; I43-E63 HydrophobicContact CD1-CG 3.78Å; I43-V70 HydrophobicContact CG2-CG1 3.86Å; I43-V70 HydrophobicContact CG2-CG2 4.49Å
44	W	93.2	Very high	93.8	Very high	90 Å²	90	61.4 Å²	61.4	34%	0.341	38%	0.379	S	S	.	.			trans	-85.4	163.2	-180	-62.8	110	0	0	0	110.5	V42 D46 G47 S48 T50 D90	V42-W44 HydrophobicContact CG1-CD2 4.3Å; V42-W44 HydrophobicContact CG1-CZ2 3.77Å; V42-W44 HydrophobicContact CG2-CD2 4Å; V42-W44 HydrophobicContact CG2-CE3 4.18Å; V42-W44 HydrophobicContact CG2-CG 4.49Å; V42-W44 HydrophobicContact CG2-CH2 4.39Å; V42-W44 HydrophobicContact CG2-CZ2 4.23Å; V42-W44 HydrophobicContact CG2-CZ3 4.37Å; W44-D46 VanDerWaalsContact CB-OD1 3.31Å; W44-D46 WeakPolarHBondContact CB-OD1 3.36Å; W44-D46 PolarHBondContact O-N 3.33Å; W44-D46 VanDerWaalsContact O-N 3.11Å; W44-G47 WeakPolarHBondContact O-CA 3.49Å; W44-G47 PolarHBondContact O-N 3.5Å; W44-S48 PolarHBondContact N-O 2.87Å; W44-T50 PolarHBondContact NE1-OG1 2.98Å; W44-D90 VanDerWaalsContact CZ3-OD2 3.24Å; W44-D90 WeakPolarHBondContact CZ3-OD2 3.36Å
45	S	90.2	Very high	93.4	Very high	55 Å²	55	57.6 Å²	57.6	39%	0.385	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.4	-178.8	56	0	0	0	0	114.5	T22 G47	T22-S45 WeakPolarHBondContact O-CB 3.37Å; S45-G47 VanDerWaalsContact C-N 3.3Å
46	D	90.8	Very high	93.1	Very high	123 Å²	123	57.1 Å²	57.1	66%	0.658	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	3.4	173	70.7	-10	0	0	0	113.1	W44 S48	W44-D46 VanDerWaalsContact CB-OD1 3.31Å; W44-D46 WeakPolarHBondContact CB-OD1 3.36Å; W44-D46 PolarHBondContact O-N 3.33Å; W44-D46 VanDerWaalsContact O-N 3.11Å; D46-S48 VanDerWaalsContact C-N 3.26Å; D46-S48 PolarHBondContact O-N 3.05Å; D46-S48 WeakPolarHBondContact OD1-CB 3.45Å; D46-S48 PolarHBondContact OD1-N 3Å; D46-S48 PolarHBondContact OD1-OG 3.4Å; D46-S48 PolarHBondContact OD2-OG 2.76Å
47	G	91.3	Very high	93	Very high	39 Å²	39	60 Å²	60	40%	0.402	35%	0.347	S	S	.	.	S	Bend	trans	80.4	-1.4	-177.4	0	0	0	0	0	114.3	W44 S45	W44-G47 WeakPolarHBondContact O-CA 3.49Å; W44-G47 PolarHBondContact O-N 3.5Å; S45-G47 VanDerWaalsContact C-N 3.3Å
48	S	93.6	Very high	93	Very high	52 Å²	52	56.9 Å²	56.9	36%	0.364	33%	0.328	S	S	.	.			trans	-69.8	149.6	175.2	70.7	0	0	0	0	110.8	W44 D46	W44-S48 PolarHBondContact N-O 2.87Å; D46-S48 VanDerWaalsContact C-N 3.26Å; D46-S48 PolarHBondContact O-N 3.05Å; D46-S48 WeakPolarHBondContact OD1-CB 3.45Å; D46-S48 PolarHBondContact OD1-N 3Å; D46-S48 PolarHBondContact OD1-OG 3.4Å; D46-S48 PolarHBondContact OD2-OG 2.76Å
49	T	95.8	Very high	92.9	Very high	60 Å²	60	55 Å²	55	37%	0.368	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.4	-174.9	54.8	0	0	0	0	111.3	V42 I43 Y51 I61	V42-T49 VanDerWaalsContact O-CA 3.27Å; V42-T49 WeakPolarHBondContact O-CA 3.25Å; I43-T49 HydrophobicContact CB-CG2 4.1Å; I43-T49 HydrophobicContact CD1-CG2 4.2Å; I43-T49 HydrophobicContact CG1-CG2 3.94Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.49Å; T49-I61 HydrophobicContact CG2-CG2 3.43Å; T49-I61 VanDerWaalsContact CG2-CG2 3.43Å
50	T	95.6	Very high	92.9	Very high	69 Å²	69	53.8 Å²	53.8	42%	0.423	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130	174.4	-50.4	0	0	0	0	108.9	W39 V41 V42 W44	W39-T50 HydrophobicContact CH2-CG2 4.06Å; W39-T50 VanDerWaalsContact CH2-O 3.25Å; W39-T50 WeakPolarHBondContact CH2-O 3.2Å; W39-T50 WeakPolarHBondContact CZ2-O 3.41Å; V41-T50 CarbonylContact C-O 3.54Å; V41-T50 VanDerWaalsContact CA-O 3.25Å; V41-T50 WeakPolarHBondContact CA-O 3.33Å; V41-T50 WeakPolarHBondContact CG2-O 3.3Å; V42-T50 PolarHBondContact N-O 3.32Å; V42-T50 PolarHBondContact O-N 2.83Å; W44-T50 PolarHBondContact NE1-OG1 2.98Å
51	Y	95.8	Very high	92.9	Very high	50 Å²	50	54.3 Å²	54.3	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	148.4	-175.3	-66.6	-100.6	0	0	0	110.7	V41 T49 S53 K56 L59 I61	V41-Y51 HydrophobicContact CB-CD1 3.92Å; V41-Y51 HydrophobicContact CB-CE1 4.28Å; V41-Y51 HydrophobicContact CB-CG 4.45Å; V41-Y51 HydrophobicContact CG2-CD1 3.53Å; V41-Y51 HydrophobicContact CG2-CD2 4.29Å; V41-Y51 HydrophobicContact CG2-CE1 3.58Å; V41-Y51 HydrophobicContact CG2-CE2 4.32Å; V41-Y51 HydrophobicContact CG2-CG 3.91Å; T49-Y51 WeakPolarHBondContact OG1-CE2 3.49Å; Y51-S53 PolarHBondContact O-N 3.37Å; Y51-K56 HydrophobicContact CD1-CG 4.38Å; Y51-K56 HydrophobicContact CD2-CG 4.39Å; Y51-K56 HydrophobicContact CG-CB 4.44Å; Y51-K56 HydrophobicContact CG-CD 4.49Å; Y51-K56 HydrophobicContact CG-CG 3.95Å; Y51-L59 HydrophobicContact CD1-CB 4.2Å; Y51-L59 HydrophobicContact CE1-CB 4.2Å; Y51-I61 PolarHBondContact OH-N 2.87Å
52	N	93.9	Very high	92.9	Very high	36 Å²	36	57.2 Å²	57.2	19%	0.193	35%	0.346	C	S	.	.			trans	-63.6	121.9	161.8	-177.2	-27.5	0	0	0	109.1	W39 L40 A54 L55 K56	W39-N52 HydrophobicContact CE3-CB 3.99Å; W39-N52 HydrophobicContact CZ3-CB 3.99Å; W39-N52 VanDerWaalsContact CZ3-N 3.34Å; W39-N52 WeakPolarHBondContact O-CB 3.46Å; W39-N52 PolarHBondContact O-ND2 2.94Å; L40-N52 VanDerWaalsContact O-CB 3.3Å; L40-N52 WeakPolarHBondContact O-CB 3.32Å; L40-N52 PolarHBondContact O-N 2.88Å; N52-A54 PolarHBondContact O-N 3.07Å; N52-A54 VanDerWaalsContact O-N 3.15Å; N52-A54 WeakPolarHBondContact OD1-CB 3.35Å; N52-A54 PolarHBondContact OD1-N 2.9Å; N52-L55 PolarHBondContact O-N 3.5Å; N52-K56 PolarHBondContact O-N 2.88Å
53	S	90.8	Very high	92.8	Very high	111 Å²	111	59.8 Å²	59.8	78%	0.776	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.9	-175.3	51.1	0	0	0	0	113.4	Y51 L55	Y51-S53 PolarHBondContact O-N 3.37Å; S53-L55 VanDerWaalsContact C-N 3.28Å; S53-L55 PolarHBondContact O-N 3.17Å
54	A	87.5	Confident	92.8	Very high	75 Å²	75	61.1 Å²	61.1	62%	0.62	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-26.2	-179.7	0	0	0	0	0	113.3	N52	N52-A54 PolarHBondContact O-N 3.07Å; N52-A54 VanDerWaalsContact O-N 3.15Å; N52-A54 WeakPolarHBondContact OD1-CB 3.35Å; N52-A54 PolarHBondContact OD1-N 2.9Å
55	L	85.6	Confident	92.6	Very high	12 Å²	12	60.1 Å²	60.1	6%	0.063	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-7.3	-171.5	-62.5	170.4	0	0	0	113.3	L40 N52 S53 S57 R58 L59	L40-L55 HydrophobicContact CD2-CD1 3.29Å; N52-L55 PolarHBondContact O-N 3.5Å; S53-L55 VanDerWaalsContact C-N 3.28Å; S53-L55 PolarHBondContact O-N 3.17Å; L55-S57 PolarHBondContact O-N 2.81Å; L55-R58 PolarHBondContact O-N 3.01Å; L55-L59 HydrophobicContact CB-CD1 3.7Å; L55-L59 HydrophobicContact CB-CG 4.13Å; L55-L59 WeakPolarHBondContact O-CG 3.25Å; L55-L59 PolarHBondContact O-N 3.48Å
56	K	89.9	Confident	92.7	Very high	130 Å²	130	62.5 Å²	62.5	57%	0.565	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-36.1	-175.9	-175.5	175.3	-178	178.6	0	114.5	Y51 N52 R58	Y51-K56 HydrophobicContact CD1-CG 4.38Å; Y51-K56 HydrophobicContact CD2-CG 4.39Å; Y51-K56 HydrophobicContact CG-CB 4.44Å; Y51-K56 HydrophobicContact CG-CD 4.49Å; Y51-K56 HydrophobicContact CG-CG 3.95Å; N52-K56 PolarHBondContact O-N 2.88Å; K56-R58 PolarHBondContact O-N 3.41Å
57	S	92.5	Very high	92.7	Very high	114 Å²	114	62.5 Å²	62.5	80%	0.797	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.5	-177.6	58.2	0	0	0	0	114	L55	L55-S57 PolarHBondContact O-N 2.81Å
58	R	93.6	Very high	92.8	Very high	34 Å²	34	62.7 Å²	62.7	13%	0.128	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-10.5	-174.2	-59.6	-167.9	-57.7	116.5	0.1	113.5	L55 K56 N75 S76 D81	L55-R58 PolarHBondContact O-N 3.01Å; K56-R58 PolarHBondContact O-N 3.41Å; R58-N75 PolarHBondContact O-N 2.89Å; R58-N75 PolarHBondContact O-ND2 3.12Å; R58-S76 PolarHBondContact NH1-O 3.34Å; R58-S76 VanDerWaalsContact NH1-O 3.14Å; R58-D81 IonicContact CZ-OD1 3.08Å; R58-D81 IonicContact CZ-OD2 3.58Å; R58-D81 IonicContact NH1-OD1 3.68Å; R58-D81 IonicContact NH1-OD2 2.83Å; R58-D81 PolarHBondContact NH1-OD2 2.03Å; R58-D81 IonicContact NH2-OD1 2.83Å; R58-D81 PolarHBondContact NH2-OD1 3.45Å; R58-D81 IonicContact NH2-OD2 3.51Å; R58-D81 PolarHBondContact NH2-OD2 2.86Å
59	L	94.8	Very high	92.9	Very high	18 Å²	18	62.4 Å²	62.4	9%	0.094	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	146.2	-176.9	-58.6	-177.1	0	0	0	111.7	L40 Y51 L55 L72 K73 M74	L40-L59 HydrophobicContact CB-CD1 3.96Å; L40-L59 HydrophobicContact CD2-CD1 4.4Å; Y51-L59 HydrophobicContact CD1-CB 4.2Å; Y51-L59 HydrophobicContact CE1-CB 4.2Å; L55-L59 HydrophobicContact CB-CD1 3.7Å; L55-L59 HydrophobicContact CB-CG 4.13Å; L55-L59 WeakPolarHBondContact O-CG 3.25Å; L55-L59 PolarHBondContact O-N 3.48Å; L59-L72 HydrophobicContact CB-CD1 4.37Å; L59-L72 HydrophobicContact CD2-CD1 4.24Å; L59-K73 CarbonylContact C-O 3.54Å; L59-K73 WeakPolarHBondContact CA-O 3.3Å; L59-M74 HydrophobicContact CD2-CB 4.31Å; L59-M74 HydrophobicContact CD2-CG 3.63Å
60	S	94.9	Very high	92.9	Very high	50 Å²	50	59.5 Å²	59.5	35%	0.35	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	133.1	168.7	170.1	0	0	0	0	108.5	K73	S60-K73 PolarHBondContact N-O 3.41Å; S60-K73 PolarHBondContact O-N 2.94Å
61	I	95.9	Very high	92.9	Very high	13 Å²	13	58.3 Å²	58.3	7%	0.067	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	144.9	176.5	-166.1	169.1	0	0	0	110.3	V41 I43 T49 Y51 V70 F71	V41-I61 HydrophobicContact CG1-CB 4.36Å; V41-I61 HydrophobicContact CG1-CD1 4Å; V41-I61 HydrophobicContact CG2-CB 4.03Å; V41-I61 HydrophobicContact CG2-CD1 4.13Å; V41-I61 HydrophobicContact CG2-CG2 3.67Å; I43-I61 HydrophobicContact CB-CD1 3.78Å; I43-I61 HydrophobicContact CB-CG1 4.23Å; I43-I61 HydrophobicContact CB-CG2 4.28Å; I43-I61 HydrophobicContact CG2-CD1 3.64Å; I43-I61 HydrophobicContact CG2-CG1 4.17Å; T49-I61 HydrophobicContact CG2-CG2 3.43Å; T49-I61 VanDerWaalsContact CG2-CG2 3.43Å; Y51-I61 PolarHBondContact OH-N 2.87Å; I61-V70 HydrophobicContact CD1-CG1 3.91Å; I61-V70 HydrophobicContact CG1-CG1 3.89Å; I61-F71 WeakPolarHBondContact CA-O 3.14Å; I61-F71 WeakPolarHBondContact CG1-O 3.46Å
62	S	94.6	Very high	92.9	Very high	61 Å²	61	55.9 Å²	55.9	43%	0.427	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	157.8	174	57.5	0	0	0	0	110.7	F71	S62-F71 PolarHBondContact N-O 2.84Å; S62-F71 VanDerWaalsContact N-O 3.07Å; S62-F71 PolarHBondContact O-N 3.05Å
63	E	94.3	Very high	93	Very high	55 Å²	55	59 Å²	59	26%	0.257	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153.2	176.5	63.8	179.1	-150	0	0	112.4	L21 I43 N65 Q69 V70	L21-E63 HydrophobicContact CD1-CB 4.27Å; I43-E63 HydrophobicContact CD1-CB 4.11Å; I43-E63 HydrophobicContact CD1-CG 3.78Å; E63-N65 PolarHBondContact OE1-ND2 3.45Å; E63-N65 PolarHBondContact OE1-OD1 3.29Å; E63-Q69 CarbonylContact C-O 3.54Å; E63-Q69 WeakPolarHBondContact CA-O 3.08Å; E63-V70 HydrophobicContact CB-CG2 4.29Å
64	D	93.5	Very high	93.2	Very high	36 Å²	36	53.8 Å²	53.8	19%	0.193	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	95.9	167.9	-176.6	-14.5	0	0	0	108.4	S66 K67 S68 Q69 F71	D64-S66 PolarHBondContact O-N 3.05Å; D64-S66 WeakPolarHBondContact OD1-CB 3.48Å; D64-S66 PolarHBondContact OD1-N 3.5Å; D64-S66 PolarHBondContact OD1-OG 2.93Å; D64-K67 HydrophobicContact CB-CB 4.42Å; D64-K67 CarbonylContact O-C 3.54Å; D64-K67 PolarHBondContact O-N 3.34Å; D64-K67 VanDerWaalsContact O-N 3.12Å; D64-K67 PolarHBondContact OD1-N 2.89Å; D64-K67 WeakPolarHBondContact OD2-CD 3.46Å; D64-K67 WeakPolarHBondContact OD2-CE 3.38Å; D64-K67 WeakPolarHBondContact OD2-CG 3.35Å; D64-K67 IonicContact OD2-NZ 2.75Å; D64-K67 PolarHBondContact OD2-NZ 2.82Å; D64-S68 PolarHBondContact O-N 2.76Å; D64-Q69 PolarHBondContact N-O 3.46Å; D64-Q69 PolarHBondContact O-N 2.77Å; D64-F71 HydrophobicContact CB-CE2 3.83Å; D64-F71 HydrophobicContact CB-CZ 4.48Å
65	N	90.2	Very high	93.5	Very high	70 Å²	70	52.4 Å²	52.4	37%	0.374	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.7	-178.4	-66.8	-23.2	0	0	0	112.3	L21 E63 K67 S68	L21-N65 WeakPolarHBondContact CB-OD1 3.49Å; L21-N65 WeakPolarHBondContact CD1-OD1 3.36Å; E63-N65 PolarHBondContact OE1-ND2 3.45Å; E63-N65 PolarHBondContact OE1-OD1 3.29Å; N65-K67 PolarHBondContact O-N 2.84Å; N65-S68 PolarHBondContact O-N 3.43Å
66	S	90.9	Very high	93.7	Very high	105 Å²	105	55.1 Å²	55.1	73%	0.734	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.6	177.4	76.9	0	0	0	0	112.6	D64	D64-S66 PolarHBondContact O-N 3.05Å; D64-S66 WeakPolarHBondContact OD1-CB 3.48Å; D64-S66 PolarHBondContact OD1-N 3.5Å; D64-S66 PolarHBondContact OD1-OG 2.93Å
67	K	92.5	Very high	93.8	Very high	123 Å²	123	49 Å²	49	54%	0.535	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-1.9	178.4	-61.2	-173.3	-166.5	115.4	0	113.5	D64 N65 Q69	D64-K67 HydrophobicContact CB-CB 4.42Å; D64-K67 CarbonylContact O-C 3.54Å; D64-K67 PolarHBondContact O-N 3.34Å; D64-K67 VanDerWaalsContact O-N 3.12Å; D64-K67 PolarHBondContact OD1-N 2.89Å; D64-K67 WeakPolarHBondContact OD2-CD 3.46Å; D64-K67 WeakPolarHBondContact OD2-CE 3.38Å; D64-K67 WeakPolarHBondContact OD2-CG 3.35Å; D64-K67 IonicContact OD2-NZ 2.75Å; D64-K67 PolarHBondContact OD2-NZ 2.82Å; N65-K67 PolarHBondContact O-N 2.84Å; K67-Q69 VanDerWaalsContact C-N 3.27Å; K67-Q69 HydrophobicContact CB-CB 4.3Å; K67-Q69 HydrophobicContact CB-CG 4.09Å; K67-Q69 PolarHBondContact O-N 3.08Å
68	S	92.1	Very high	93.7	Very high	43 Å²	43	48.1 Å²	48.1	30%	0.301	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	46.9	-172.2	-58.5	0	0	0	0	111.6	T15 V16 D64 N65	T15-S68 WeakPolarHBondContact CA-O 3.44Å; V16-S68 WeakPolarHBondContact CG2-O 3.37Å; V16-S68 PolarHBondContact N-O 2.91Å; D64-S68 PolarHBondContact O-N 2.76Å; N65-S68 PolarHBondContact O-N 3.43Å
69	Q	95.4	Very high	93.6	Very high	45 Å²	45	50.1 Å²	50.1	21%	0.21	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.2	-175.9	-77.3	177.6	-14.3	0	0	112.6	T13 C14 T15 E63 D64 K67 F71	T13-Q69 HydrophobicContact CG2-CB 4.08Å; T13-Q69 HydrophobicContact CG2-CG 3.91Å; C14-Q69 CarbonylContact O-C 3.39Å; C14-Q69 VanDerWaalsContact O-CA 3.3Å; C14-Q69 WeakPolarHBondContact O-CA 3.39Å; T15-Q69 HydrophobicContact CG2-CG 4.33Å; T15-Q69 PolarHBondContact OG1-NE2 3.13Å; E63-Q69 CarbonylContact C-O 3.54Å; E63-Q69 WeakPolarHBondContact CA-O 3.08Å; D64-Q69 PolarHBondContact N-O 3.46Å; D64-Q69 PolarHBondContact O-N 2.77Å; K67-Q69 VanDerWaalsContact C-N 3.27Å; K67-Q69 HydrophobicContact CB-CB 4.3Å; K67-Q69 HydrophobicContact CB-CG 4.09Å; K67-Q69 PolarHBondContact O-N 3.08Å; Q69-F71 HydrophobicContact CB-CE1 4.46Å; Q69-F71 HydrophobicContact CB-CE2 3.79Å; Q69-F71 HydrophobicContact CB-CZ 3.68Å
70	V	95.6	Very high	93.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.5	171.4	-175.7	0	0	0	0	108.8	C14 L21 V26 I43 I61 E63	C14-V70 PolarHBondContact N-O 2.74Å; C14-V70 PolarHBondContact O-N 2.77Å; L21-V70 HydrophobicContact CD1-CG2 3.91Å; L21-V70 HydrophobicContact CD2-CG2 3.55Å; L21-V70 HydrophobicContact CG-CG2 4.41Å; V26-V70 HydrophobicContact CB-CG2 3.99Å; V26-V70 HydrophobicContact CG1-CB 4.21Å; V26-V70 HydrophobicContact CG1-CG1 4.26Å; V26-V70 HydrophobicContact CG1-CG2 4.04Å; V26-V70 HydrophobicContact CG2-CG2 3.99Å; I43-V70 HydrophobicContact CG2-CG1 3.86Å; I43-V70 HydrophobicContact CG2-CG2 4.49Å; I61-V70 HydrophobicContact CD1-CG1 3.91Å; I61-V70 HydrophobicContact CG1-CG1 3.89Å; E63-V70 HydrophobicContact CB-CG2 4.29Å
71	F	96.4	Very high	93.2	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	-115	130.4	-175.4	-53.2	-91.5	0	0	0	109.7	I12 T13 I61 S62 D64 Q69	I12-F71 WeakPolarHBondContact O-CA 3.42Å; T13-F71 HydrophobicContact CG2-CD1 3.88Å; T13-F71 HydrophobicContact CG2-CE1 3.58Å; T13-F71 HydrophobicContact CG2-CZ 4.22Å; T13-F71 VanDerWaalsContact OG1-CD1 3.3Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.2Å; T13-F71 WeakPolarHBondContact OG1-CE1 3.25Å; I61-F71 WeakPolarHBondContact CA-O 3.14Å; I61-F71 WeakPolarHBondContact CG1-O 3.46Å; S62-F71 PolarHBondContact N-O 2.84Å; S62-F71 VanDerWaalsContact N-O 3.07Å; S62-F71 PolarHBondContact O-N 3.05Å; D64-F71 HydrophobicContact CB-CE2 3.83Å; D64-F71 HydrophobicContact CB-CZ 4.48Å; Q69-F71 HydrophobicContact CB-CE1 4.46Å; Q69-F71 HydrophobicContact CB-CE2 3.79Å; Q69-F71 HydrophobicContact CB-CZ 3.68Å
72	L	97	Very high	93.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	111.5	167.1	175.9	64.6	0	0	0	108.9	S11 I12 W28 L40 V41 L59 M74 Y85	S11-L72 WeakPolarHBondContact CA-O 3.46Å; I12-L72 HydrophobicContact CD1-CB 4.38Å; I12-L72 HydrophobicContact CD1-CD2 4.07Å; I12-L72 HydrophobicContact CG1-CB 3.8Å; I12-L72 HydrophobicContact CG1-CD2 4.36Å; I12-L72 HydrophobicContact CG1-CG 4.39Å; I12-L72 PolarHBondContact N-O 3.15Å; I12-L72 PolarHBondContact O-N 3.01Å; W28-L72 HydrophobicContact CB-CD2 3.96Å; W28-L72 HydrophobicContact CD2-CB 3.76Å; W28-L72 HydrophobicContact CD2-CD2 3.89Å; W28-L72 HydrophobicContact CD2-CG 4.43Å; W28-L72 HydrophobicContact CE3-CB 4.4Å; W28-L72 HydrophobicContact CE3-CD2 4.09Å; W28-L72 HydrophobicContact CG-CB 3.96Å; W28-L72 HydrophobicContact CG-CD2 3.85Å; W28-L72 HydrophobicContact CG-CG 4.35Å; W28-L72 HydrophobicContact CZ2-CB 4.03Å; L40-L72 HydrophobicContact CD1-CD2 3.91Å; V41-L72 HydrophobicContact CG1-CD1 3.82Å; L59-L72 HydrophobicContact CB-CD1 4.37Å; L59-L72 HydrophobicContact CD2-CD1 4.24Å; L72-M74 HydrophobicContact CD2-CG 4.31Å; L72-M74 HydrophobicContact CD2-SD 4.39Å; L72-M74 HydrophobicContact CG-CG 4.13Å; L72-Y85 HydrophobicContact CD2-CD1 4.11Å; L72-Y85 HydrophobicContact CD2-CE1 4.35Å
73	K	95.6	Very high	93.3	Very high	101 Å²	101	50.9 Å²	50.9	44%	0.439	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122	171.4	-172.2	177.3	-176.3	-175.8	0	109.8	L10 L59 S60 N75	L10-K73 WeakPolarHBondContact O-CA 3.06Å; L59-K73 CarbonylContact C-O 3.54Å; L59-K73 WeakPolarHBondContact CA-O 3.3Å; S60-K73 PolarHBondContact N-O 3.41Å; S60-K73 PolarHBondContact O-N 2.94Å; K73-N75 VanDerWaalsContact CE-OD1 3.25Å; K73-N75 WeakPolarHBondContact CE-OD1 2.96Å
74	M	94.4	Very high	93.4	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.4	174.6	-60.6	178.7	-77.8	0	0	108.2	S9 L10 I12 L59 L72 L77 Y85 V104	S9-M74 CarbonylContact C-O 3.44Å; S9-M74 WeakPolarHBondContact CA-O 3.41Å; S9-M74 WeakPolarHBondContact CB-O 3.39Å; L10-M74 HydrophobicContact CB-CE 4.36Å; L10-M74 HydrophobicContact CD2-CE 3.93Å; L10-M74 HydrophobicContact CG-CE 4.31Å; L10-M74 PolarHBondContact N-O 3.05Å; L10-M74 PolarHBondContact O-N 2.8Å; I12-M74 HydrophobicContact CD1-CE 4.16Å; I12-M74 HydrophobicContact CG1-CE 4.39Å; I12-M74 HydrophobicContact CG2-CE 4.25Å; L59-M74 HydrophobicContact CD2-CB 4.31Å; L59-M74 HydrophobicContact CD2-CG 3.63Å; L72-M74 HydrophobicContact CD2-CG 4.31Å; L72-M74 HydrophobicContact CD2-SD 4.39Å; L72-M74 HydrophobicContact CG-CG 4.13Å; M74-L77 HydrophobicContact CB-CD2 3.9Å; M74-L77 HydrophobicContact CE-CD2 4.48Å; M74-L77 HydrophobicContact SD-CD2 4.28Å; M74-Y85 HydrophobicContact CE-CD1 4.48Å; M74-Y85 HydrophobicContact CE-CE1 4.06Å; M74-Y85 HydrophobicContact SD-CD1 4.18Å; M74-Y85 HydrophobicContact SD-CE1 3.32Å; M74-Y85 WeakPolarHBondContact SD-CE1 3.31Å; M74-Y85 HydrophobicContact SD-CE2 4.42Å; M74-Y85 PolarHBondContact SD-OH 3.45Å; M74-Y85 VanDerWaalsContact SD-OH 3.37Å; M74-V104 HydrophobicContact CE-CG2 4.46Å
75	N	93.1	Very high	93.6	Very high	46 Å²	46	49.2 Å²	49.2	25%	0.246	27%	0.266	C	S	.	.			trans	-105	151	178	-53.2	-66.5	0	0	0	110.1	S9 R58 K73 L77	S9-N75 PolarHBondContact OG-OD1 3.03Å; R58-N75 PolarHBondContact O-N 2.89Å; R58-N75 PolarHBondContact O-ND2 3.12Å; K73-N75 VanDerWaalsContact CE-OD1 3.25Å; K73-N75 WeakPolarHBondContact CE-OD1 2.96Å; N75-L77 PolarHBondContact O-N 2.91Å
76	S	91	Very high	93.8	Very high	69 Å²	69	47.8 Å²	47.8	48%	0.483	26%	0.256	S	S	.	.	S	Bend	trans	51.3	59.1	178	-56.5	0	0	0	0	111.8	Q8 R58	Q8-S76 PolarHBondContact O-N 3.04Å; R58-S76 PolarHBondContact NH1-O 3.34Å; R58-S76 VanDerWaalsContact NH1-O 3.14Å
77	L	91	Very high	94	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	23%	0.226	C	C	.	.			trans	-57.6	140	179.9	-77.5	169.7	0	0	0	111.7	V4 P6 S7 Q8 L10 M74 N75 D81 V106	V4-L77 HydrophobicContact CB-CD1 3.94Å; V4-L77 HydrophobicContact CG1-CD1 4.27Å; V4-L77 HydrophobicContact CG2-CD1 3.77Å; P6-L77 WeakPolarHBondContact CA-O 3.42Å; S7-L77 PolarHBondContact N-O 2.81Å; Q8-L77 WeakPolarHBondContact O-CB 3.21Å; Q8-L77 WeakPolarHBondContact O-CG 3.24Å; Q8-L77 PolarHBondContact O-N 2.78Å; L10-L77 HydrophobicContact CB-CD1 3.72Å; M74-L77 HydrophobicContact CB-CD2 3.9Å; M74-L77 HydrophobicContact CE-CD2 4.48Å; M74-L77 HydrophobicContact SD-CD2 4.28Å; N75-L77 PolarHBondContact O-N 2.91Å; L77-D81 HydrophobicContact CD2-CB 3.82Å; L77-V106 HydrophobicContact CB-CG1 4.31Å; L77-V106 HydrophobicContact CB-CG2 4.13Å; L77-V106 HydrophobicContact CD1-CG2 4.27Å; L77-V106 HydrophobicContact CD2-CG2 4.24Å; L77-V106 HydrophobicContact CG-CG2 4.46Å
78	Q	91.8	Very high	94	Very high	95 Å²	95	37.8 Å²	37.8	44%	0.444	20%	0.202	S	C	.	.			trans	-117.5	159.6	176.7	-60.8	177.6	-0.6	0	0	109.1	D80 D81 V106	Q78-D80 PolarHBondContact O-N 2.85Å; Q78-D80 VanDerWaalsContact O-N 3.14Å; Q78-D81 PolarHBondContact N-OD2 2.8Å; Q78-D81 WeakPolarHBondContact O-CB 3.38Å; Q78-D81 PolarHBondContact O-N 3.41Å; Q78-V106 WeakPolarHBondContact O-CB 3.33Å; Q78-V106 WeakPolarHBondContact O-CG1 3.21Å
79	T	90.3	Very high	93.9	Very high	75 Å²	75	36 Å²	36	46%	0.46	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-54.3	-33.9	175.4	46.8	0	0	0	0	112.2	D81 T82	T79-D81 PolarHBondContact O-N 2.86Å; T79-T82 VanDerWaalsContact O-CB 3.25Å; T79-T82 WeakPolarHBondContact O-CB 3.5Å; T79-T82 PolarHBondContact O-N 2.89Å; T79-T82 PolarHBondContact O-OG1 2.94Å
80	D	90.1	Very high	93.1	Very high	114 Å²	114	35.6 Å²	35.6	61%	0.61	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-69.9	-11.6	178.6	-69.1	9.3	0	0	0	113.7	Q78	Q78-D80 PolarHBondContact O-N 2.85Å; Q78-D80 VanDerWaalsContact O-N 3.14Å
81	D	92.3	Very high	91.8	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-83	1.4	170.8	-58.6	-45	0	0	0	112.2	R30 R58 L77 Q78 T79 A83 Y85 V106	R30-D81 IonicContact NH1-OD1 3.73Å; R30-D81 PolarHBondContact NH1-OD1 3.35Å; R58-D81 IonicContact CZ-OD1 3.08Å; R58-D81 IonicContact CZ-OD2 3.58Å; R58-D81 IonicContact NH1-OD1 3.68Å; R58-D81 IonicContact NH1-OD2 2.83Å; R58-D81 PolarHBondContact NH1-OD2 2.03Å; R58-D81 IonicContact NH2-OD1 2.83Å; R58-D81 PolarHBondContact NH2-OD1 3.45Å; R58-D81 IonicContact NH2-OD2 3.51Å; R58-D81 PolarHBondContact NH2-OD2 2.86Å; L77-D81 HydrophobicContact CD2-CB 3.82Å; Q78-D81 PolarHBondContact N-OD2 2.8Å; Q78-D81 WeakPolarHBondContact O-CB 3.38Å; Q78-D81 PolarHBondContact O-N 3.41Å; T79-D81 PolarHBondContact O-N 2.86Å; D81-A83 PolarHBondContact O-N 2.63Å; D81-A83 VanDerWaalsContact O-N 3.13Å; D81-Y85 WeakPolarHBondContact O-CE2 3.27Å; D81-Y85 PolarHBondContact O-OH 3.32Å; D81-V106 HydrophobicContact CB-CG2 4.42Å
82	T	94.9	Very high	90	Very high	36 Å²	36	43.5 Å²	43.5	22%	0.221	22%	0.223	C	C	.	.			trans	-65.7	111.6	170.1	-63.5	0	0	0	0	109.9	P33 T79 V104 T105 V106	P33-T82 WeakPolarHBondContact CD-O 3.48Å; P33-T82 HydrophobicContact CG-CG2 4.49Å; T79-T82 VanDerWaalsContact O-CB 3.25Å; T79-T82 WeakPolarHBondContact O-CB 3.5Å; T79-T82 PolarHBondContact O-N 2.89Å; T79-T82 PolarHBondContact O-OG1 2.94Å; T82-V104 WeakPolarHBondContact CA-O 3.39Å; T82-T105 HydrophobicContact CG2-CG2 4.43Å; T82-V106 PolarHBondContact OG1-N 2.78Å; T82-V106 PolarHBondContact OG1-O 3.07Å
83	A	96.3	Very high	88.2	Confident	4 Å²	4	54 Å²	54	3%	0.033	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	166.2	-175.5	0	0	0	0	0	111.6	R30 Q31 P32 D81 Y85 V104	R30-A83 HydrophobicContact CB-CB 3.97Å; R30-A83 HydrophobicContact CG-CB 4.39Å; Q31-A83 WeakPolarHBondContact O-CA 3.42Å; Q31-A83 WeakPolarHBondContact O-CB 3.3Å; P32-A83 HydrophobicContact CB-CB 4.49Å; P32-A83 HydrophobicContact CG-CB 4.4Å; D81-A83 PolarHBondContact O-N 2.63Å; D81-A83 VanDerWaalsContact O-N 3.13Å; A83-Y85 HydrophobicContact CB-CD2 4.21Å; A83-Y85 HydrophobicContact CB-CE2 3.74Å; A83-Y85 WeakPolarHBondContact O-CD2 3.16Å; A83-V104 PolarHBondContact N-O 2.91Å; A83-V104 VanDerWaalsContact N-O 3.09Å; A83-V104 PolarHBondContact O-N 3.05Å
84	M	97.4	Very high	86.8	Confident	54 Å²	54	51.6 Å²	51.6	27%	0.266	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	128.6	158.2	-76.1	-64.4	-62	0	0	109.4	R30 Q31 Y86 S103	R30-M84 CarbonylContact C-O 3.6Å; R30-M84 WeakPolarHBondContact CA-O 3.46Å; Q31-M84 PolarHBondContact N-O 3.35Å; Q31-M84 PolarHBondContact O-N 3.14Å; M84-Y86 HydrophobicContact CB-CD2 4.48Å; M84-Y86 HydrophobicContact CB-CE2 3.51Å; M84-Y86 VanDerWaalsContact CB-OH 3.3Å; M84-Y86 WeakPolarHBondContact CB-OH 3.4Å; M84-Y86 HydrophobicContact CE-CE1 4.28Å; M84-S103 WeakPolarHBondContact SD-CA 3.38Å; M84-S103 WeakPolarHBondContact SD-CB 3.21Å; M84-S103 PolarHBondContact SD-N 3.11Å
85	Y	96.9	Very high	85.9	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.4	179.1	-73.7	-102.1	0	0	0	110.5	I12 V29 R30 L40 L72 M74 D81 A83 G101 T102 V104	I12-Y85 VanDerWaalsContact CD1-CB 3.43Å; I12-Y85 HydrophobicContact CD1-CD1 3.75Å; I12-Y85 HydrophobicContact CD1-CG 3.68Å; V29-Y85 CarbonylContact O-C 3.49Å; R30-Y85 HydrophobicContact CB-CD1 3.88Å; R30-Y85 HydrophobicContact CB-CE1 3.84Å; R30-Y85 HydrophobicContact CB-CE2 4.46Å; R30-Y85 HydrophobicContact CB-CG 4.23Å; L40-Y85 HydrophobicContact CD1-CD1 3.89Å; L40-Y85 HydrophobicContact CD1-CE1 3.68Å; L72-Y85 HydrophobicContact CD2-CD1 4.11Å; L72-Y85 HydrophobicContact CD2-CE1 4.35Å; M74-Y85 HydrophobicContact CE-CD1 4.48Å; M74-Y85 HydrophobicContact CE-CE1 4.06Å; M74-Y85 HydrophobicContact SD-CD1 4.18Å; M74-Y85 HydrophobicContact SD-CE1 3.32Å; M74-Y85 WeakPolarHBondContact SD-CE1 3.31Å; M74-Y85 HydrophobicContact SD-CE2 4.42Å; M74-Y85 PolarHBondContact SD-OH 3.45Å; M74-Y85 VanDerWaalsContact SD-OH 3.37Å; D81-Y85 WeakPolarHBondContact O-CE2 3.27Å; D81-Y85 PolarHBondContact O-OH 3.32Å; A83-Y85 HydrophobicContact CB-CD2 4.21Å; A83-Y85 HydrophobicContact CB-CE2 3.74Å; A83-Y85 WeakPolarHBondContact O-CD2 3.16Å; Y85-G101 CarbonylContact O-C 3.51Å; Y85-G101 WeakPolarHBondContact O-CA 3.37Å; Y85-T102 PolarHBondContact N-O 2.85Å; Y85-T102 PolarHBondContact O-N 2.57Å; Y85-V104 HydrophobicContact CD2-CB 3.86Å; Y85-V104 HydrophobicContact CD2-CG2 3.63Å; Y85-V104 HydrophobicContact CE2-CB 3.73Å; Y85-V104 HydrophobicContact CE2-CG1 4.38Å; Y85-V104 HydrophobicContact CE2-CG2 3.92Å; Y85-V104 HydrophobicContact CG-CG2 4.46Å
86	Y	96.1	Very high	85.2	Confident	41 Å²	41	56.6 Å²	56.6	16%	0.161	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.4	-178.2	-54.7	-87.2	0	0	0	109.4	W28 V29 Q31 L37 M84 W98 G101	W28-Y86 WeakPolarHBondContact CA-O 3.25Å; V29-Y86 PolarHBondContact N-O 2.97Å; V29-Y86 PolarHBondContact O-N 3.41Å; Q31-Y86 HydrophobicContact CB-CE2 3.96Å; L37-Y86 HydrophobicContact CD2-CD2 4.36Å; L37-Y86 HydrophobicContact CD2-CE2 4.41Å; M84-Y86 HydrophobicContact CB-CD2 4.48Å; M84-Y86 HydrophobicContact CB-CE2 3.51Å; M84-Y86 VanDerWaalsContact CB-OH 3.3Å; M84-Y86 WeakPolarHBondContact CB-OH 3.4Å; M84-Y86 HydrophobicContact CE-CE1 4.28Å; Y86-W98 HydrophobicContact CG-CE3 4.17Å; Y86-W98 HydrophobicContact CG-CZ3 4.32Å; Y86-G101 VanDerWaalsContact CD1-CA 3.43Å
87	C	94.4	Very high	84.9	Confident	16 Å²	16	60.7 Å²	60.7	11%	0.108	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	143	157.5	56.3	0	0	0	0	109.1	C14 V26 H27 W28 G99	C14-C87 HydrophobicContact CB-CB 3.41Å; C14-C87 VanDerWaalsContact CB-CB 3.41Å; C14-C87 WeakPolarHBondContact CB-SG 3.39Å; C14-C87 WeakPolarHBondContact SG-CB 3.47Å; C14-C87 CovalentContact SG-SG 2.03Å; C14-C87 PolarHBondContact SG-SG 3.05Å; V26-C87 HydrophobicContact CG1-CB 4.19Å; H27-C87 CarbonylContact O-C 3.56Å; H27-C87 WeakPolarHBondContact O-CA 3.01Å; W28-C87 HydrophobicContact CD2-CB 4.39Å; W28-C87 HydrophobicContact CE3-CB 4.37Å; W28-C87 HydrophobicContact CH2-CB 4.31Å; W28-C87 HydrophobicContact CZ2-CB 4.33Å; W28-C87 HydrophobicContact CZ3-CB 4.31Å; C87-G99 PolarHBondContact O-N 3.33Å
88	A	93.2	Very high	84.9	Confident	2 Å²	2	65.8 Å²	65.8	2%	0.017	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	153.4	173.7	0	0	0	0	0	109.9	V26 H27 M95 Y97 W98	V26-A88 CarbonylContact C-O 3.53Å; V26-A88 WeakPolarHBondContact CA-O 3.3Å; H27-A88 PolarHBondContact N-O 3.29Å; H27-A88 PolarHBondContact O-N 2.88Å; A88-M95 HydrophobicContact CB-CB 4.3Å; A88-M95 HydrophobicContact CB-CG 4.43Å; A88-M95 HydrophobicContact CB-SD 4.13Å; A88-Y97 CarbonylContact C-O 3.43Å; A88-Y97 WeakPolarHBondContact CA-O 3.49Å; A88-Y97 WeakPolarHBondContact CB-O 3.45Å; A88-W98 HydrophobicContact CB-CD2 3.83Å; A88-W98 HydrophobicContact CB-CE3 4.12Å; A88-W98 HydrophobicContact CB-CG 4.21Å; A88-W98 HydrophobicContact CB-CH2 4.47Å; A88-W98 HydrophobicContact CB-CZ2 4.2Å; A88-W98 HydrophobicContact CB-CZ3 4.43Å
89	S	89.2	Confident	84.9	Confident	5 Å²	5	62.6 Å²	62.6	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143	174.1	-169.9	0	0	0	0	110.4	F19 Y24 G25 D96 Y97	F19-S89 VanDerWaalsContact CZ-CB 3.47Å; F19-S89 WeakPolarHBondContact CZ-OG 3.3Å; Y24-S89 WeakPolarHBondContact CB-OG 3.38Å; G25-S89 WeakPolarHBondContact O-CA 3.4Å; G25-S89 PolarHBondContact O-OG 3.04Å; S89-D96 PolarHBondContact O-N 2.9Å; S89-Y97 PolarHBondContact N-O 3.33Å; S89-Y97 PolarHBondContact O-N 3.34Å
90	D	79.2	Confident	85	Confident	36 Å²	36	67.9 Å²	67.9	19%	0.193	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	130.2	174.3	-78	-12.8	0	0	0	110.3	Y24 G25 H27 W44	Y24-D90 WeakPolarHBondContact CD1-O 3.49Å; G25-D90 PolarHBondContact O-N 2.93Å; H27-D90 IonicContact CD2-OD1 3.05Å; H27-D90 IonicContact CE1-OD1 3.56Å; H27-D90 IonicContact CE1-OD2 3.64Å; H27-D90 IonicContact NE2-OD1 3.78Å; H27-D90 PolarHBondContact NE2-OD1 2.77Å; H27-D90 VanDerWaalsContact NE2-OD1 3.08Å; H27-D90 IonicContact NE2-OD2 2.74Å; H27-D90 PolarHBondContact NE2-OD2 3.17Å; W44-D90 VanDerWaalsContact CZ3-OD2 3.24Å; W44-D90 WeakPolarHBondContact CZ3-OD2 3.36Å
91	G	66.6	Low	85.2	Confident	15 Å²	15	63.7 Å²	63.7	16%	0.155	31%	0.31	C	S	.	.			trans	-88.9	-176.9	153.3	0	0	0	0	0	110.3	Y93 A94 D96	G91-Y93 PolarHBondContact O-N 3.33Å; G91-A94 PolarHBondContact N-O 3.27Å; G91-D96 WeakPolarHBondContact CA-OD2 3.47Å
92	Y	58.8	Low	85.3	Confident	195 Å²	195	65 Å²	65	77%	0.765	32%	0.318	S	S	*	.	S	Bend	trans	-55.9	-18	-176	-89.7	-93.5	0	0	0	114.8
93	Y	60.2	Low	85.3	Confident	221 Å²	221	66.3 Å²	66.3	87%	0.867	33%	0.328	S	S	*	.	S	Bend	trans	-142	-8.3	-174.9	-58.4	-75.5	0	0	0	116	G91	G91-Y93 PolarHBondContact O-N 3.33Å
94	A	66.4	Low	85.2	Confident	50 Å²	50	66.1 Å²	66.1	41%	0.413	33%	0.327	S	S	.	.	S	Bend	trans	-165.1	172.8	-179	0	0	0	0	0	112.8	G91 D96	G91-A94 PolarHBondContact N-O 3.27Å; A94-D96 VanDerWaalsContact C-N 3.27Å; A94-D96 WeakPolarHBondContact CB-OD1 3.21Å; A94-D96 PolarHBondContact O-N 2.94Å
95	M	75.8	Confident	85	Confident	60 Å²	60	66.4 Å²	66.4	30%	0.296	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	80.7	168.2	-70.1	-176.5	-171.6	0	0	110.2	H27 V29 A88 W98	H27-M95 HydrophobicContact CB-CE 3.72Å; H27-M95 HydrophobicContact CB-SD 4.22Å; H27-M95 WeakPolarHBondContact ND1-CE 3.43Å; V29-M95 HydrophobicContact CG2-SD 4.39Å; A88-M95 HydrophobicContact CB-CB 4.3Å; A88-M95 HydrophobicContact CB-CG 4.43Å; A88-M95 HydrophobicContact CB-SD 4.13Å; M95-W98 HydrophobicContact CB-CZ2 4.18Å; M95-W98 PolarHBondContact O-NE1 2.78Å; M95-W98 HydrophobicContact SD-CH2 4.5Å; M95-W98 HydrophobicContact SD-CZ2 4.08Å
96	D	76.9	Confident	84.7	Confident	93 Å²	93	66.6 Å²	66.6	50%	0.497	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-23.7	-169.7	-66.8	-36.6	0	0	0	112.9	S89 G91 A94	S89-D96 PolarHBondContact O-N 2.9Å; G91-D96 WeakPolarHBondContact CA-OD2 3.47Å; A94-D96 VanDerWaalsContact C-N 3.27Å; A94-D96 WeakPolarHBondContact CB-OD1 3.21Å; A94-D96 PolarHBondContact O-N 2.94Å
97	Y	85.8	Confident	84.2	Confident	154 Å²	154	66.7 Å²	66.7	60%	0.604	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.4	-175.8	-59.1	-76.6	0	0	0	111.4	A88 S89	A88-Y97 CarbonylContact C-O 3.43Å; A88-Y97 WeakPolarHBondContact CA-O 3.49Å; A88-Y97 WeakPolarHBondContact CB-O 3.45Å; S89-Y97 PolarHBondContact N-O 3.33Å; S89-Y97 PolarHBondContact O-N 3.34Å
98	W	91.3	Very high	83.1	Confident	110 Å²	110	73.7 Å²	73.7	42%	0.417	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.8	-179.4	-69.6	70.8	0	0	0	111.3	V29 L37 Y86 A88 M95	V29-W98 HydrophobicContact CB-CH2 4.04Å; V29-W98 HydrophobicContact CB-CZ3 3.86Å; V29-W98 HydrophobicContact CG1-CH2 3.98Å; V29-W98 HydrophobicContact CG1-CZ3 4.01Å; V29-W98 HydrophobicContact CG2-CH2 3.82Å; V29-W98 HydrophobicContact CG2-CZ3 4.04Å; L37-W98 HydrophobicContact CD1-CH2 3.98Å; L37-W98 HydrophobicContact CD1-CZ3 4.39Å; L37-W98 HydrophobicContact CD2-CZ3 4.3Å; Y86-W98 HydrophobicContact CG-CE3 4.17Å; Y86-W98 HydrophobicContact CG-CZ3 4.32Å; A88-W98 HydrophobicContact CB-CD2 3.83Å; A88-W98 HydrophobicContact CB-CE3 4.12Å; A88-W98 HydrophobicContact CB-CG 4.21Å; A88-W98 HydrophobicContact CB-CH2 4.47Å; A88-W98 HydrophobicContact CB-CZ2 4.2Å; A88-W98 HydrophobicContact CB-CZ3 4.43Å; M95-W98 HydrophobicContact CB-CZ2 4.18Å; M95-W98 PolarHBondContact O-NE1 2.78Å; M95-W98 HydrophobicContact SD-CH2 4.5Å; M95-W98 HydrophobicContact SD-CZ2 4.08Å
99	G	91.4	Very high	82.6	Confident	28 Å²	28	77.3 Å²	77.3	29%	0.289	41%	0.407	S	S	.	.			trans	-70.3	161.8	168.5	0	0	0	0	0	111.9	C87 G101	C87-G99 PolarHBondContact O-N 3.33Å; G99-G101 PolarHBondContact O-N 3.12Å
100	Q	92.1	Very high	82.2	Confident	186 Å²	186	81.1 Å²	81.1	87%	0.869	43%	0.427	S	S	*	.			trans	-61.6	-16.4	178.5	-66.5	-64.5	-36.3	0	0	113.9
101	G	93.3	Very high	82.4	Confident	26 Å²	26	83.6 Å²	83.6	27%	0.268	44%	0.44	S	S	.	.			trans	86.5	162.4	-178.6	0	0	0	0	0	113.4	Y85 Y86 G99	Y85-G101 CarbonylContact O-C 3.51Å; Y85-G101 WeakPolarHBondContact O-CA 3.37Å; Y86-G101 VanDerWaalsContact CD1-CA 3.43Å; G99-G101 PolarHBondContact O-N 3.12Å
102	T	95.3	Very high	83.3	Confident	32 Å²	32	87.6 Å²	87.6	20%	0.196	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	119.5	-179.3	-83.3	0	0	0	0	108.6	P1 I12 Y85 V104	P1-T102 HydrophobicContact CB-CG2 3.4Å; P1-T102 VanDerWaalsContact CB-CG2 3.4Å; P1-T102 HydrophobicContact CG-CG2 3.32Å; I12-T102 HydrophobicContact CB-CG2 4.5Å; I12-T102 HydrophobicContact CG2-CG2 3.99Å; Y85-T102 PolarHBondContact N-O 2.85Å; Y85-T102 PolarHBondContact O-N 2.57Å; T102-V104 HydrophobicContact CG2-CG2 4.07Å
103	S	95	Very high	84.9	Confident	62 Å²	62	80.9 Å²	80.9	43%	0.434	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	126.5	175.1	-171.6	0	0	0	0	110.4	P1 M84	P1-S103 WeakPolarHBondContact CB-O 3.32Å; M84-S103 WeakPolarHBondContact SD-CA 3.38Å; M84-S103 WeakPolarHBondContact SD-CB 3.21Å; M84-S103 PolarHBondContact SD-N 3.11Å
104	V	94.1	Very high	86.5	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.006	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125	172.7	177.6	0	0	0	0	107.8	V4 L10 I12 M74 T82 A83 Y85 T102 V106	V4-V104 HydrophobicContact CG2-CG1 4.13Å; L10-V104 HydrophobicContact CD2-CB 4.37Å; L10-V104 HydrophobicContact CD2-CG1 3.65Å; L10-V104 HydrophobicContact CD2-CG2 3.75Å; I12-V104 HydrophobicContact CG2-CG2 4.22Å; M74-V104 HydrophobicContact CE-CG2 4.46Å; T82-V104 WeakPolarHBondContact CA-O 3.39Å; A83-V104 PolarHBondContact N-O 2.91Å; A83-V104 VanDerWaalsContact N-O 3.09Å; A83-V104 PolarHBondContact O-N 3.05Å; Y85-V104 HydrophobicContact CD2-CB 3.86Å; Y85-V104 HydrophobicContact CD2-CG2 3.63Å; Y85-V104 HydrophobicContact CE2-CB 3.73Å; Y85-V104 HydrophobicContact CE2-CG1 4.38Å; Y85-V104 HydrophobicContact CE2-CG2 3.92Å; Y85-V104 HydrophobicContact CG-CG2 4.46Å; T102-V104 HydrophobicContact CG2-CG2 4.07Å; V104-V106 HydrophobicContact CG1-CG2 4.32Å
105	T	93.4	Very high	87.9	Confident	59 Å²	59	73.1 Å²	73.1	36%	0.362	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.2	177.4	-55.6	0	0	0	0	109.3	L3 V4 T82	L3-T105 HydrophobicContact CD1-CG2 4.36Å; V4-T105 PolarHBondContact N-O 3.31Å; V4-T105 VanDerWaalsContact N-O 3.07Å; T82-T105 HydrophobicContact CG2-CG2 4.43Å
106	V	89.8	Confident	88.9	Confident	6 Å²	6	74.2 Å²	74.2	4%	0.036	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	112.5	175.6	-173.3	0	0	0	0	108.3	V4 P6 L77 Q78 D81 T82 V104	V4-V106 HydrophobicContact CG2-CG2 4.14Å; V4-V106 WeakPolarHBondContact O-CA 3.4Å; P6-V106 HydrophobicContact CG-CG1 4.3Å; L77-V106 HydrophobicContact CB-CG1 4.31Å; L77-V106 HydrophobicContact CB-CG2 4.13Å; L77-V106 HydrophobicContact CD1-CG2 4.27Å; L77-V106 HydrophobicContact CD2-CG2 4.24Å; L77-V106 HydrophobicContact CG-CG2 4.46Å; Q78-V106 WeakPolarHBondContact O-CB 3.33Å; Q78-V106 WeakPolarHBondContact O-CG1 3.21Å; D81-V106 HydrophobicContact CB-CG2 4.42Å; T82-V106 PolarHBondContact OG1-N 2.78Å; T82-V106 PolarHBondContact OG1-O 3.07Å; V104-V106 HydrophobicContact CG1-CG2 4.32Å
107	S	85.1	Confident	89.9	Confident	44 Å²	44	72.6 Å²	72.6	31%	0.308	41%	0.411	S	S	.	.			trans	-129.4	140.4	-179.2	62	0	0	0	0	110.8	L3 V4 P6	L3-S107 WeakPolarHBondContact CD1-OG 3.45Å; V4-S107 PolarHBondContact O-N 2.74Å; P6-S107 WeakPolarHBondContact CD-O 3.33Å
108	S	71.9	Confident	90.2	Very high	163 Å²	163	65.2 Å²	65.2	100%	1.14	39%	0.393	S	S	*	.			trans	-69.2	0	172.9	58.2	0	0	0	0	112.9

Retrieved 108 of 108 residues in 39.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).