X5J4T0_MOUSE Loading...

IgG1 heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4T0, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 100 aa.

						>X5J4T0_MOUSE|X5J4T0
GGLVKPGGSLKLSCAASGFTFSDYYMYWVRQTPEKRLEWVATISDGGSYTYYPDSVKGRFTISRDNAKNNLYLQMSSLKSEDTAMYYCARANWYAMDYWG
					

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(Predicted Aligned Error values between residue pairs)

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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	G	59.3	Low	84.1	Confident	113 Å²	113	89.9 Å²	89.9	100%	1.165	59%	0.585	S	S	*	*				0	153.6	0	0	0	0	0	0	109.4
2	G	72.8	Confident	85.1	Confident	51 Å²	51	84.1 Å²	84.1	53%	0.526	55%	0.545	S	S	.	.			trans	-103.8	160.1	178.3	0	0	0	0	0	112.3
3	L	77.7	Confident	85.9	Confident	185 Å²	185	84.2 Å²	84.2	97%	0.969	55%	0.55	S	S	*	.			trans	-69.6	126.7	172	-174.3	71.2	0	0	0	109.6
4	V	83.2	Confident	86.6	Confident	52 Å²	52	78.8 Å²	78.8	32%	0.315	51%	0.514	S	S	.	.			trans	-126.2	140.5	179.8	-175.3	0	0	0	0	109.5	L10 L78	V4-L10 HydrophobicContact CG2-CB 4.11Å; V4-L10 HydrophobicContact CG2-CD1 4.02Å; V4-L10 HydrophobicContact CG2-CD2 4.27Å; V4-L10 HydrophobicContact CG2-CG 4.36Å; V4-L78 HydrophobicContact CB-CD1 3.98Å; V4-L78 HydrophobicContact CG1-CD1 3.89Å; V4-L78 HydrophobicContact CG2-CD1 4.5Å
5	K	83.5	Confident	87.2	Confident	178 Å²	178	78.3 Å²	78.3	77%	0.774	52%	0.519	S	S	*	.			trans	-67.7	149.1	175.8	-65.1	-176.5	-179.2	-179.5	0	110.5	G8	K5-G8 WeakPolarHBondContact O-CA 3.41Å; K5-G8 PolarHBondContact O-N 2.84Å
6	P	84.6	Confident	87.6	Confident	108 Å²	108	74.1 Å²	74.1	70%	0.701	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	141.3	171.1	-25.7	34.2	0	0	0	112	G8	P6-G8 PolarHBondContact O-N 3.28Å
7	G	87.3	Confident	87.8	Confident	55 Å²	55	75.8 Å²	75.8	57%	0.567	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-10.5	-173.2	0	0	0	0	0	114.6	L78	G7-L78 PolarHBondContact N-O 3.07Å
8	G	91.7	Very high	88	Confident	21 Å²	21	76.5 Å²	76.5	22%	0.216	53%	0.529	C	S	.	.			trans	-71.3	177.7	176	0	0	0	0	0	113.6	K5 P6 S77 L78	K5-G8 WeakPolarHBondContact O-CA 3.41Å; K5-G8 PolarHBondContact O-N 2.84Å; P6-G8 PolarHBondContact O-N 3.28Å; G8-S77 PolarHBondContact O-N 3.22Å; G8-L78 PolarHBondContact O-N 2.7Å; G8-L78 VanDerWaalsContact O-N 3.08Å
9	S	94.1	Very high	88	Confident	71 Å²	71	74.3 Å²	74.3	50%	0.497	51%	0.509	S	S	.	.			trans	-123.9	146.7	175.3	-61.8	0	0	0	0	110.6	M75	S9-M75 CarbonylContact C-O 3.55Å; S9-M75 WeakPolarHBondContact CA-O 3.42Å; S9-M75 WeakPolarHBondContact CB-O 2.95Å
10	L	94.6	Very high	88.2	Confident	39 Å²	39	74.5 Å²	74.5	20%	0.204	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.4	177.4	-176.8	60.1	0	0	0	109.1	V4 L12 M75 L78	V4-L10 HydrophobicContact CG2-CB 4.11Å; V4-L10 HydrophobicContact CG2-CD1 4.02Å; V4-L10 HydrophobicContact CG2-CD2 4.27Å; V4-L10 HydrophobicContact CG2-CG 4.36Å; L10-L12 HydrophobicContact CD2-CD2 3.67Å; L10-L12 HydrophobicContact CD2-CG 4.42Å; L10-L12 HydrophobicContact CG-CD2 4.01Å; L10-M75 PolarHBondContact N-O 2.82Å; L10-M75 PolarHBondContact O-N 2.77Å; L10-L78 HydrophobicContact CB-CD1 3.93Å
11	K	95.9	Very high	88.4	Confident	116 Å²	116	71 Å²	71	50%	0.504	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.8	168	-171.3	174.9	178.9	178.2	0	109.3	L73	K11-L73 WeakPolarHBondContact CA-O 2.94Å
12	L	96.1	Very high	89.9	Confident	20 Å²	20	68 Å²	68	11%	0.105	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	150.8	169.4	-56.1	-178	0	0	0	109.8	L10 W28 Y72 L73 M75 Y86	L10-L12 HydrophobicContact CD2-CD2 3.67Å; L10-L12 HydrophobicContact CD2-CG 4.42Å; L10-L12 HydrophobicContact CG-CD2 4.01Å; L12-W28 HydrophobicContact CB-CH2 3.64Å; L12-W28 HydrophobicContact CB-CZ2 3.96Å; L12-W28 HydrophobicContact CB-CZ3 4.21Å; L12-W28 HydrophobicContact CD1-CE3 4.45Å; L12-W28 HydrophobicContact CD1-CH2 4.3Å; L12-W28 HydrophobicContact CD1-CZ3 4.01Å; L12-Y72 VanDerWaalsContact O-CA 3.27Å; L12-Y72 WeakPolarHBondContact O-CA 3.18Å; L12-L73 HydrophobicContact CB-CB 4.23Å; L12-L73 HydrophobicContact CD1-CD2 4.41Å; L12-L73 PolarHBondContact N-O 3.42Å; L12-L73 PolarHBondContact O-N 3.11Å; L12-M75 HydrophobicContact CD1-SD 3.71Å; L12-M75 HydrophobicContact CG-SD 3.9Å; L12-Y86 HydrophobicContact CD1-CD1 3.93Å; L12-Y86 HydrophobicContact CD1-CD2 4.22Å; L12-Y86 HydrophobicContact CD1-CG 3.67Å
13	S	96.5	Very high	90.8	Very high	86 Å²	86	70.3 Å²	70.3	60%	0.601	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.2	142.9	177.6	58.8	0	0	0	0	109.9	L71	S13-L71 CarbonylContact C-O 3.57Å; S13-L71 WeakPolarHBondContact CA-O 3.26Å
14	C	95.6	Very high	91.5	Very high	8 Å²	8	63.9 Å²	63.9	5%	0.054	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	114.3	-179.6	-155.3	0	0	0	0	110.1	W28 N70 L71 C88	C14-W28 HydrophobicContact CB-CH2 4Å; C14-W28 HydrophobicContact CB-CZ2 3.98Å; C14-N70 WeakPolarHBondContact O-CA 3.39Å; C14-L71 HydrophobicContact CB-CB 4.16Å; C14-L71 PolarHBondContact N-O 2.87Å; C14-L71 PolarHBondContact O-N 3.01Å; C14-C88 HydrophobicContact CB-CB 3.99Å; C14-C88 WeakPolarHBondContact CB-SG 3.27Å; C14-C88 WeakPolarHBondContact SG-CB 3.31Å; C14-C88 CovalentContact SG-SG 2.01Å; C14-C88 PolarHBondContact SG-SG 3.14Å
15	A	95.3	Very high	92	Very high	71 Å²	71	65 Å²	65	59%	0.587	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	126.1	177.3	0	0	0	0	0	109.6	N70	A15-N70 WeakPolarHBondContact CA-OD1 3.49Å; A15-N70 WeakPolarHBondContact CB-OD1 3.33Å
16	A	92.8	Very high	92.6	Very high	12 Å²	12	56.5 Å²	56.5	10%	0.099	37%	0.37	C	S	.	.			trans	-91.8	139.6	175.4	0	0	0	0	0	111.1	F19 F21 N69	A16-F19 HydrophobicContact CB-CD1 4.46Å; A16-F19 HydrophobicContact CB-CE1 3.57Å; A16-F19 HydrophobicContact CB-CE2 4.39Å; A16-F19 HydrophobicContact CB-CZ 3.52Å; A16-F21 HydrophobicContact CB-CB 4.49Å; A16-F21 HydrophobicContact CB-CD2 3.36Å; A16-F21 HydrophobicContact CB-CE2 3.97Å; A16-F21 HydrophobicContact CB-CG 4.3Å; A16-N69 HydrophobicContact CB-CB 4.33Å; A16-N69 WeakPolarHBondContact CB-O 3.37Å; A16-N69 PolarHBondContact N-O 3.43Å
17	S	91.8	Very high	93.1	Very high	102 Å²	102	52.6 Å²	52.6	71%	0.713	34%	0.342	S	S	*	.			trans	-144	152	173.4	64.5	0	0	0	0	110.1	F19	S17-F19 VanDerWaalsContact O-CD1 3.3Å; S17-F19 WeakPolarHBondContact O-CD1 3.38Å
18	G	90.4	Very high	93.6	Very high	89 Å²	89	50.3 Å²	50.3	92%	0.918	32%	0.316	S	S	*	.	S	Bend	trans	82.6	11.2	178	0	0	0	0	0	115.8
19	F	88.9	Confident	93.8	Very high	34 Å²	34	50.2 Å²	50.2	15%	0.149	31%	0.311	C	S	.	.	S	Bend	trans	-160	163.1	174.1	66.2	-79.7	0	0	0	112.6	A16 S17 F21 Y24 M26 R90 W99	A16-F19 HydrophobicContact CB-CD1 4.46Å; A16-F19 HydrophobicContact CB-CE1 3.57Å; A16-F19 HydrophobicContact CB-CE2 4.39Å; A16-F19 HydrophobicContact CB-CZ 3.52Å; S17-F19 VanDerWaalsContact O-CD1 3.3Å; S17-F19 WeakPolarHBondContact O-CD1 3.38Å; F19-F21 HydrophobicContact CE2-CD2 4.4Å; F19-F21 HydrophobicContact CZ-CD2 4.41Å; F19-F21 PolarHBondContact O-N 2.98Å; F19-F21 VanDerWaalsContact O-N 3.13Å; F19-Y24 HydrophobicContact CB-CE2 4.41Å; F19-Y24 AromaticContact CD2-CD2 3.68Å; F19-Y24 HydrophobicContact CD2-CD2 3.68Å; F19-Y24 AromaticContact CD2-CE2 3.75Å; F19-Y24 HydrophobicContact CD2-CE2 3.75Å; F19-Y24 HydrophobicContact CE2-CD2 4.05Å; F19-M26 HydrophobicContact CE2-CE 3.72Å; F19-M26 HydrophobicContact CZ-CE 4.27Å; F19-R90 VanDerWaalsContact CD2-NH1 3.29Å; F19-R90 VanDerWaalsContact CE1-NH1 3.32Å; F19-W99 HydrophobicContact CE1-CB 4.49Å; F19-W99 AromaticContact CE1-CD2 3.91Å; F19-W99 HydrophobicContact CE1-CD2 3.91Å; F19-W99 HydrophobicContact CE1-CE3 4.46Å; F19-W99 AromaticContact CE1-CG 3.87Å; F19-W99 HydrophobicContact CE1-CG 3.87Å; F19-W99 AromaticContact CZ-CD2 3.71Å; F19-W99 HydrophobicContact CZ-CD2 3.71Å; F19-W99 AromaticContact CZ-CE2 3.64Å; F19-W99 HydrophobicContact CZ-CE3 4.11Å; F19-W99 HydrophobicContact CZ-CG 4.15Å; F19-W99 HydrophobicContact CZ-CH2 4.35Å; F19-W99 AromaticContact CZ-CZ2 3.98Å; F19-W99 HydrophobicContact CZ-CZ2 3.98Å; F19-W99 HydrophobicContact CZ-CZ3 4.4Å; F19-W99 AromaticContact CZ-NE1 3.96Å
20	T	91.6	Very high	93.8	Very high	78 Å²	78	47.5 Å²	47.5	48%	0.479	29%	0.29	S	S	.	.			trans	-74.6	98.1	173.8	-48.3	0	0	0	0	110.2	S22 D23 Y24	T20-S22 WeakPolarHBondContact CG2-OG 3.42Å; T20-S22 PolarHBondContact O-N 2.8Å; T20-D23 WeakPolarHBondContact CB-OD2 3.46Å; T20-D23 HydrophobicContact CG2-CB 4.46Å; T20-D23 VanDerWaalsContact CG2-CG 3.45Å; T20-D23 WeakPolarHBondContact CG2-OD1 3.48Å; T20-D23 VanDerWaalsContact CG2-OD2 3.27Å; T20-D23 WeakPolarHBondContact CG2-OD2 3.48Å; T20-D23 PolarHBondContact O-N 2.98Å; T20-D23 VanDerWaalsContact O-N 3.11Å; T20-Y24 VanDerWaalsContact O-CD2 3.27Å; T20-Y24 WeakPolarHBondContact O-CD2 3.1Å
21	F	92.1	Very high	93.8	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-56.2	-33.9	-175.9	-176.3	-99.7	0	0	0	113.3	A16 F19 D23 M26 R64 N66 N69 N70 L71	A16-F21 HydrophobicContact CB-CB 4.49Å; A16-F21 HydrophobicContact CB-CD2 3.36Å; A16-F21 HydrophobicContact CB-CE2 3.97Å; A16-F21 HydrophobicContact CB-CG 4.3Å; F19-F21 HydrophobicContact CE2-CD2 4.4Å; F19-F21 HydrophobicContact CZ-CD2 4.41Å; F19-F21 PolarHBondContact O-N 2.98Å; F19-F21 VanDerWaalsContact O-N 3.13Å; F21-D23 PolarHBondContact O-N 2.75Å; F21-M26 HydrophobicContact CB-CE 4.26Å; F21-M26 HydrophobicContact CD1-CE 4.18Å; F21-M26 HydrophobicContact CD2-CE 3.1Å; F21-M26 HydrophobicContact CD2-SD 4.21Å; F21-M26 HydrophobicContact CE1-CE 4.34Å; F21-M26 HydrophobicContact CE2-CE 3.31Å; F21-M26 HydrophobicContact CE2-CG 4.19Å; F21-M26 HydrophobicContact CE2-SD 3.91Å; F21-M26 HydrophobicContact CG-CE 3.59Å; F21-M26 HydrophobicContact CZ-CE 3.94Å; F21-M26 HydrophobicContact CZ-CG 4.22Å; F21-M26 WeakPolarHBondContact O-CE 3.22Å; F21-R64 HydrophobicContact CE1-CB 4.05Å; F21-R64 VanDerWaalsContact CE1-NH2 3.31Å; F21-R64 HydrophobicContact CZ-CB 4.2Å; F21-R64 PolarHBondContact O-NH2 2.8Å; F21-N66 WeakPolarHBondContact CD1-OD1 3.38Å; F21-N66 WeakPolarHBondContact CE1-OD1 3.48Å; F21-N69 HydrophobicContact CB-CB 4.01Å; F21-N69 VanDerWaalsContact CB-OD1 3.26Å; F21-N69 WeakPolarHBondContact CB-OD1 3.24Å; F21-N69 HydrophobicContact CG-CB 4.18Å; F21-N70 WeakPolarHBondContact CZ-O 3.49Å; F21-L71 HydrophobicContact CE2-CB 4.32Å; F21-L71 HydrophobicContact CZ-CB 4.14Å
22	S	91.9	Very high	93.7	Very high	51 Å²	51	43.9 Å²	43.9	36%	0.357	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-69	-11.4	179.8	53.9	0	0	0	0	115	T20 D45	T20-S22 WeakPolarHBondContact CG2-OG 3.42Å; T20-S22 PolarHBondContact O-N 2.8Å; S22-D45 WeakPolarHBondContact O-CB 3.06Å
23	D	91.5	Very high	93.4	Very high	99 Å²	99	47.6 Å²	47.6	53%	0.529	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-95.5	-3.9	-171.7	-61.2	-5.2	0	0	0	113.1	T20 F21	T20-D23 WeakPolarHBondContact CB-OD2 3.46Å; T20-D23 HydrophobicContact CG2-CB 4.46Å; T20-D23 VanDerWaalsContact CG2-CG 3.45Å; T20-D23 WeakPolarHBondContact CG2-OD1 3.48Å; T20-D23 VanDerWaalsContact CG2-OD2 3.27Å; T20-D23 WeakPolarHBondContact CG2-OD2 3.48Å; T20-D23 PolarHBondContact O-N 2.98Å; T20-D23 VanDerWaalsContact O-N 3.11Å; F21-D23 PolarHBondContact O-N 2.75Å
24	Y	92.1	Very high	93.1	Very high	51 Å²	51	50.6 Å²	50.6	20%	0.2	31%	0.305	C	S	.	.	S	Bend	trans	-122.1	147.1	-171.4	-60.7	-100.3	0	0	0	112.5	F19 T20 D45 R64 R90 N92	F19-Y24 HydrophobicContact CB-CE2 4.41Å; F19-Y24 AromaticContact CD2-CD2 3.68Å; F19-Y24 HydrophobicContact CD2-CD2 3.68Å; F19-Y24 AromaticContact CD2-CE2 3.75Å; F19-Y24 HydrophobicContact CD2-CE2 3.75Å; F19-Y24 HydrophobicContact CE2-CD2 4.05Å; T20-Y24 VanDerWaalsContact O-CD2 3.27Å; T20-Y24 WeakPolarHBondContact O-CD2 3.1Å; Y24-D45 WeakPolarHBondContact O-CA 3.16Å; Y24-R64 PolarHBondContact O-NH1 2.8Å; Y24-R64 VanDerWaalsContact O-NH1 3.12Å; Y24-R90 HydrophobicContact CD1-CB 4.1Å; Y24-R90 HydrophobicContact CD1-CG 4.01Å; Y24-R90 HydrophobicContact CG-CB 4.24Å; Y24-R90 HydrophobicContact CG-CG 4.47Å; Y24-N92 HydrophobicContact CD1-CB 3.8Å; Y24-N92 HydrophobicContact CE1-CB 3.77Å
25	Y	94.4	Very high	92.7	Very high	75 Å²	75	58.2 Å²	58.2	29%	0.294	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	141.7	157.4	-79.8	-113.3	0	0	0	108.3	Y27 T42 D45 Y49 R90 A91	Y25-Y27 WeakPolarHBondContact CB-OH 3.38Å; Y25-Y27 HydrophobicContact CD1-CE1 4.46Å; Y25-T42 HydrophobicContact CD1-CG2 4.22Å; Y25-D45 WeakPolarHBondContact CE2-OD1 3.3Å; Y25-Y49 HydrophobicContact CE1-CD1 4.45Å; Y25-R90 WeakPolarHBondContact O-CA 3.28Å; Y25-R90 WeakPolarHBondContact O-CB 3.49Å; Y25-A91 PolarHBondContact N-O 2.75Å; Y25-A91 PolarHBondContact O-N 2.73Å; Y25-A91 VanDerWaalsContact O-N 3.13Å
26	M	95.3	Very high	92.5	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.8	-177	-57.8	-66.7	-175.4	0	0	110.4	F19 F21 T42 I43 L71 A89 R90 W99	F19-M26 HydrophobicContact CE2-CE 3.72Å; F19-M26 HydrophobicContact CZ-CE 4.27Å; F21-M26 HydrophobicContact CB-CE 4.26Å; F21-M26 HydrophobicContact CD1-CE 4.18Å; F21-M26 HydrophobicContact CD2-CE 3.1Å; F21-M26 HydrophobicContact CD2-SD 4.21Å; F21-M26 HydrophobicContact CE1-CE 4.34Å; F21-M26 HydrophobicContact CE2-CE 3.31Å; F21-M26 HydrophobicContact CE2-CG 4.19Å; F21-M26 HydrophobicContact CE2-SD 3.91Å; F21-M26 HydrophobicContact CG-CE 3.59Å; F21-M26 HydrophobicContact CZ-CE 3.94Å; F21-M26 HydrophobicContact CZ-CG 4.22Å; F21-M26 WeakPolarHBondContact O-CE 3.22Å; M26-T42 WeakPolarHBondContact O-CA 3.27Å; M26-I43 HydrophobicContact CB-CG2 3.73Å; M26-I43 PolarHBondContact N-O 3.31Å; M26-I43 PolarHBondContact O-N 3.03Å; M26-L71 HydrophobicContact CB-CD1 3.67Å; M26-L71 HydrophobicContact CB-CD2 3.93Å; M26-L71 HydrophobicContact CB-CG 4.4Å; M26-L71 HydrophobicContact CG-CD1 4.32Å; M26-A89 CarbonylContact C-O 3.54Å; M26-R90 HydrophobicContact SD-CB 4.17Å; M26-W99 HydrophobicContact CE-CZ2 4.46Å; M26-W99 HydrophobicContact SD-CH2 3.27Å; M26-W99 WeakPolarHBondContact SD-CH2 3.38Å; M26-W99 HydrophobicContact SD-CZ2 3.42Å; M26-W99 WeakPolarHBondContact SD-CZ2 3.13Å; M26-W99 HydrophobicContact SD-CZ3 4.42Å
27	Y	95.9	Very high	92.4	Very high	25 Å²	25	67.6 Å²	67.6	10%	0.098	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	143.4	-165.4	-49.6	-58.6	0	0	0	111	Y25 W39 A41 T42 C88 A89 A91 M96	Y25-Y27 WeakPolarHBondContact CB-OH 3.38Å; Y25-Y27 HydrophobicContact CD1-CE1 4.46Å; Y27-W39 VanDerWaalsContact CB-CH2 3.44Å; Y27-W39 HydrophobicContact CD1-CE3 4.38Å; Y27-W39 AromaticContact CD1-CH2 3.12Å; Y27-W39 HydrophobicContact CD1-CH2 3.12Å; Y27-W39 HydrophobicContact CD1-CZ2 4.47Å; Y27-W39 AromaticContact CD1-CZ3 3.05Å; Y27-W39 HydrophobicContact CD1-CZ3 3.05Å; Y27-W39 AromaticContact CD2-CH2 3.36Å; Y27-W39 HydrophobicContact CD2-CH2 3.36Å; Y27-W39 HydrophobicContact CD2-CZ2 4.23Å; Y27-W39 HydrophobicContact CD2-CZ3 4.07Å; Y27-W39 AromaticContact CE1-CH2 3.42Å; Y27-W39 HydrophobicContact CE1-CH2 3.42Å; Y27-W39 VanDerWaalsContact CE1-CH2 3.42Å; Y27-W39 AromaticContact CE1-CZ3 3.68Å; Y27-W39 HydrophobicContact CE1-CZ3 3.68Å; Y27-W39 AromaticContact CE2-CH2 3.7Å; Y27-W39 HydrophobicContact CE2-CH2 3.7Å; Y27-W39 AromaticContact CG-CH2 3.02Å; Y27-W39 HydrophobicContact CG-CH2 3.02Å; Y27-W39 HydrophobicContact CG-CZ2 4.18Å; Y27-W39 AromaticContact CG-CZ3 3.23Å; Y27-W39 HydrophobicContact CG-CZ3 3.23Å; Y27-W39 AromaticContact CZ-CH2 3.72Å; Y27-A41 VanDerWaalsContact CA-O 3.31Å; Y27-A41 WeakPolarHBondContact CA-O 3.28Å; Y27-T42 HydrophobicContact CD1-CG2 3.67Å; Y27-T42 WeakPolarHBondContact CD1-OG1 2.78Å; Y27-T42 HydrophobicContact CE1-CG2 3.43Å; Y27-T42 VanDerWaalsContact CE1-CG2 3.43Å; Y27-C88 WeakPolarHBondContact O-CA 3.17Å; Y27-A89 WeakPolarHBondContact CA-O 3.2Å; Y27-A89 VanDerWaalsContact CB-O 3.24Å; Y27-A89 WeakPolarHBondContact CB-O 3.38Å; Y27-A89 VanDerWaalsContact CD2-C 3.49Å; Y27-A89 HydrophobicContact CD2-CB 4.33Å; Y27-A89 VanDerWaalsContact CD2-O 3.25Å; Y27-A89 WeakPolarHBondContact CD2-O 3.39Å; Y27-A89 PolarHBondContact N-O 3.3Å; Y27-A89 PolarHBondContact O-N 3.31Å; Y27-A91 HydrophobicContact CE2-CB 3.52Å; Y27-A91 WeakPolarHBondContact OH-CB 3.49Å; Y27-M96 HydrophobicContact CD2-CE 4.25Å; Y27-M96 HydrophobicContact CE2-CE 3.56Å
28	W	97.1	Very high	92.5	Very high	7 Å²	7	64.8 Å²	64.8	3%	0.027	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.6	161.7	-78	96.4	0	0	0	108.9	L12 C14 V40 A41 L71 L73 Y86 C88	L12-W28 HydrophobicContact CB-CH2 3.64Å; L12-W28 HydrophobicContact CB-CZ2 3.96Å; L12-W28 HydrophobicContact CB-CZ3 4.21Å; L12-W28 HydrophobicContact CD1-CE3 4.45Å; L12-W28 HydrophobicContact CD1-CH2 4.3Å; L12-W28 HydrophobicContact CD1-CZ3 4.01Å; C14-W28 HydrophobicContact CB-CH2 4Å; C14-W28 HydrophobicContact CB-CZ2 3.98Å; W28-V40 HydrophobicContact CB-CB 4.05Å; W28-V40 HydrophobicContact CB-CG1 4.46Å; W28-V40 WeakPolarHBondContact O-CA 3.46Å; W28-V40 WeakPolarHBondContact O-CB 3.4Å; W28-V40 PolarHBondContact O-N 3.16Å; W28-A41 PolarHBondContact N-O 2.99Å; W28-A41 PolarHBondContact O-N 2.93Å; W28-L71 HydrophobicContact CG-CD2 4.5Å; W28-L73 HydrophobicContact CB-CD2 4.19Å; W28-L73 HydrophobicContact CD2-CB 4.01Å; W28-L73 HydrophobicContact CD2-CD2 4.17Å; W28-L73 HydrophobicContact CG-CB 4.09Å; W28-L73 HydrophobicContact CG-CD1 4.29Å; W28-L73 HydrophobicContact CG-CD2 3.97Å; W28-L73 HydrophobicContact CG-CG 4.35Å; W28-L73 HydrophobicContact CZ2-CB 4.17Å; W28-Y86 HydrophobicContact CE3-CD1 4.46Å; W28-C88 VanDerWaalsContact CH2-SG 3.59Å
29	V	95.7	Very high	92.7	Very high	19 Å²	19	65.7 Å²	65.7	12%	0.115	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	144.9	174	-175.1	0	0	0	0	107	L37 E38 W39 Y86 Y87 A89	V29-L37 HydrophobicContact CG1-CB 4.34Å; V29-L37 HydrophobicContact CG1-CD2 3.97Å; V29-E38 CarbonylContact C-O 3.55Å; V29-E38 WeakPolarHBondContact CA-O 3.3Å; V29-E38 WeakPolarHBondContact CG1-O 3.07Å; V29-W39 HydrophobicContact CG2-CD2 4.45Å; V29-Y86 CarbonylContact O-C 3.48Å; V29-Y86 WeakPolarHBondContact O-CA 3.4Å; V29-Y87 PolarHBondContact N-O 3.17Å; V29-Y87 PolarHBondContact O-N 3.05Å; V29-A89 HydrophobicContact CG2-CB 4.15Å
30	R	95.2	Very high	93.1	Very high	14 Å²	14	64 Å²	64	5%	0.053	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.3	171.7	72.5	-178.3	-178.3	-174.9	2.8	111.3	L37 E38 V40 D82 A84 M85 Y86	R30-L37 CarbonylContact O-C 3.59Å; R30-L37 WeakPolarHBondContact O-CA 3.48Å; R30-E38 HydrophobicContact CG-CB 3.97Å; R30-E38 IonicContact CZ-OE2 2.8Å; R30-E38 PolarHBondContact N-O 2.78Å; R30-E38 IonicContact NE-OE2 3.33Å; R30-E38 PolarHBondContact NE-OE2 2.94Å; R30-E38 IonicContact NH2-OE2 3.09Å; R30-E38 PolarHBondContact NH2-OE2 3Å; R30-E38 PolarHBondContact O-N 2.97Å; R30-V40 HydrophobicContact CB-CG2 3.78Å; R30-V40 HydrophobicContact CG-CG2 3.6Å; R30-D82 IonicContact NH1-OD1 3.65Å; R30-D82 PolarHBondContact NH1-OD1 2.98Å; R30-D82 VanDerWaalsContact NH1-OD1 3.09Å; R30-A84 HydrophobicContact CB-CB 3.8Å; R30-A84 HydrophobicContact CG-CB 4.07Å; R30-M85 CarbonylContact C-O 3.58Å; R30-M85 WeakPolarHBondContact CA-O 3.48Å; R30-M85 WeakPolarHBondContact CB-O 3.43Å; R30-Y86 HydrophobicContact CB-CD1 3.94Å; R30-Y86 HydrophobicContact CB-CD2 4.38Å; R30-Y86 HydrophobicContact CB-CE1 3.87Å; R30-Y86 HydrophobicContact CB-CE2 4.3Å; R30-Y86 HydrophobicContact CB-CG 4.2Å
31	Q	94.5	Very high	93.4	Very high	63 Å²	63	60.4 Å²	60.4	29%	0.294	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	115.5	169.9	-169.5	174.3	42.6	0	0	109	R36 L37 A84 M85 Y87	Q31-R36 WeakPolarHBondContact CA-O 3.42Å; Q31-L37 HydrophobicContact CB-CD2 3.88Å; Q31-L37 HydrophobicContact CG-CD2 4.19Å; Q31-A84 WeakPolarHBondContact O-CA 3.25Å; Q31-A84 VanDerWaalsContact O-CB 3.31Å; Q31-A84 WeakPolarHBondContact O-CB 3.45Å; Q31-M85 PolarHBondContact N-O 2.8Å; Q31-M85 PolarHBondContact O-N 3.09Å; Q31-Y87 HydrophobicContact CB-CD2 4.47Å; Q31-Y87 HydrophobicContact CB-CE2 3.76Å
32	T	92.5	Very high	93.6	Very high	17 Å²	17	61 Å²	61	10%	0.104	29%	0.289	C	S	.	.			trans	-70.1	163.4	176.6	76.3	0	0	0	0	110.7	E34 K35 R36 E38	T32-E34 WeakPolarHBondContact CB-OE2 3.36Å; T32-E34 PolarHBondContact O-N 3.29Å; T32-E34 VanDerWaalsContact O-N 3.11Å; T32-E34 PolarHBondContact OG1-N 3.09Å; T32-E34 PolarHBondContact OG1-OE2 3.26Å; T32-K35 WeakPolarHBondContact O-CA 3.33Å; T32-K35 PolarHBondContact O-N 3.07Å; T32-R36 PolarHBondContact N-O 3.02Å; T32-E38 HydrophobicContact CG2-CG 4.38Å
33	P	89.3	Confident	93.8	Very high	98 Å²	98	58.9 Å²	58.9	64%	0.636	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-28.8	174.3	-27.3	36.8	0	0	0	113.9	K35	P33-K35 PolarHBondContact O-N 3.01Å
34	E	91.3	Very high	94	Very high	149 Å²	149	54.2 Å²	54.2	70%	0.696	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	8.4	175	-52.8	71.8	-152.5	0	0	113.2	T32 R36	T32-E34 WeakPolarHBondContact CB-OE2 3.36Å; T32-E34 PolarHBondContact O-N 3.29Å; T32-E34 VanDerWaalsContact O-N 3.11Å; T32-E34 PolarHBondContact OG1-N 3.09Å; T32-E34 PolarHBondContact OG1-OE2 3.26Å; E34-R36 PolarHBondContact O-N 2.96Å
35	K	87.2	Confident	93.9	Very high	167 Å²	167	55 Å²	55	73%	0.726	26%	0.256	S	S	*	.			trans	65.7	15.3	-179.6	-53.7	-178.5	179.2	179.8	0	115	T32 P33	T32-K35 WeakPolarHBondContact O-CA 3.33Å; T32-K35 PolarHBondContact O-N 3.07Å; P33-K35 PolarHBondContact O-N 3.01Å
36	R	90.2	Very high	93.5	Very high	166 Å²	166	54 Å²	54	63%	0.626	27%	0.269	S	S	*	.			trans	-76.2	127.4	173.6	-173.7	-178.1	-179.4	-175.2	2.8	110	Q31 T32 E34 E38	Q31-R36 WeakPolarHBondContact CA-O 3.42Å; T32-R36 PolarHBondContact N-O 3.02Å; E34-R36 PolarHBondContact O-N 2.96Å; R36-E38 HydrophobicContact CG-CG 4.08Å; R36-E38 IonicContact CZ-OE1 3.43Å; R36-E38 IonicContact NE-OE1 3.65Å; R36-E38 IonicContact NH1-OE1 2.98Å; R36-E38 PolarHBondContact NH1-OE1 2.99Å
37	L	91.9	Very high	93.3	Very high	115 Å²	115	55.4 Å²	55.4	60%	0.602	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.7	169.6	-71.8	169.9	0	0	0	109.9	V29 R30 Q31	V29-L37 HydrophobicContact CG1-CB 4.34Å; V29-L37 HydrophobicContact CG1-CD2 3.97Å; R30-L37 CarbonylContact O-C 3.59Å; R30-L37 WeakPolarHBondContact O-CA 3.48Å; Q31-L37 HydrophobicContact CB-CD2 3.88Å; Q31-L37 HydrophobicContact CG-CD2 4.19Å
38	E	94	Very high	93.2	Very high	43 Å²	43	59.8 Å²	59.8	20%	0.201	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.2	-179.6	-62.2	-171.3	157.9	0	0	110.3	V29 R30 T32 R36	V29-E38 CarbonylContact C-O 3.55Å; V29-E38 WeakPolarHBondContact CA-O 3.3Å; V29-E38 WeakPolarHBondContact CG1-O 3.07Å; R30-E38 HydrophobicContact CG-CB 3.97Å; R30-E38 IonicContact CZ-OE2 2.8Å; R30-E38 PolarHBondContact N-O 2.78Å; R30-E38 IonicContact NE-OE2 3.33Å; R30-E38 PolarHBondContact NE-OE2 2.94Å; R30-E38 IonicContact NH2-OE2 3.09Å; R30-E38 PolarHBondContact NH2-OE2 3Å; R30-E38 PolarHBondContact O-N 2.97Å; T32-E38 HydrophobicContact CG2-CG 4.38Å; R36-E38 HydrophobicContact CG-CG 4.08Å; R36-E38 IonicContact CZ-OE1 3.43Å; R36-E38 IonicContact NE-OE1 3.65Å; R36-E38 IonicContact NH1-OE1 2.98Å; R36-E38 PolarHBondContact NH1-OE1 2.99Å
39	W	94.3	Very high	93.1	Very high	107 Å²	107	65.1 Å²	65.1	41%	0.405	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	138.8	169.5	-87.1	87.1	0	0	0	111.2	Y27 V29 T42 P53 M96	Y27-W39 VanDerWaalsContact CB-CH2 3.44Å; Y27-W39 HydrophobicContact CD1-CE3 4.38Å; Y27-W39 AromaticContact CD1-CH2 3.12Å; Y27-W39 HydrophobicContact CD1-CH2 3.12Å; Y27-W39 HydrophobicContact CD1-CZ2 4.47Å; Y27-W39 AromaticContact CD1-CZ3 3.05Å; Y27-W39 HydrophobicContact CD1-CZ3 3.05Å; Y27-W39 AromaticContact CD2-CH2 3.36Å; Y27-W39 HydrophobicContact CD2-CH2 3.36Å; Y27-W39 HydrophobicContact CD2-CZ2 4.23Å; Y27-W39 HydrophobicContact CD2-CZ3 4.07Å; Y27-W39 AromaticContact CE1-CH2 3.42Å; Y27-W39 HydrophobicContact CE1-CH2 3.42Å; Y27-W39 VanDerWaalsContact CE1-CH2 3.42Å; Y27-W39 AromaticContact CE1-CZ3 3.68Å; Y27-W39 HydrophobicContact CE1-CZ3 3.68Å; Y27-W39 AromaticContact CE2-CH2 3.7Å; Y27-W39 HydrophobicContact CE2-CH2 3.7Å; Y27-W39 AromaticContact CG-CH2 3.02Å; Y27-W39 HydrophobicContact CG-CH2 3.02Å; Y27-W39 HydrophobicContact CG-CZ2 4.18Å; Y27-W39 AromaticContact CG-CZ3 3.23Å; Y27-W39 HydrophobicContact CG-CZ3 3.23Å; Y27-W39 AromaticContact CZ-CH2 3.72Å; V29-W39 HydrophobicContact CG2-CD2 4.45Å; W39-T42 VanDerWaalsContact CZ3-OG1 3.25Å; W39-T42 WeakPolarHBondContact CZ3-OG1 3.46Å; W39-P53 WeakPolarHBondContact O-CG 3.44Å; W39-M96 HydrophobicContact CH2-CE 3.74Å; W39-M96 HydrophobicContact CZ2-CE 3.41Å; W39-M96 VanDerWaalsContact CZ2-CE 3.41Å; W39-M96 HydrophobicContact CZ2-SD 4.47Å
40	V	96.9	Very high	93.2	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	-47	-178	-179.7	0	0	0	0	111.7	W28 R30 P53 V56 F60 L73 Y86	W28-V40 HydrophobicContact CB-CB 4.05Å; W28-V40 HydrophobicContact CB-CG1 4.46Å; W28-V40 WeakPolarHBondContact O-CA 3.46Å; W28-V40 WeakPolarHBondContact O-CB 3.4Å; W28-V40 PolarHBondContact O-N 3.16Å; R30-V40 HydrophobicContact CB-CG2 3.78Å; R30-V40 HydrophobicContact CG-CG2 3.6Å; V40-P53 WeakPolarHBondContact O-CD 3.48Å; V40-V56 HydrophobicContact CG1-CG2 4.35Å; V40-V56 VanDerWaalsContact O-CG2 3.3Å; V40-V56 WeakPolarHBondContact O-CG2 3.47Å; V40-F60 HydrophobicContact CG1-CD2 3.58Å; V40-F60 HydrophobicContact CG1-CE2 3.93Å; V40-L73 HydrophobicContact CG1-CD2 3.93Å; V40-Y86 HydrophobicContact CG1-CE1 4.2Å; V40-Y86 HydrophobicContact CG2-CD1 4.41Å; V40-Y86 HydrophobicContact CG2-CE1 3.97Å
41	A	97.6	Very high	93.3	Very high	1 Å²	1	72.1 Å²	72.1	1%	0.008	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	153.4	179.2	0	0	0	0	0	111.6	Y27 W28 Y51 Y52 I62 L73	Y27-A41 VanDerWaalsContact CA-O 3.31Å; Y27-A41 WeakPolarHBondContact CA-O 3.28Å; W28-A41 PolarHBondContact N-O 2.99Å; W28-A41 PolarHBondContact O-N 2.93Å; A41-Y51 CarbonylContact C-O 3.5Å; A41-Y51 WeakPolarHBondContact CA-O 3.34Å; A41-Y52 HydrophobicContact CB-CD1 3.71Å; A41-Y52 HydrophobicContact CB-CE1 3.73Å; A41-I62 HydrophobicContact CB-CB 3.77Å; A41-I62 HydrophobicContact CB-CD1 3.96Å; A41-I62 HydrophobicContact CB-CG1 4.41Å; A41-I62 HydrophobicContact CB-CG2 3.97Å; A41-L73 HydrophobicContact CB-CD1 4.07Å
42	T	96.6	Very high	93.4	Very high	14 Å²	14	71 Å²	71	9%	0.086	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.9	177.2	-63.7	0	0	0	0	110.3	Y25 M26 Y27 W39 Y49 T50 Y51	Y25-T42 HydrophobicContact CD1-CG2 4.22Å; M26-T42 WeakPolarHBondContact O-CA 3.27Å; Y27-T42 HydrophobicContact CD1-CG2 3.67Å; Y27-T42 WeakPolarHBondContact CD1-OG1 2.78Å; Y27-T42 HydrophobicContact CE1-CG2 3.43Å; Y27-T42 VanDerWaalsContact CE1-CG2 3.43Å; W39-T42 VanDerWaalsContact CZ3-OG1 3.25Å; W39-T42 WeakPolarHBondContact CZ3-OG1 3.46Å; T42-Y49 HydrophobicContact CG2-CE1 4.28Å; T42-T50 CarbonylContact O-C 3.59Å; T42-T50 WeakPolarHBondContact O-CA 3.25Å; T42-Y51 PolarHBondContact N-O 3.12Å; T42-Y51 PolarHBondContact O-N 3.27Å
43	I	97	Very high	93.6	Very high	7 Å²	7	71.3 Å²	71.3	4%	0.036	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.6	168.1	-170.2	161.1	0	0	0	110.2	M26 Y49 T50 I62 R64 L71	M26-I43 HydrophobicContact CB-CG2 3.73Å; M26-I43 PolarHBondContact N-O 3.31Å; M26-I43 PolarHBondContact O-N 3.03Å; I43-Y49 WeakPolarHBondContact CA-O 3.27Å; I43-T50 HydrophobicContact CB-CG2 4.14Å; I43-T50 HydrophobicContact CD1-CG2 3.97Å; I43-T50 HydrophobicContact CG1-CG2 3.84Å; I43-I62 HydrophobicContact CB-CD1 3.95Å; I43-I62 HydrophobicContact CB-CG1 4.2Å; I43-I62 HydrophobicContact CB-CG2 3.97Å; I43-I62 HydrophobicContact CG2-CD1 3.59Å; I43-I62 HydrophobicContact CG2-CG1 3.94Å; I43-R64 HydrophobicContact CD1-CB 4.26Å; I43-R64 HydrophobicContact CD1-CG 3.76Å; I43-R64 HydrophobicContact CG1-CG 4.4Å; I43-L71 HydrophobicContact CG2-CD1 3.71Å
44	S	94.9	Very high	93.9	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.007	37%	0.371	C	S	.	.			trans	-68.3	165.9	176	59.4	0	0	0	0	112.5	G46 G47 S48 Y49 R64	S44-G46 VanDerWaalsContact C-N 3.31Å; S44-G46 PolarHBondContact O-N 3.33Å; S44-G47 PolarHBondContact O-N 2.99Å; S44-G47 PolarHBondContact OG-N 2.87Å; S44-S48 PolarHBondContact OG-N 2.99Å; S44-S48 PolarHBondContact OG-OG 2.86Å; S44-Y49 PolarHBondContact N-O 3.39Å; S44-Y49 PolarHBondContact OG-N 2.68Å; S44-R64 WeakPolarHBondContact O-CD 3.34Å; S44-R64 PolarHBondContact O-NH1 2.91Å
45	D	90.8	Very high	94	Very high	66 Å²	66	69.2 Å²	69.2	35%	0.353	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-46.3	174.4	59.7	-71.7	0	0	0	113.1	S22 Y24 Y25 R64	S22-D45 WeakPolarHBondContact O-CB 3.06Å; Y24-D45 WeakPolarHBondContact O-CA 3.16Å; Y25-D45 WeakPolarHBondContact CE2-OD1 3.3Å; D45-R64 VanDerWaalsContact C-NH1 3.35Å; D45-R64 PolarHBondContact O-NE 3.21Å; D45-R64 PolarHBondContact O-NH1 2.91Å; D45-R64 PolarHBondContact O-NH2 2.79Å
46	G	85.8	Confident	94.4	Very high	55 Å²	55	61.2 Å²	61.2	57%	0.567	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-6.4	175.2	0	0	0	0	0	115.5	S44 S48	S44-G46 VanDerWaalsContact C-N 3.31Å; S44-G46 PolarHBondContact O-N 3.33Å; G46-S48 PolarHBondContact O-N 3.07Å
47	G	91.6	Very high	94.6	Very high	30 Å²	30	59.7 Å²	59.7	31%	0.309	32%	0.323	S	S	.	.	S	Bend	trans	75.3	5.2	-177.4	0	0	0	0	0	115.7	S44 Y49	S44-G47 PolarHBondContact O-N 2.99Å; S44-G47 PolarHBondContact OG-N 2.87Å; G47-Y49 VanDerWaalsContact C-N 3.33Å
48	S	92.3	Very high	94.8	Very high	116 Å²	116	58 Å²	58	81%	0.811	33%	0.333	S	S	*	.			trans	-72.2	-25.6	179.9	56	0	0	0	0	113.6	S44 G46	S44-S48 PolarHBondContact OG-N 2.99Å; S44-S48 PolarHBondContact OG-OG 2.86Å; G46-S48 PolarHBondContact O-N 3.07Å
49	Y	95.3	Very high	95	Very high	120 Å²	120	57.4 Å²	57.4	47%	0.471	33%	0.328	S	S	.	.			trans	-117.2	132.4	-179.6	174.8	-96.8	0	0	0	109.9	Y25 T42 I43 S44 G47	Y25-Y49 HydrophobicContact CE1-CD1 4.45Å; T42-Y49 HydrophobicContact CG2-CE1 4.28Å; I43-Y49 WeakPolarHBondContact CA-O 3.27Å; S44-Y49 PolarHBondContact N-O 3.39Å; S44-Y49 PolarHBondContact OG-N 2.68Å; G47-Y49 VanDerWaalsContact C-N 3.33Å
50	T	97.5	Very high	95.1	Very high	61 Å²	61	52.4 Å²	52.4	37%	0.374	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	146.1	169.3	57.4	0	0	0	0	110.9	T42 I43 I62	T42-T50 CarbonylContact O-C 3.59Å; T42-T50 WeakPolarHBondContact O-CA 3.25Å; I43-T50 HydrophobicContact CB-CG2 4.14Å; I43-T50 HydrophobicContact CD1-CG2 3.97Å; I43-T50 HydrophobicContact CG1-CG2 3.84Å; T50-I62 HydrophobicContact CG2-CG2 3.89Å
51	Y	97.3	Very high	95.2	Very high	119 Å²	119	56.1 Å²	56.1	47%	0.467	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143.3	174.9	173.6	-93.2	0	0	0	110.8	A41 T42	A41-Y51 CarbonylContact C-O 3.5Å; A41-Y51 WeakPolarHBondContact CA-O 3.34Å; T42-Y51 PolarHBondContact N-O 3.12Å; T42-Y51 PolarHBondContact O-N 3.27Å
52	Y	97.6	Very high	95.2	Very high	39 Å²	39	56.3 Å²	56.3	15%	0.153	33%	0.333	C	S	.	.			trans	-137.8	134.5	177.5	-53.3	-87.3	0	0	0	108.9	A41 F60 T61 I62	A41-Y52 HydrophobicContact CB-CD1 3.71Å; A41-Y52 HydrophobicContact CB-CE1 3.73Å; Y52-F60 VanDerWaalsContact CE1-O 3.29Å; Y52-F60 WeakPolarHBondContact CE1-O 3.47Å; Y52-T61 WeakPolarHBondContact OH-CA 3.31Å; Y52-I62 HydrophobicContact CE1-CB 4.27Å; Y52-I62 HydrophobicContact CE1-CG2 3.87Å; Y52-I62 WeakPolarHBondContact OH-CG2 3.14Å; Y52-I62 PolarHBondContact OH-N 2.87Å
53	P	96.2	Very high	95.2	Very high	24 Å²	24	58 Å²	58	16%	0.156	35%	0.346	C	S	.	.			trans	-70.2	156.4	169.4	29.5	-29.2	0	0	0	110.7	W39 V40 S55 V56 K57	W39-P53 WeakPolarHBondContact O-CG 3.44Å; V40-P53 WeakPolarHBondContact O-CD 3.48Å; P53-S55 PolarHBondContact O-N 3.34Å; P53-S55 VanDerWaalsContact O-N 3.07Å; P53-V56 HydrophobicContact CG-CG2 3.94Å; P53-V56 PolarHBondContact O-N 3.16Å; P53-V56 VanDerWaalsContact O-N 3.09Å; P53-K57 WeakPolarHBondContact O-CB 3.24Å; P53-K57 PolarHBondContact O-N 2.95Å
54	D	95.3	Very high	95.2	Very high	139 Å²	139	59.4 Å²	59.4	74%	0.743	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.8	-174.1	-65.3	-34	0	0	0	113.7	V56	D54-V56 PolarHBondContact O-N 2.86Å
55	S	93.3	Very high	95.3	Very high	63 Å²	63	61.3 Å²	61.3	44%	0.441	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.8	177.5	56.8	0	0	0	0	114	P53 R59	P53-S55 PolarHBondContact O-N 3.34Å; P53-S55 VanDerWaalsContact O-N 3.07Å; S55-R59 PolarHBondContact O-NH2 2.86Å
56	V	96.1	Very high	95.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-7.1	-175.6	-56.7	0	0	0	0	113.5	V40 P53 D54 G58 R59 F60	V40-V56 HydrophobicContact CG1-CG2 4.35Å; V40-V56 VanDerWaalsContact O-CG2 3.3Å; V40-V56 WeakPolarHBondContact O-CG2 3.47Å; P53-V56 HydrophobicContact CG-CG2 3.94Å; P53-V56 PolarHBondContact O-N 3.16Å; P53-V56 VanDerWaalsContact O-N 3.09Å; D54-V56 PolarHBondContact O-N 2.86Å; V56-G58 PolarHBondContact O-N 2.86Å; V56-R59 PolarHBondContact O-N 2.01Å; V56-F60 HydrophobicContact CB-CB 4.16Å; V56-F60 HydrophobicContact CB-CD1 4.37Å; V56-F60 HydrophobicContact CB-CD2 3.68Å; V56-F60 HydrophobicContact CB-CE2 4.06Å; V56-F60 HydrophobicContact CB-CG 3.83Å; V56-F60 HydrophobicContact CG1-CD2 3.75Å; V56-F60 HydrophobicContact CG1-CE2 3.62Å; V56-F60 HydrophobicContact CG1-CG 4.33Å; V56-F60 HydrophobicContact CG1-CZ 4.09Å; V56-F60 HydrophobicContact CG2-CB 4.4Å; V56-F60 HydrophobicContact CG2-CD2 4.19Å; V56-F60 HydrophobicContact CG2-CG 4.47Å; V56-F60 PolarHBondContact O-N 3.05Å; V56-F60 VanDerWaalsContact O-N 3.07Å
57	K	95.4	Very high	95.7	Very high	134 Å²	134	63.4 Å²	63.4	58%	0.583	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	132.1	179.5	-167.2	172.8	-175.3	177.6	0	110.9	P53 R59	P53-K57 WeakPolarHBondContact O-CB 3.24Å; P53-K57 PolarHBondContact O-N 2.95Å; K57-R59 PolarHBondContact O-N 3.13Å
58	G	95.8	Very high	95.9	Very high	79 Å²	79	68.3 Å²	68.3	81%	0.814	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	-6.7	-177	0	0	0	0	0	115.2	V56	V56-G58 PolarHBondContact O-N 2.86Å
59	R	96.9	Very high	96	Very high	30 Å²	30	66 Å²	66	11%	0.113	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-36.7	176.1	-61.4	-169.5	-57.9	115.6	0.9	112.4	S55 V56 K57 S76 S77 D82	S55-R59 PolarHBondContact O-NH2 2.86Å; V56-R59 PolarHBondContact O-N 2.01Å; K57-R59 PolarHBondContact O-N 3.13Å; R59-S76 WeakPolarHBondContact CB-O 3.44Å; R59-S76 WeakPolarHBondContact O-CB 3.43Å; R59-S76 PolarHBondContact O-N 3Å; R59-S76 PolarHBondContact O-OG 2.76Å; R59-S77 PolarHBondContact NH1-O 3.35Å; R59-D82 IonicContact CZ-OD1 3.91Å; R59-D82 IonicContact CZ-OD2 3.39Å; R59-D82 IonicContact NH1-OD1 3.88Å; R59-D82 IonicContact NH1-OD2 2.68Å; R59-D82 PolarHBondContact NH1-OD2 2.88Å; R59-D82 IonicContact NH2-OD1 2.99Å; R59-D82 PolarHBondContact NH2-OD1 3.13Å; R59-D82 IonicContact NH2-OD2 3.21Å; R59-D82 PolarHBondContact NH2-OD2 3.18Å
60	F	97.5	Very high	96.1	Very high	3 Å²	3	61.8 Å²	61.8	1%	0.013	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.5	-176.1	-67.1	12.1	0	0	0	110.7	V40 Y52 V56 L73 Q74 M75 L78 D82 Y86	V40-F60 HydrophobicContact CG1-CD2 3.58Å; V40-F60 HydrophobicContact CG1-CE2 3.93Å; Y52-F60 VanDerWaalsContact CE1-O 3.29Å; Y52-F60 WeakPolarHBondContact CE1-O 3.47Å; V56-F60 HydrophobicContact CB-CB 4.16Å; V56-F60 HydrophobicContact CB-CD1 4.37Å; V56-F60 HydrophobicContact CB-CD2 3.68Å; V56-F60 HydrophobicContact CB-CE2 4.06Å; V56-F60 HydrophobicContact CB-CG 3.83Å; V56-F60 HydrophobicContact CG1-CD2 3.75Å; V56-F60 HydrophobicContact CG1-CE2 3.62Å; V56-F60 HydrophobicContact CG1-CG 4.33Å; V56-F60 HydrophobicContact CG1-CZ 4.09Å; V56-F60 HydrophobicContact CG2-CB 4.4Å; V56-F60 HydrophobicContact CG2-CD2 4.19Å; V56-F60 HydrophobicContact CG2-CG 4.47Å; V56-F60 PolarHBondContact O-N 3.05Å; V56-F60 VanDerWaalsContact O-N 3.07Å; F60-L73 HydrophobicContact CB-CD1 4.28Å; F60-L73 HydrophobicContact CD2-CD2 4.17Å; F60-Q74 CarbonylContact C-O 3.58Å; F60-Q74 VanDerWaalsContact CA-O 3.26Å; F60-Q74 WeakPolarHBondContact CA-O 3.27Å; F60-M75 HydrophobicContact CD1-CB 3.83Å; F60-M75 HydrophobicContact CD1-CG 4.03Å; F60-M75 HydrophobicContact CD2-CG 3.96Å; F60-M75 HydrophobicContact CE1-CB 3.74Å; F60-M75 HydrophobicContact CE1-CE 4.38Å; F60-M75 HydrophobicContact CE1-CG 4.03Å; F60-M75 HydrophobicContact CE2-CE 3.89Å; F60-M75 HydrophobicContact CE2-CG 3.95Å; F60-M75 HydrophobicContact CE2-SD 4.45Å; F60-M75 HydrophobicContact CG-CB 4.32Å; F60-M75 HydrophobicContact CG-CG 4.03Å; F60-M75 HydrophobicContact CZ-CB 4.13Å; F60-M75 HydrophobicContact CZ-CE 3.66Å; F60-M75 HydrophobicContact CZ-CG 4Å; F60-L78 HydrophobicContact CE1-CD2 4.03Å; F60-L78 HydrophobicContact CZ-CD2 4.05Å; F60-D82 HydrophobicContact CZ-CB 4.1Å; F60-Y86 HydrophobicContact CE2-CE1 4.4Å
61	T	98	Very high	96.1	Very high	77 Å²	77	58.9 Å²	58.9	47%	0.472	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	117.9	178.9	-53	0	0	0	0	109.4	Y52 Q74	Y52-T61 WeakPolarHBondContact OH-CA 3.31Å; T61-Q74 PolarHBondContact N-O 2.96Å; T61-Q74 PolarHBondContact O-N 3Å
62	I	98.2	Very high	96.1	Very high	6 Å²	6	55 Å²	55	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	139.4	171.7	-169.4	170.8	0	0	0	109.4	A41 I43 T50 Y52 L71 Y72 L73	A41-I62 HydrophobicContact CB-CB 3.77Å; A41-I62 HydrophobicContact CB-CD1 3.96Å; A41-I62 HydrophobicContact CB-CG1 4.41Å; A41-I62 HydrophobicContact CB-CG2 3.97Å; I43-I62 HydrophobicContact CB-CD1 3.95Å; I43-I62 HydrophobicContact CB-CG1 4.2Å; I43-I62 HydrophobicContact CB-CG2 3.97Å; I43-I62 HydrophobicContact CG2-CD1 3.59Å; I43-I62 HydrophobicContact CG2-CG1 3.94Å; T50-I62 HydrophobicContact CG2-CG2 3.89Å; Y52-I62 HydrophobicContact CE1-CB 4.27Å; Y52-I62 HydrophobicContact CE1-CG2 3.87Å; Y52-I62 WeakPolarHBondContact OH-CG2 3.14Å; Y52-I62 PolarHBondContact OH-N 2.87Å; I62-L71 HydrophobicContact CD1-CD1 4.01Å; I62-L71 HydrophobicContact CD1-CD2 4.43Å; I62-L71 HydrophobicContact CD1-CG 4.5Å; I62-L71 HydrophobicContact CG1-CD1 3.97Å; I62-L71 HydrophobicContact CG1-CG 4.48Å; I62-Y72 WeakPolarHBondContact CA-O 3.49Å; I62-L73 HydrophobicContact CB-CD1 4.28Å
63	S	97.4	Very high	96.1	Very high	49 Å²	49	53.2 Å²	53.2	34%	0.343	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	158.8	171.9	60.7	0	0	0	0	110.7	Y72	S63-Y72 PolarHBondContact N-O 3.12Å; S63-Y72 PolarHBondContact O-N 2.86Å
64	R	96.7	Very high	96.2	Very high	36 Å²	36	55.6 Å²	55.6	14%	0.136	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.9	-177.2	66.9	-178.8	-69.3	154.6	3.3	110.7	F21 Y24 I43 S44 D45 N66 N70 L71	F21-R64 HydrophobicContact CE1-CB 4.05Å; F21-R64 VanDerWaalsContact CE1-NH2 3.31Å; F21-R64 HydrophobicContact CZ-CB 4.2Å; F21-R64 PolarHBondContact O-NH2 2.8Å; Y24-R64 PolarHBondContact O-NH1 2.8Å; Y24-R64 VanDerWaalsContact O-NH1 3.12Å; I43-R64 HydrophobicContact CD1-CB 4.26Å; I43-R64 HydrophobicContact CD1-CG 3.76Å; I43-R64 HydrophobicContact CG1-CG 4.4Å; S44-R64 WeakPolarHBondContact O-CD 3.34Å; S44-R64 PolarHBondContact O-NH1 2.91Å; D45-R64 VanDerWaalsContact C-NH1 3.35Å; D45-R64 PolarHBondContact O-NE 3.21Å; D45-R64 PolarHBondContact O-NH1 2.91Å; D45-R64 PolarHBondContact O-NH2 2.79Å; R64-N66 PolarHBondContact NE-OD1 3.31Å; R64-N66 PolarHBondContact NH2-OD1 3.08Å; R64-N70 CarbonylContact C-O 3.49Å; R64-N70 WeakPolarHBondContact CA-O 3.29Å; R64-L71 HydrophobicContact CB-CD1 4.09Å
65	D	95.6	Very high	96.3	Very high	42 Å²	42	49.2 Å²	49.2	23%	0.225	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	104	172.3	-176	-22.9	0	0	0	108.2	A67 K68 N69 N70 Y72	D65-A67 VanDerWaalsContact C-N 3.33Å; D65-A67 PolarHBondContact OD1-N 2.98Å; D65-K68 HydrophobicContact CB-CB 4.27Å; D65-K68 PolarHBondContact O-N 2.96Å; D65-K68 PolarHBondContact OD1-N 3.03Å; D65-K68 VanDerWaalsContact OD1-N 3.09Å; D65-K68 WeakPolarHBondContact OD2-CD 3.48Å; D65-K68 VanDerWaalsContact OD2-CE 3.28Å; D65-K68 WeakPolarHBondContact OD2-CE 3.17Å; D65-K68 WeakPolarHBondContact OD2-CG 3.5Å; D65-K68 IonicContact OD2-NZ 3.49Å; D65-K68 PolarHBondContact OD2-NZ 2.78Å; D65-N69 WeakPolarHBondContact O-CA 3.33Å; D65-N69 PolarHBondContact O-N 2.93Å; D65-N70 PolarHBondContact N-O 2.78Å; D65-N70 PolarHBondContact O-N 2.93Å; D65-Y72 HydrophobicContact CB-CE2 4.02Å
66	N	93.6	Very high	96.4	Very high	68 Å²	68	48 Å²	48	36%	0.364	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-28.2	-177.9	-73	-9.2	0	0	0	112.7	F21 R64 K68 N69	F21-N66 WeakPolarHBondContact CD1-OD1 3.38Å; F21-N66 WeakPolarHBondContact CE1-OD1 3.48Å; R64-N66 PolarHBondContact NE-OD1 3.31Å; R64-N66 PolarHBondContact NH2-OD1 3.08Å; N66-K68 VanDerWaalsContact C-N 3.28Å; N66-K68 PolarHBondContact O-N 2.88Å; N66-N69 PolarHBondContact O-OD1 2.8Å
67	A	93.1	Very high	96.3	Very high	96 Å²	96	51.4 Å²	51.4	79%	0.793	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-29.2	177.4	0	0	0	0	0	111.4	D65	D65-A67 VanDerWaalsContact C-N 3.33Å; D65-A67 PolarHBondContact OD1-N 2.98Å
68	K	95.1	Very high	96.3	Very high	134 Å²	134	45.9 Å²	45.9	58%	0.583	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-0.1	179.9	-59.7	-176.6	-165.9	159.2	0	114.4	D65 N66 N70	D65-K68 HydrophobicContact CB-CB 4.27Å; D65-K68 PolarHBondContact O-N 2.96Å; D65-K68 PolarHBondContact OD1-N 3.03Å; D65-K68 VanDerWaalsContact OD1-N 3.09Å; D65-K68 WeakPolarHBondContact OD2-CD 3.48Å; D65-K68 VanDerWaalsContact OD2-CE 3.28Å; D65-K68 WeakPolarHBondContact OD2-CE 3.17Å; D65-K68 WeakPolarHBondContact OD2-CG 3.5Å; D65-K68 IonicContact OD2-NZ 3.49Å; D65-K68 PolarHBondContact OD2-NZ 2.78Å; N66-K68 VanDerWaalsContact C-N 3.28Å; N66-K68 PolarHBondContact O-N 2.88Å; K68-N70 HydrophobicContact CB-CB 4.36Å; K68-N70 PolarHBondContact O-N 2.65Å
69	N	95.2	Very high	96.2	Very high	67 Å²	67	46.9 Å²	46.9	36%	0.358	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	40.9	-173.2	-60.8	-35.8	0	0	0	112.9	A16 F21 D65 N66	A16-N69 HydrophobicContact CB-CB 4.33Å; A16-N69 WeakPolarHBondContact CB-O 3.37Å; A16-N69 PolarHBondContact N-O 3.43Å; F21-N69 HydrophobicContact CB-CB 4.01Å; F21-N69 VanDerWaalsContact CB-OD1 3.26Å; F21-N69 WeakPolarHBondContact CB-OD1 3.24Å; F21-N69 HydrophobicContact CG-CB 4.18Å; D65-N69 WeakPolarHBondContact O-CA 3.33Å; D65-N69 PolarHBondContact O-N 2.93Å; N66-N69 PolarHBondContact O-OD1 2.8Å
70	N	96.4	Very high	95.8	Very high	31 Å²	31	49.7 Å²	49.7	17%	0.166	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.3	-175.7	-79.8	-33.5	0	0	0	112	C14 A15 F21 R64 D65 K68 Y72	C14-N70 WeakPolarHBondContact O-CA 3.39Å; A15-N70 WeakPolarHBondContact CA-OD1 3.49Å; A15-N70 WeakPolarHBondContact CB-OD1 3.33Å; F21-N70 WeakPolarHBondContact CZ-O 3.49Å; R64-N70 CarbonylContact C-O 3.49Å; R64-N70 WeakPolarHBondContact CA-O 3.29Å; D65-N70 PolarHBondContact N-O 2.78Å; D65-N70 PolarHBondContact O-N 2.93Å; K68-N70 HydrophobicContact CB-CB 4.36Å; K68-N70 PolarHBondContact O-N 2.65Å; N70-Y72 HydrophobicContact CB-CE1 4.22Å; N70-Y72 HydrophobicContact CB-CE2 3.73Å; N70-Y72 VanDerWaalsContact CB-CZ 3.5Å; N70-Y72 VanDerWaalsContact CB-OH 3.3Å; N70-Y72 WeakPolarHBondContact CB-OH 3.44Å; N70-Y72 PolarHBondContact ND2-OH 2.8Å; N70-Y72 VanDerWaalsContact ND2-OH 3.14Å
71	L	97.6	Very high	95.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139	168.3	-169.7	70.4	0	0	0	109.8	S13 C14 F21 M26 W28 I43 I62 R64	S13-L71 CarbonylContact C-O 3.57Å; S13-L71 WeakPolarHBondContact CA-O 3.26Å; C14-L71 HydrophobicContact CB-CB 4.16Å; C14-L71 PolarHBondContact N-O 2.87Å; C14-L71 PolarHBondContact O-N 3.01Å; F21-L71 HydrophobicContact CE2-CB 4.32Å; F21-L71 HydrophobicContact CZ-CB 4.14Å; M26-L71 HydrophobicContact CB-CD1 3.67Å; M26-L71 HydrophobicContact CB-CD2 3.93Å; M26-L71 HydrophobicContact CB-CG 4.4Å; M26-L71 HydrophobicContact CG-CD1 4.32Å; W28-L71 HydrophobicContact CG-CD2 4.5Å; I43-L71 HydrophobicContact CG2-CD1 3.71Å; I62-L71 HydrophobicContact CD1-CD1 4.01Å; I62-L71 HydrophobicContact CD1-CD2 4.43Å; I62-L71 HydrophobicContact CD1-CG 4.5Å; I62-L71 HydrophobicContact CG1-CD1 3.97Å; I62-L71 HydrophobicContact CG1-CG 4.48Å; R64-L71 HydrophobicContact CB-CD1 4.09Å
72	Y	97.6	Very high	95.3	Very high	39 Å²	39	52.6 Å²	52.6	15%	0.153	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	146.9	179.7	-56	-75.7	0	0	0	111.2	L12 I62 S63 D65 N70	L12-Y72 VanDerWaalsContact O-CA 3.27Å; L12-Y72 WeakPolarHBondContact O-CA 3.18Å; I62-Y72 WeakPolarHBondContact CA-O 3.49Å; S63-Y72 PolarHBondContact N-O 3.12Å; S63-Y72 PolarHBondContact O-N 2.86Å; D65-Y72 HydrophobicContact CB-CE2 4.02Å; N70-Y72 HydrophobicContact CB-CE1 4.22Å; N70-Y72 HydrophobicContact CB-CE2 3.73Å; N70-Y72 VanDerWaalsContact CB-CZ 3.5Å; N70-Y72 VanDerWaalsContact CB-OH 3.3Å; N70-Y72 WeakPolarHBondContact CB-OH 3.44Å; N70-Y72 PolarHBondContact ND2-OH 2.8Å; N70-Y72 VanDerWaalsContact ND2-OH 3.14Å
73	L	98.1	Very high	95	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	109	167.2	-170.2	67.4	0	0	0	108.5	K11 L12 W28 V40 A41 F60 I62 M75 Y86	K11-L73 WeakPolarHBondContact CA-O 2.94Å; L12-L73 HydrophobicContact CB-CB 4.23Å; L12-L73 HydrophobicContact CD1-CD2 4.41Å; L12-L73 PolarHBondContact N-O 3.42Å; L12-L73 PolarHBondContact O-N 3.11Å; W28-L73 HydrophobicContact CB-CD2 4.19Å; W28-L73 HydrophobicContact CD2-CB 4.01Å; W28-L73 HydrophobicContact CD2-CD2 4.17Å; W28-L73 HydrophobicContact CG-CB 4.09Å; W28-L73 HydrophobicContact CG-CD1 4.29Å; W28-L73 HydrophobicContact CG-CD2 3.97Å; W28-L73 HydrophobicContact CG-CG 4.35Å; W28-L73 HydrophobicContact CZ2-CB 4.17Å; V40-L73 HydrophobicContact CG1-CD2 3.93Å; A41-L73 HydrophobicContact CB-CD1 4.07Å; F60-L73 HydrophobicContact CB-CD1 4.28Å; F60-L73 HydrophobicContact CD2-CD2 4.17Å; I62-L73 HydrophobicContact CB-CD1 4.28Å; L73-M75 HydrophobicContact CD2-CG 3.82Å; L73-M75 HydrophobicContact CD2-SD 3.89Å; L73-M75 HydrophobicContact CG-CG 3.82Å; L73-M75 HydrophobicContact CG-SD 4.41Å; L73-Y86 HydrophobicContact CD2-CD1 4.12Å; L73-Y86 HydrophobicContact CD2-CE1 4.12Å
74	Q	97.6	Very high	94.8	Very high	75 Å²	75	55.9 Å²	55.9	35%	0.35	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	119.1	168.2	-174.5	65	40.4	0	0	108.1	F60 T61	F60-Q74 CarbonylContact C-O 3.58Å; F60-Q74 VanDerWaalsContact CA-O 3.26Å; F60-Q74 WeakPolarHBondContact CA-O 3.27Å; T61-Q74 PolarHBondContact N-O 2.96Å; T61-Q74 PolarHBondContact O-N 3Å
75	M	96.6	Very high	94.7	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.02	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.6	178.9	-58.3	162.4	61.3	0	0	107.9	S9 L10 L12 F60 L73 L78 Y86	S9-M75 CarbonylContact C-O 3.55Å; S9-M75 WeakPolarHBondContact CA-O 3.42Å; S9-M75 WeakPolarHBondContact CB-O 2.95Å; L10-M75 PolarHBondContact N-O 2.82Å; L10-M75 PolarHBondContact O-N 2.77Å; L12-M75 HydrophobicContact CD1-SD 3.71Å; L12-M75 HydrophobicContact CG-SD 3.9Å; F60-M75 HydrophobicContact CD1-CB 3.83Å; F60-M75 HydrophobicContact CD1-CG 4.03Å; F60-M75 HydrophobicContact CD2-CG 3.96Å; F60-M75 HydrophobicContact CE1-CB 3.74Å; F60-M75 HydrophobicContact CE1-CE 4.38Å; F60-M75 HydrophobicContact CE1-CG 4.03Å; F60-M75 HydrophobicContact CE2-CE 3.89Å; F60-M75 HydrophobicContact CE2-CG 3.95Å; F60-M75 HydrophobicContact CE2-SD 4.45Å; F60-M75 HydrophobicContact CG-CB 4.32Å; F60-M75 HydrophobicContact CG-CG 4.03Å; F60-M75 HydrophobicContact CZ-CB 4.13Å; F60-M75 HydrophobicContact CZ-CE 3.66Å; F60-M75 HydrophobicContact CZ-CG 4Å; L73-M75 HydrophobicContact CD2-CG 3.82Å; L73-M75 HydrophobicContact CD2-SD 3.89Å; L73-M75 HydrophobicContact CG-CG 3.82Å; L73-M75 HydrophobicContact CG-SD 4.41Å; M75-L78 HydrophobicContact CB-CD2 3.84Å; M75-L78 HydrophobicContact CB-CG 4.39Å; M75-L78 HydrophobicContact CE-CD2 3.34Å; M75-Y86 HydrophobicContact CE-CE1 4.06Å; M75-Y86 HydrophobicContact CE-CE2 4.03Å; M75-Y86 WeakPolarHBondContact CE-OH 3.47Å; M75-Y86 HydrophobicContact SD-CE1 4.36Å
76	S	95.8	Very high	94.7	Very high	39 Å²	39	58.9 Å²	58.9	27%	0.273	33%	0.326	S	S	.	.			trans	-118	159.2	175.9	68.5	0	0	0	0	111.1	R59 L78	R59-S76 WeakPolarHBondContact CB-O 3.44Å; R59-S76 WeakPolarHBondContact O-CB 3.43Å; R59-S76 PolarHBondContact O-N 3Å; R59-S76 PolarHBondContact O-OG 2.76Å; S76-L78 VanDerWaalsContact C-N 3.31Å; S76-L78 PolarHBondContact O-N 3.37Å
77	S	94.6	Very high	94.8	Very high	70 Å²	70	59.3 Å²	59.3	49%	0.49	32%	0.323	S	S	.	.	S	Bend	trans	48.3	53	179.4	-57.8	0	0	0	0	112.2	G8 R59	G8-S77 PolarHBondContact O-N 3.22Å; R59-S77 PolarHBondContact NH1-O 3.35Å
78	L	94.6	Very high	94.9	Very high	19 Å²	19	54.8 Å²	54.8	10%	0.099	29%	0.285	C	S	.	.			trans	-60.9	136.4	-176.7	-76.7	170.2	0	0	0	112.1	V4 G7 G8 L10 F60 M75 S76 D82	V4-L78 HydrophobicContact CB-CD1 3.98Å; V4-L78 HydrophobicContact CG1-CD1 3.89Å; V4-L78 HydrophobicContact CG2-CD1 4.5Å; G7-L78 PolarHBondContact N-O 3.07Å; G8-L78 PolarHBondContact O-N 2.7Å; G8-L78 VanDerWaalsContact O-N 3.08Å; L10-L78 HydrophobicContact CB-CD1 3.93Å; F60-L78 HydrophobicContact CE1-CD2 4.03Å; F60-L78 HydrophobicContact CZ-CD2 4.05Å; M75-L78 HydrophobicContact CB-CD2 3.84Å; M75-L78 HydrophobicContact CB-CG 4.39Å; M75-L78 HydrophobicContact CE-CD2 3.34Å; S76-L78 VanDerWaalsContact C-N 3.31Å; S76-L78 PolarHBondContact O-N 3.37Å; L78-D82 HydrophobicContact CD2-CB 3.97Å
79	K	93.5	Very high	94.8	Very high	100 Å²	100	49.2 Å²	49.2	44%	0.435	26%	0.264	S	S	.	.			trans	-107	162.7	175	-60	179.4	-179.1	-177.9	0	110	E81 D82	K79-E81 HydrophobicContact CB-CB 4.39Å; K79-E81 WeakPolarHBondContact CD-OE2 3.32Å; K79-E81 PolarHBondContact O-N 3.4Å; K79-D82 PolarHBondContact N-OD2 3.25Å; K79-D82 WeakPolarHBondContact O-CB 3.27Å; K79-D82 PolarHBondContact O-N 2.97Å
80	S	89.9	Confident	94.7	Very high	88 Å²	88	48 Å²	48	62%	0.615	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-56	-37.6	171.6	46.8	0	0	0	0	111.8	D82 T83	S80-D82 PolarHBondContact O-N 3.27Å; S80-T83 VanDerWaalsContact O-CB 3.24Å; S80-T83 WeakPolarHBondContact O-CB 3.33Å; S80-T83 PolarHBondContact O-N 2.77Å; S80-T83 PolarHBondContact O-OG1 3.11Å
81	E	90.7	Very high	94.3	Very high	134 Å²	134	47 Å²	47	63%	0.626	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-59.9	-19.5	175.6	-62.7	150.6	-167.6	0	0	114	K79 T83	K79-E81 HydrophobicContact CB-CB 4.39Å; K79-E81 WeakPolarHBondContact CD-OE2 3.32Å; K79-E81 PolarHBondContact O-N 3.4Å; E81-T83 VanDerWaalsContact C-N 3.25Å
82	D	92.9	Very high	93.4	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.043	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-85.6	1.1	177	-57.5	-49.6	0	0	0	112.7	R30 R59 F60 L78 K79 S80 A84 Y86	R30-D82 IonicContact NH1-OD1 3.65Å; R30-D82 PolarHBondContact NH1-OD1 2.98Å; R30-D82 VanDerWaalsContact NH1-OD1 3.09Å; R59-D82 IonicContact CZ-OD1 3.91Å; R59-D82 IonicContact CZ-OD2 3.39Å; R59-D82 IonicContact NH1-OD1 3.88Å; R59-D82 IonicContact NH1-OD2 2.68Å; R59-D82 PolarHBondContact NH1-OD2 2.88Å; R59-D82 IonicContact NH2-OD1 2.99Å; R59-D82 PolarHBondContact NH2-OD1 3.13Å; R59-D82 IonicContact NH2-OD2 3.21Å; R59-D82 PolarHBondContact NH2-OD2 3.18Å; F60-D82 HydrophobicContact CZ-CB 4.1Å; L78-D82 HydrophobicContact CD2-CB 3.97Å; K79-D82 PolarHBondContact N-OD2 3.25Å; K79-D82 WeakPolarHBondContact O-CB 3.27Å; K79-D82 PolarHBondContact O-N 2.97Å; S80-D82 PolarHBondContact O-N 3.27Å; D82-A84 PolarHBondContact O-N 2.88Å; D82-A84 VanDerWaalsContact O-N 3.12Å; D82-Y86 WeakPolarHBondContact O-CE2 3.3Å; D82-Y86 PolarHBondContact O-OH 3.24Å
83	T	92.4	Very high	91.9	Very high	100 Å²	100	58.9 Å²	58.9	61%	0.613	30%	0.3	S	S	*	.			trans	-73.5	105.3	176.9	-52.6	0	0	0	0	109.6	S80 E81	S80-T83 VanDerWaalsContact O-CB 3.24Å; S80-T83 WeakPolarHBondContact O-CB 3.33Å; S80-T83 PolarHBondContact O-N 2.77Å; S80-T83 PolarHBondContact O-OG1 3.11Å; E81-T83 VanDerWaalsContact C-N 3.25Å
84	A	94.1	Very high	90.3	Very high	23 Å²	23	69.1 Å²	69.1	19%	0.19	34%	0.34	C	S	.	.	S	Bend	trans	-157.7	168	-177.8	0	0	0	0	0	110	R30 Q31 D82 Y86	R30-A84 HydrophobicContact CB-CB 3.8Å; R30-A84 HydrophobicContact CG-CB 4.07Å; Q31-A84 WeakPolarHBondContact O-CA 3.25Å; Q31-A84 VanDerWaalsContact O-CB 3.31Å; Q31-A84 WeakPolarHBondContact O-CB 3.45Å; D82-A84 PolarHBondContact O-N 2.88Å; D82-A84 VanDerWaalsContact O-N 3.12Å; A84-Y86 HydrophobicContact CB-CD2 4.43Å; A84-Y86 HydrophobicContact CB-CE2 3.94Å; A84-Y86 VanDerWaalsContact O-CD2 3.28Å; A84-Y86 WeakPolarHBondContact O-CD2 3.35Å
85	M	94.3	Very high	88.8	Confident	113 Å²	113	68.6 Å²	68.6	56%	0.557	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	133.5	163.3	-70.6	-49.9	-41.5	0	0	109.9	R30 Q31 Y87	R30-M85 CarbonylContact C-O 3.58Å; R30-M85 WeakPolarHBondContact CA-O 3.48Å; R30-M85 WeakPolarHBondContact CB-O 3.43Å; Q31-M85 PolarHBondContact N-O 2.8Å; Q31-M85 PolarHBondContact O-N 3.09Å; M85-Y87 HydrophobicContact CB-CE2 3.68Å; M85-Y87 WeakPolarHBondContact CB-OH 3.33Å
86	Y	95.1	Very high	87.6	Confident	29 Å²	29	74.1 Å²	74.1	11%	0.114	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134.9	-177	-75.4	-102.9	0	0	0	110.1	L12 W28 V29 R30 V40 F60 L73 M75 D82 A84	L12-Y86 HydrophobicContact CD1-CD1 3.93Å; L12-Y86 HydrophobicContact CD1-CD2 4.22Å; L12-Y86 HydrophobicContact CD1-CG 3.67Å; W28-Y86 HydrophobicContact CE3-CD1 4.46Å; V29-Y86 CarbonylContact O-C 3.48Å; V29-Y86 WeakPolarHBondContact O-CA 3.4Å; R30-Y86 HydrophobicContact CB-CD1 3.94Å; R30-Y86 HydrophobicContact CB-CD2 4.38Å; R30-Y86 HydrophobicContact CB-CE1 3.87Å; R30-Y86 HydrophobicContact CB-CE2 4.3Å; R30-Y86 HydrophobicContact CB-CG 4.2Å; V40-Y86 HydrophobicContact CG1-CE1 4.2Å; V40-Y86 HydrophobicContact CG2-CD1 4.41Å; V40-Y86 HydrophobicContact CG2-CE1 3.97Å; F60-Y86 HydrophobicContact CE2-CE1 4.4Å; L73-Y86 HydrophobicContact CD2-CD1 4.12Å; L73-Y86 HydrophobicContact CD2-CE1 4.12Å; M75-Y86 HydrophobicContact CE-CE1 4.06Å; M75-Y86 HydrophobicContact CE-CE2 4.03Å; M75-Y86 WeakPolarHBondContact CE-OH 3.47Å; M75-Y86 HydrophobicContact SD-CE1 4.36Å; D82-Y86 WeakPolarHBondContact O-CE2 3.3Å; D82-Y86 PolarHBondContact O-OH 3.24Å; A84-Y86 HydrophobicContact CB-CD2 4.43Å; A84-Y86 HydrophobicContact CB-CE2 3.94Å; A84-Y86 VanDerWaalsContact O-CD2 3.28Å; A84-Y86 WeakPolarHBondContact O-CD2 3.35Å
87	Y	94.9	Very high	86.5	Confident	77 Å²	77	75.7 Å²	75.7	30%	0.302	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.1	-175.2	-57.5	-78.7	0	0	0	111	V29 Q31 M85 G100	V29-Y87 PolarHBondContact N-O 3.17Å; V29-Y87 PolarHBondContact O-N 3.05Å; Q31-Y87 HydrophobicContact CB-CD2 4.47Å; Q31-Y87 HydrophobicContact CB-CE2 3.76Å; M85-Y87 HydrophobicContact CB-CE2 3.68Å; M85-Y87 WeakPolarHBondContact CB-OH 3.33Å; Y87-G100 CarbonylContact C-O 3.6Å; Y87-G100 VanDerWaalsContact CA-O 3.27Å; Y87-G100 WeakPolarHBondContact CA-O 3.28Å
88	C	95.3	Very high	85.3	Confident	1 Å²	1	81 Å²	81	1%	0.007	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.9	175.8	-43.6	0	0	0	0	109.9	C14 Y27 W28 Y98 W99 G100	C14-C88 HydrophobicContact CB-CB 3.99Å; C14-C88 WeakPolarHBondContact CB-SG 3.27Å; C14-C88 WeakPolarHBondContact SG-CB 3.31Å; C14-C88 CovalentContact SG-SG 2.01Å; C14-C88 PolarHBondContact SG-SG 3.14Å; Y27-C88 WeakPolarHBondContact O-CA 3.17Å; W28-C88 VanDerWaalsContact CH2-SG 3.59Å; C88-Y98 WeakPolarHBondContact O-CA 3.3Å; C88-W99 HydrophobicContact CB-CH2 4.49Å; C88-W99 HydrophobicContact CB-CZ2 3.99Å; C88-W99 PolarHBondContact O-N 3.03Å; C88-W99 VanDerWaalsContact O-N 3.16Å; C88-G100 PolarHBondContact N-O 3.49Å
89	A	94.3	Very high	84.5	Confident	16 Å²	16	82.5 Å²	82.5	13%	0.132	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	160.4	178.5	0	0	0	0	0	111.7	M26 Y27 V29 D97 W99	M26-A89 CarbonylContact C-O 3.54Å; Y27-A89 WeakPolarHBondContact CA-O 3.2Å; Y27-A89 VanDerWaalsContact CB-O 3.24Å; Y27-A89 WeakPolarHBondContact CB-O 3.38Å; Y27-A89 VanDerWaalsContact CD2-C 3.49Å; Y27-A89 HydrophobicContact CD2-CB 4.33Å; Y27-A89 VanDerWaalsContact CD2-O 3.25Å; Y27-A89 WeakPolarHBondContact CD2-O 3.39Å; Y27-A89 PolarHBondContact N-O 3.3Å; Y27-A89 PolarHBondContact O-N 3.31Å; V29-A89 HydrophobicContact CG2-CB 4.15Å; A89-D97 CarbonylContact C-O 3.39Å; A89-D97 VanDerWaalsContact CA-O 3.28Å; A89-D97 WeakPolarHBondContact CA-O 3.26Å; A89-W99 VanDerWaalsContact CA-CZ3 3.4Å; A89-W99 WeakPolarHBondContact O-CH2 3.42Å; A89-W99 WeakPolarHBondContact O-CZ3 3.35Å
90	R	92.8	Very high	82.8	Confident	43 Å²	43	81 Å²	81	16%	0.162	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.8	-169.2	61.6	-161.7	170.4	174.8	-0.8	107.2	F19 Y24 Y25 M26 M96 D97 W99	F19-R90 VanDerWaalsContact CD2-NH1 3.29Å; F19-R90 VanDerWaalsContact CE1-NH1 3.32Å; Y24-R90 HydrophobicContact CD1-CB 4.1Å; Y24-R90 HydrophobicContact CD1-CG 4.01Å; Y24-R90 HydrophobicContact CG-CB 4.24Å; Y24-R90 HydrophobicContact CG-CG 4.47Å; Y25-R90 WeakPolarHBondContact O-CA 3.28Å; Y25-R90 WeakPolarHBondContact O-CB 3.49Å; M26-R90 HydrophobicContact SD-CB 4.17Å; R90-M96 VanDerWaalsContact O-CA 3.3Å; R90-M96 WeakPolarHBondContact O-CA 3.35Å; R90-D97 HydrophobicContact CG-CB 4.4Å; R90-D97 IonicContact CZ-OD2 3.72Å; R90-D97 PolarHBondContact N-O 3.09Å; R90-D97 IonicContact NE-OD2 3.75Å; R90-D97 IonicContact NH2-OD2 2.86Å; R90-D97 PolarHBondContact NH2-OD2 3.37Å; R90-D97 PolarHBondContact O-N 3.5Å; R90-W99 VanDerWaalsContact CA-CZ3 3.45Å; R90-W99 HydrophobicContact CB-CE3 4.04Å; R90-W99 HydrophobicContact CB-CH2 3.38Å; R90-W99 HydrophobicContact CB-CZ3 3.04Å; R90-W99 VanDerWaalsContact CD-CZ3 3.48Å; R90-W99 HydrophobicContact CG-CE3 3.78Å; R90-W99 HydrophobicContact CG-CH2 4.09Å; R90-W99 HydrophobicContact CG-CZ3 3.25Å
91	A	87.3	Confident	82.4	Confident	10 Å²	10	80.7 Å²	80.7	8%	0.083	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	149.7	162.4	0	0	0	0	0	110.7	Y25 Y27 A95 M96	Y25-A91 PolarHBondContact N-O 2.75Å; Y25-A91 PolarHBondContact O-N 2.73Å; Y25-A91 VanDerWaalsContact O-N 3.13Å; Y27-A91 HydrophobicContact CE2-CB 3.52Å; Y27-A91 WeakPolarHBondContact OH-CB 3.49Å; A91-A95 WeakPolarHBondContact CA-O 3.39Å; A91-M96 HydrophobicContact CB-CE 4.14Å; A91-M96 HydrophobicContact CB-CG 3.58Å
92	N	78.7	Confident	82	Confident	58 Å²	58	77.9 Å²	77.9	31%	0.31	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-174.7	152.8	66.2	15.7	0	0	0	108.4	Y24 Y94 A95	Y24-N92 HydrophobicContact CD1-CB 3.8Å; Y24-N92 HydrophobicContact CE1-CB 3.77Å; N92-Y94 PolarHBondContact O-N 2.84Å; N92-Y94 PolarHBondContact OD1-N 3.36Å; N92-A95 PolarHBondContact N-O 2.96Å; N92-A95 VanDerWaalsContact N-O 3.16Å; N92-A95 PolarHBondContact OD1-N 3.27Å
93	W	66.6	Low	81.4	Confident	230 Å²	230	81.8 Å²	81.8	87%	0.871	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-9.2	-179	-59.1	97.9	0	0	0	115.3
94	Y	63.8	Low	80.7	Confident	215 Å²	215	80.7 Å²	80.7	84%	0.843	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-18.2	-171.8	-57.5	-76.8	0	0	0	114.8	N92	N92-Y94 PolarHBondContact O-N 2.84Å; N92-Y94 PolarHBondContact OD1-N 3.36Å
95	A	67.6	Low	79.9	Confident	63 Å²	63	84.3 Å²	84.3	52%	0.521	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	153.4	-176.1	0	0	0	0	0	114	A91 N92	A91-A95 WeakPolarHBondContact CA-O 3.39Å; N92-A95 PolarHBondContact N-O 2.96Å; N92-A95 VanDerWaalsContact N-O 3.16Å; N92-A95 PolarHBondContact OD1-N 3.27Å
96	M	70.4	Confident	79	Confident	120 Å²	120	82.4 Å²	82.4	59%	0.591	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.6	169.8	-95	-179.2	156.5	0	0	110.7	Y27 W39 R90 A91	Y27-M96 HydrophobicContact CD2-CE 4.25Å; Y27-M96 HydrophobicContact CE2-CE 3.56Å; W39-M96 HydrophobicContact CH2-CE 3.74Å; W39-M96 HydrophobicContact CZ2-CE 3.41Å; W39-M96 VanDerWaalsContact CZ2-CE 3.41Å; W39-M96 HydrophobicContact CZ2-SD 4.47Å; R90-M96 VanDerWaalsContact O-CA 3.3Å; R90-M96 WeakPolarHBondContact O-CA 3.35Å; A91-M96 HydrophobicContact CB-CE 4.14Å; A91-M96 HydrophobicContact CB-CG 3.58Å
97	D	73.3	Confident	77.8	Confident	73 Å²	73	86.2 Å²	86.2	39%	0.39	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	155.8	-176.9	-171	22.4	0	0	0	111.9	A89 R90	A89-D97 CarbonylContact C-O 3.39Å; A89-D97 VanDerWaalsContact CA-O 3.28Å; A89-D97 WeakPolarHBondContact CA-O 3.26Å; R90-D97 HydrophobicContact CG-CB 4.4Å; R90-D97 IonicContact CZ-OD2 3.72Å; R90-D97 PolarHBondContact N-O 3.09Å; R90-D97 IonicContact NE-OD2 3.75Å; R90-D97 IonicContact NH2-OD2 2.86Å; R90-D97 PolarHBondContact NH2-OD2 3.37Å; R90-D97 PolarHBondContact O-N 3.5Å
98	Y	69.8	Low	76.5	Confident	181 Å²	181	86.9 Å²	86.9	71%	0.71	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	138	179	55.3	-95.2	0	0	0	111.5	C88	C88-Y98 WeakPolarHBondContact O-CA 3.3Å
99	W	76.4	Confident	74.9	Confident	51 Å²	51	94.1 Å²	94.1	19%	0.193	46%	0.46	C	S	.	.			trans	-133.3	7.6	-178	70.2	88.9	0	0	0	115.2	F19 M26 C88 A89 R90	F19-W99 HydrophobicContact CE1-CB 4.49Å; F19-W99 AromaticContact CE1-CD2 3.91Å; F19-W99 HydrophobicContact CE1-CD2 3.91Å; F19-W99 HydrophobicContact CE1-CE3 4.46Å; F19-W99 AromaticContact CE1-CG 3.87Å; F19-W99 HydrophobicContact CE1-CG 3.87Å; F19-W99 AromaticContact CZ-CD2 3.71Å; F19-W99 HydrophobicContact CZ-CD2 3.71Å; F19-W99 AromaticContact CZ-CE2 3.64Å; F19-W99 HydrophobicContact CZ-CE3 4.11Å; F19-W99 HydrophobicContact CZ-CG 4.15Å; F19-W99 HydrophobicContact CZ-CH2 4.35Å; F19-W99 AromaticContact CZ-CZ2 3.98Å; F19-W99 HydrophobicContact CZ-CZ2 3.98Å; F19-W99 HydrophobicContact CZ-CZ3 4.4Å; F19-W99 AromaticContact CZ-NE1 3.96Å; M26-W99 HydrophobicContact CE-CZ2 4.46Å; M26-W99 HydrophobicContact SD-CH2 3.27Å; M26-W99 WeakPolarHBondContact SD-CH2 3.38Å; M26-W99 HydrophobicContact SD-CZ2 3.42Å; M26-W99 WeakPolarHBondContact SD-CZ2 3.13Å; M26-W99 HydrophobicContact SD-CZ3 4.42Å; C88-W99 HydrophobicContact CB-CH2 4.49Å; C88-W99 HydrophobicContact CB-CZ2 3.99Å; C88-W99 PolarHBondContact O-N 3.03Å; C88-W99 VanDerWaalsContact O-N 3.16Å; A89-W99 VanDerWaalsContact CA-CZ3 3.4Å; A89-W99 WeakPolarHBondContact O-CH2 3.42Å; A89-W99 WeakPolarHBondContact O-CZ3 3.35Å; R90-W99 VanDerWaalsContact CA-CZ3 3.45Å; R90-W99 HydrophobicContact CB-CE3 4.04Å; R90-W99 HydrophobicContact CB-CH2 3.38Å; R90-W99 HydrophobicContact CB-CZ3 3.04Å; R90-W99 VanDerWaalsContact CD-CZ3 3.48Å; R90-W99 HydrophobicContact CG-CE3 3.78Å; R90-W99 HydrophobicContact CG-CH2 4.09Å; R90-W99 HydrophobicContact CG-CZ3 3.25Å
100	G	58.3	Low	73.2	Confident	69 Å²	69	101.2 Å²	101.2	71%	0.711	49%	0.49	S	S	*	.			trans	-159.8	0	-176.2	0	0	0	0	0	113.2	Y87 C88	Y87-G100 CarbonylContact C-O 3.6Å; Y87-G100 VanDerWaalsContact CA-O 3.27Å; Y87-G100 WeakPolarHBondContact CA-O 3.28Å; C88-G100 PolarHBondContact N-O 3.49Å

Retrieved 100 of 100 residues in 36.9 ms (Link to these results)

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