X5J4F5_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4F5, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 110 aa.

						>X5J4F5_MOUSE|X5J4F5
GGLVKPGGSLKLSCAASGFTFSSYAMSWVRQSPEKRLEWVAEISSGGSYAYYPDTVTGRFTISRDNAKNTLYLEMSSLRSEDTAMYYCARKTTSYAMDYWGQGTSVTVSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	G	71.2	Confident	92.6	Very high	67 Å²	67	69.6 Å²	69.6	69%	0.691	45%	0.446	S	S	*	.				0	171.8	0	0	0	0	0	0	108.9	T104 S105	G1-T104 WeakPolarHBondContact CA-OG1 3.43Å; G1-T104 PolarHBondContact N-OG1 2.72Å; G1-S105 CarbonylContact C-O 3.56Å; G1-S105 WeakPolarHBondContact CA-O 3.43Å
2	G	89.6	Confident	93.1	Very high	24 Å²	24	64.3 Å²	64.3	25%	0.247	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	150.3	-177.4	0	0	0	0	0	113	S105 T107	G2-S105 PolarHBondContact N-O 3.01Å; G2-T107 PolarHBondContact O-N 3.38Å
3	L	92.6	Very high	93.5	Very high	125 Å²	125	65.7 Å²	65.7	65%	0.654	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.1	165.3	179.1	65.2	0	0	0	108	T107 S109	L3-T107 WeakPolarHBondContact CA-O 3.34Å; L3-T107 HydrophobicContact CD1-CG2 3.72Å; L3-S109 WeakPolarHBondContact CD1-OG 3.37Å
4	V	94.1	Very high	93.7	Very high	23 Å²	23	62.3 Å²	62.3	14%	0.139	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	149.4	-179.1	-72.3	0	0	0	0	110.3	L10 L78 T107 V108 S109	V4-L10 HydrophobicContact CG1-CB 4.47Å; V4-L78 HydrophobicContact CG2-CD1 3.65Å; V4-T107 PolarHBondContact N-O 3.46Å; V4-V108 HydrophobicContact CG2-CG2 3.98Å; V4-V108 VanDerWaalsContact O-CA 3.26Å; V4-V108 WeakPolarHBondContact O-CA 3.33Å; V4-S109 PolarHBondContact O-N 2.94Å; V4-S109 VanDerWaalsContact O-N 3.12Å
5	K	94.1	Very high	94	Very high	145 Å²	145	63.5 Å²	63.5	63%	0.63	42%	0.42	S	S	*	.			trans	-76.5	153.4	173.7	-69.8	-176	174.6	-175.5	0	110.6	G7 G8	K5-G7 PolarHBondContact O-N 2.9Å; K5-G8 WeakPolarHBondContact O-CA 3.37Å; K5-G8 PolarHBondContact O-N 3.21Å
6	P	95.7	Very high	94	Very high	75 Å²	75	60.6 Å²	60.6	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	139.5	169.7	-25.8	34	0	0	0	111.9	G8 L78 V108	P6-G8 PolarHBondContact O-N 3.07Å; P6-L78 CarbonylContact C-O 3.43Å; P6-L78 WeakPolarHBondContact CA-O 3.5Å; P6-V108 HydrophobicContact CB-CG1 4.43Å; P6-V108 HydrophobicContact CG-CG1 4.14Å
7	G	94.7	Very high	94	Very high	57 Å²	57	63 Å²	63	59%	0.588	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	-9.4	-172.4	0	0	0	0	0	114.6	K5 L78	K5-G7 PolarHBondContact O-N 2.9Å; G7-L78 PolarHBondContact N-O 2.88Å
8	G	95.8	Very high	93.9	Very high	22 Å²	22	63.8 Å²	63.8	23%	0.227	44%	0.442	C	S	.	.			trans	-68	173.8	177	0	0	0	0	0	113.7	K5 P6 S77 L78	K5-G8 WeakPolarHBondContact O-CA 3.37Å; K5-G8 PolarHBondContact O-N 3.21Å; P6-G8 PolarHBondContact O-N 3.07Å; G8-S77 PolarHBondContact O-N 3.23Å; G8-L78 PolarHBondContact O-N 2.99Å; G8-L78 VanDerWaalsContact O-N 3.08Å
9	S	96.8	Very high	93.7	Very high	83 Å²	83	62.6 Å²	62.6	58%	0.58	43%	0.428	S	S	*	.			trans	-126.7	149.9	176.1	-59.3	0	0	0	0	111.3	M75	S9-M75 CarbonylContact C-O 3.54Å; S9-M75 WeakPolarHBondContact CA-O 3.42Å; S9-M75 WeakPolarHBondContact CB-O 3.49Å
10	L	96.9	Very high	93.7	Very high	37 Å²	37	63.8 Å²	63.8	19%	0.194	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.8	178.4	-174.5	64.9	0	0	0	109.7	V4 L12 M75 L78 V106	V4-L10 HydrophobicContact CG1-CB 4.47Å; L10-L12 HydrophobicContact CD2-CD2 3.68Å; L10-L12 HydrophobicContact CG-CD2 4.1Å; L10-M75 PolarHBondContact N-O 2.85Å; L10-M75 WeakPolarHBondContact O-CB 3.27Å; L10-M75 PolarHBondContact O-N 2.84Å; L10-L78 HydrophobicContact CB-CD1 3.95Å; L10-V106 HydrophobicContact CD2-CB 4.48Å; L10-V106 HydrophobicContact CD2-CG1 3.97Å; L10-V106 HydrophobicContact CD2-CG2 3.76Å
11	K	97.7	Very high	93.8	Very high	108 Å²	108	60.8 Å²	60.8	47%	0.47	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120.5	170	-175.2	169.5	-176.7	156.5	0	109.8	L73 E74	K11-L73 CarbonylContact C-O 3.6Å; K11-L73 WeakPolarHBondContact CA-O 3.27Å; K11-E74 HydrophobicContact CB-CG 4.41Å; K11-E74 HydrophobicContact CD-CG 3.84Å; K11-E74 WeakPolarHBondContact CE-OE1 3.26Å; K11-E74 HydrophobicContact CG-CG 3.9Å; K11-E74 IonicContact NZ-OE1 3.96Å; K11-E74 PolarHBondContact NZ-OE1 3.07Å
12	L	98.1	Very high	94.9	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.031	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	150.1	171.4	-55	-176.1	0	0	0	110	L10 W28 Y72 L73 M75 Y86 T104 V106	L10-L12 HydrophobicContact CD2-CD2 3.68Å; L10-L12 HydrophobicContact CG-CD2 4.1Å; L12-W28 HydrophobicContact CB-CH2 3.78Å; L12-W28 HydrophobicContact CB-CZ2 3.98Å; L12-W28 HydrophobicContact CB-CZ3 4.36Å; L12-W28 HydrophobicContact CD1-CE3 4.49Å; L12-W28 HydrophobicContact CD1-CH2 4.37Å; L12-W28 HydrophobicContact CD1-CZ3 4.11Å; L12-Y72 VanDerWaalsContact O-CA 3.24Å; L12-Y72 WeakPolarHBondContact O-CA 3.07Å; L12-L73 HydrophobicContact CB-CB 4.25Å; L12-L73 HydrophobicContact CD1-CD2 4.43Å; L12-L73 PolarHBondContact N-O 3.23Å; L12-L73 PolarHBondContact O-N 2.87Å; L12-M75 HydrophobicContact CD1-SD 3.73Å; L12-M75 HydrophobicContact CG-SD 3.88Å; L12-Y86 HydrophobicContact CD1-CD1 3.98Å; L12-Y86 HydrophobicContact CD1-CD2 4.45Å; L12-Y86 HydrophobicContact CD1-CG 3.79Å; L12-T104 HydrophobicContact CD1-CG2 4.03Å; L12-T104 HydrophobicContact CD2-CG2 3.88Å; L12-T104 HydrophobicContact CG-CG2 4.5Å; L12-V106 HydrophobicContact CD1-CG2 4.11Å; L12-V106 HydrophobicContact CD2-CG2 3.99Å
13	S	97.8	Very high	95.1	Very high	82 Å²	82	62.4 Å²	62.4	57%	0.573	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.2	172	61.1	0	0	0	0	110.5	L71	S13-L71 CarbonylContact C-O 3.6Å; S13-L71 VanDerWaalsContact CA-O 3.28Å; S13-L71 WeakPolarHBondContact CA-O 3.13Å
14	C	97.5	Very high	95.2	Very high	18 Å²	18	60 Å²	60	12%	0.122	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	111.2	174.1	165.1	0	0	0	0	109.2	W28 T70 L71 C88	C14-W28 HydrophobicContact CB-CH2 3.87Å; C14-W28 HydrophobicContact CB-CZ2 3.89Å; C14-T70 CarbonylContact O-C 3.57Å; C14-T70 WeakPolarHBondContact O-CA 3.44Å; C14-L71 HydrophobicContact CB-CB 4.35Å; C14-L71 PolarHBondContact N-O 2.84Å; C14-L71 PolarHBondContact O-N 2.95Å; C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 3.26Å; C14-C88 WeakPolarHBondContact SG-CB 3.38Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 3.22Å
15	A	96.9	Very high	95.3	Very high	80 Å²	80	59.8 Å²	59.8	66%	0.661	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	124.9	173.3	0	0	0	0	0	109.5
16	A	94.8	Very high	95.4	Very high	17 Å²	17	53.1 Å²	53.1	14%	0.14	36%	0.364	C	S	.	.			trans	-93.1	143.2	177.8	0	0	0	0	0	111	F19 F21 N69	A16-F19 HydrophobicContact CB-CE1 4.1Å; A16-F19 HydrophobicContact CB-CE2 4.36Å; A16-F19 HydrophobicContact CB-CZ 3.7Å; A16-F21 HydrophobicContact CB-CB 4.38Å; A16-F21 HydrophobicContact CB-CD2 3.44Å; A16-F21 VanDerWaalsContact CB-CD2 3.44Å; A16-F21 HydrophobicContact CB-CE2 4.06Å; A16-F21 HydrophobicContact CB-CG 4.24Å; A16-N69 WeakPolarHBondContact CB-O 3.17Å; A16-N69 PolarHBondContact N-O 2.88Å
17	S	93.4	Very high	95.5	Very high	102 Å²	102	49.5 Å²	49.5	71%	0.713	34%	0.341	S	S	*	.			trans	-143.9	159.7	174.4	62.5	0	0	0	0	110.2	F19	S17-F19 WeakPolarHBondContact O-CD1 3.48Å; S17-F19 PolarHBondContact O-N 3.17Å
18	G	91.8	Very high	95.6	Very high	78 Å²	78	47 Å²	47	80%	0.804	31%	0.314	S	S	*	.	S	Bend	trans	83	2.5	177.5	0	0	0	0	0	115.9
19	F	91.6	Very high	95.7	Very high	41 Å²	41	46.2 Å²	46.2	18%	0.18	30%	0.304	C	S	.	.	S	Bend	trans	-155.9	162.8	173.1	61.7	-86	0	0	0	111.7	A16 S17 F21 Y24 M26 R90	A16-F19 HydrophobicContact CB-CE1 4.1Å; A16-F19 HydrophobicContact CB-CE2 4.36Å; A16-F19 HydrophobicContact CB-CZ 3.7Å; S17-F19 WeakPolarHBondContact O-CD1 3.48Å; S17-F19 PolarHBondContact O-N 3.17Å; F19-F21 HydrophobicContact CE2-CB 4.4Å; F19-F21 HydrophobicContact CE2-CD2 4.28Å; F19-F21 PolarHBondContact O-N 2.78Å; F19-Y24 HydrophobicContact CB-CE2 4.32Å; F19-Y24 AromaticContact CD2-CD2 3.64Å; F19-Y24 HydrophobicContact CD2-CD2 3.64Å; F19-Y24 HydrophobicContact CD2-CE2 4.02Å; F19-Y24 HydrophobicContact CD2-CG 4.49Å; F19-Y24 HydrophobicContact CE2-CD2 4.2Å; F19-M26 HydrophobicContact CE2-SD 4.06Å; F19-M26 HydrophobicContact CZ-CE 4.25Å; F19-M26 HydrophobicContact CZ-SD 4.12Å; F19-R90 HydrophobicContact CE2-CG 4.13Å; F19-R90 HydrophobicContact CZ-CB 4.3Å; F19-R90 HydrophobicContact CZ-CG 4.33Å
20	T	94.1	Very high	95.6	Very high	85 Å²	85	43 Å²	43	52%	0.521	28%	0.279	S	S	.	.			trans	-72.1	92.4	174.3	-50.6	0	0	0	0	110.3	S22 S23 Y24	T20-S22 VanDerWaalsContact C-N 3.25Å; T20-S22 PolarHBondContact O-N 3.21Å; T20-S23 VanDerWaalsContact CG2-OG 3.25Å; T20-S23 WeakPolarHBondContact CG2-OG 3.31Å; T20-S23 WeakPolarHBondContact O-CB 3.44Å; T20-S23 PolarHBondContact O-N 3Å; T20-Y24 VanDerWaalsContact O-CD2 3.26Å; T20-Y24 WeakPolarHBondContact O-CD2 3.33Å
21	F	94.9	Very high	95.5	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-51.8	-40.5	-174.9	177.8	-103.3	0	0	0	113.7	A16 F19 S23 Y24 M26 R64 N66 N69 L71	A16-F21 HydrophobicContact CB-CB 4.38Å; A16-F21 HydrophobicContact CB-CD2 3.44Å; A16-F21 VanDerWaalsContact CB-CD2 3.44Å; A16-F21 HydrophobicContact CB-CE2 4.06Å; A16-F21 HydrophobicContact CB-CG 4.24Å; F19-F21 HydrophobicContact CE2-CB 4.4Å; F19-F21 HydrophobicContact CE2-CD2 4.28Å; F19-F21 PolarHBondContact O-N 2.78Å; F21-S23 PolarHBondContact O-N 2.95Å; F21-Y24 PolarHBondContact O-N 2.79Å; F21-M26 HydrophobicContact CD2-CE 4.36Å; F21-M26 HydrophobicContact CD2-CG 4.05Å; F21-M26 HydrophobicContact CD2-SD 4.04Å; F21-M26 HydrophobicContact CE2-CE 3.98Å; F21-M26 HydrophobicContact CE2-CG 3.51Å; F21-M26 HydrophobicContact CE2-SD 3.94Å; F21-M26 HydrophobicContact CZ-CG 4.05Å; F21-R64 HydrophobicContact CE1-CB 4.1Å; F21-R64 VanDerWaalsContact CE1-NH2 3.25Å; F21-R64 HydrophobicContact CZ-CB 4.15Å; F21-R64 PolarHBondContact O-NH2 2.83Å; F21-N66 WeakPolarHBondContact CD1-OD1 3.26Å; F21-N66 WeakPolarHBondContact CE1-OD1 3.4Å; F21-N69 HydrophobicContact CB-CB 3.93Å; F21-N69 WeakPolarHBondContact CB-OD1 3.17Å; F21-N69 HydrophobicContact CD1-CB 4.45Å; F21-N69 HydrophobicContact CG-CB 4.2Å; F21-L71 HydrophobicContact CE2-CB 4.3Å; F21-L71 HydrophobicContact CZ-CB 4.15Å
22	S	94.9	Very high	95.2	Very high	54 Å²	54	40.4 Å²	40.4	38%	0.378	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-66.7	-12.1	178.5	56.5	0	0	0	0	114.7	T20 S45	T20-S22 VanDerWaalsContact C-N 3.25Å; T20-S22 PolarHBondContact O-N 3.21Å; S22-S45 WeakPolarHBondContact O-CB 3.16Å
23	S	93.8	Very high	94.5	Very high	72 Å²	72	45 Å²	45	50%	0.503	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-88.4	-11.4	178	-56.8	0	0	0	0	113.6	T20 F21	T20-S23 VanDerWaalsContact CG2-OG 3.25Å; T20-S23 WeakPolarHBondContact CG2-OG 3.31Å; T20-S23 WeakPolarHBondContact O-CB 3.44Å; T20-S23 PolarHBondContact O-N 3Å; F21-S23 PolarHBondContact O-N 2.95Å
24	Y	94.6	Very high	93.7	Very high	74 Å²	74	49.4 Å²	49.4	29%	0.29	31%	0.312	S	S	.	.	S	Bend	trans	-123.3	146.2	-172	-60.9	-87.2	0	0	0	112.7	F19 T20 F21 S45 R64 R90	F19-Y24 HydrophobicContact CB-CE2 4.32Å; F19-Y24 AromaticContact CD2-CD2 3.64Å; F19-Y24 HydrophobicContact CD2-CD2 3.64Å; F19-Y24 HydrophobicContact CD2-CE2 4.02Å; F19-Y24 HydrophobicContact CD2-CG 4.49Å; F19-Y24 HydrophobicContact CE2-CD2 4.2Å; T20-Y24 VanDerWaalsContact O-CD2 3.26Å; T20-Y24 WeakPolarHBondContact O-CD2 3.33Å; F21-Y24 PolarHBondContact O-N 2.79Å; Y24-S45 VanDerWaalsContact O-CA 3.3Å; Y24-S45 WeakPolarHBondContact O-CA 3.47Å; Y24-R64 PolarHBondContact O-NH1 3.06Å; Y24-R90 HydrophobicContact CD1-CG 4.02Å; Y24-R90 HydrophobicContact CG-CG 3.82Å
25	A	95.3	Very high	92.4	Very high	19 Å²	19	56.9 Å²	56.9	16%	0.157	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	147.2	162.4	0	0	0	0	0	109.2	I43 K91	A25-I43 VanDerWaalsContact CA-O 3.27Å; A25-I43 WeakPolarHBondContact CA-O 3.34Å; A25-I43 WeakPolarHBondContact CB-O 3.33Å; A25-K91 HydrophobicContact CB-CB 4.2Å; A25-K91 HydrophobicContact CB-CD 4.47Å; A25-K91 PolarHBondContact O-N 3.25Å
26	M	97	Very high	91.9	Very high	4 Å²	4	62.1 Å²	62.1	2%	0.02	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	148.5	-175.7	-64	-62.1	-56.5	0	0	109.4	F19 F21 E42 I43 L71 A89 R90	F19-M26 HydrophobicContact CE2-SD 4.06Å; F19-M26 HydrophobicContact CZ-CE 4.25Å; F19-M26 HydrophobicContact CZ-SD 4.12Å; F21-M26 HydrophobicContact CD2-CE 4.36Å; F21-M26 HydrophobicContact CD2-CG 4.05Å; F21-M26 HydrophobicContact CD2-SD 4.04Å; F21-M26 HydrophobicContact CE2-CE 3.98Å; F21-M26 HydrophobicContact CE2-CG 3.51Å; F21-M26 HydrophobicContact CE2-SD 3.94Å; F21-M26 HydrophobicContact CZ-CG 4.05Å; M26-E42 CarbonylContact O-C 3.59Å; M26-E42 WeakPolarHBondContact O-CA 3.31Å; M26-I43 HydrophobicContact CB-CG2 4.16Å; M26-I43 PolarHBondContact N-O 3Å; M26-I43 PolarHBondContact O-N 3.04Å; M26-L71 HydrophobicContact CB-CD1 3.74Å; M26-L71 HydrophobicContact CB-CD2 3.92Å; M26-L71 HydrophobicContact CB-CG 4.38Å; M26-A89 WeakPolarHBondContact CA-O 3.36Å; M26-A89 WeakPolarHBondContact CE-O 3.28Å; M26-R90 HydrophobicContact CE-CB 4.42Å; M26-R90 HydrophobicContact SD-CB 4.06Å; M26-R90 HydrophobicContact SD-CG 4.12Å
27	S	97	Very high	91.8	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	150.6	-172.4	-47.5	0	0	0	0	111	W39 A41 C88 A89 M97	S27-W39 WeakPolarHBondContact OG-CZ2 3.48Å; S27-A41 CarbonylContact C-O 3.6Å; S27-A41 WeakPolarHBondContact CA-O 3.38Å; S27-C88 CarbonylContact O-C 3.59Å; S27-C88 VanDerWaalsContact O-CA 3.27Å; S27-C88 WeakPolarHBondContact O-CA 3.02Å; S27-A89 PolarHBondContact N-O 2.94Å; S27-A89 PolarHBondContact O-N 3.37Å; S27-M97 VanDerWaalsContact CB-CE 3.46Å
28	W	97.6	Very high	91.7	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.015	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.9	160.4	-76.2	98	0	0	0	108.9	L12 C14 V40 A41 L71 Y72 L73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 3.78Å; L12-W28 HydrophobicContact CB-CZ2 3.98Å; L12-W28 HydrophobicContact CB-CZ3 4.36Å; L12-W28 HydrophobicContact CD1-CE3 4.49Å; L12-W28 HydrophobicContact CD1-CH2 4.37Å; L12-W28 HydrophobicContact CD1-CZ3 4.11Å; C14-W28 HydrophobicContact CB-CH2 3.87Å; C14-W28 HydrophobicContact CB-CZ2 3.89Å; W28-V40 HydrophobicContact CB-CB 4.05Å; W28-V40 HydrophobicContact CB-CG1 4.45Å; W28-V40 WeakPolarHBondContact O-CA 3.41Å; W28-V40 WeakPolarHBondContact O-CB 3.26Å; W28-V40 PolarHBondContact O-N 3.13Å; W28-A41 PolarHBondContact N-O 3.07Å; W28-A41 PolarHBondContact O-N 2.98Å; W28-L71 HydrophobicContact CD2-CD2 4.44Å; W28-L71 HydrophobicContact CG-CD2 4.32Å; W28-L71 HydrophobicContact CZ2-CD2 4.5Å; W28-L71 VanDerWaalsContact NE1-CD2 3.3Å; W28-Y72 PolarHBondContact NE1-O 2.92Å; W28-L73 HydrophobicContact CB-CD2 4.18Å; W28-L73 HydrophobicContact CD2-CB 4.14Å; W28-L73 HydrophobicContact CD2-CD2 4.29Å; W28-L73 HydrophobicContact CG-CB 4.11Å; W28-L73 HydrophobicContact CG-CD1 4.41Å; W28-L73 HydrophobicContact CG-CD2 4.01Å; W28-L73 HydrophobicContact CG-CG 4.42Å; W28-L73 HydrophobicContact CZ2-CB 4.38Å; W28-Y87 CarbonylContact C-O 3.39Å; W28-Y87 WeakPolarHBondContact CA-O 3.48Å; W28-Y87 VanDerWaalsContact CE3-C 3.5Å; W28-C88 HydrophobicContact CD2-CB 4.46Å; W28-C88 HydrophobicContact CE3-CB 4.34Å; W28-C88 HydrophobicContact CH2-CB 4.27Å; W28-C88 HydrophobicContact CZ2-CB 4.38Å; W28-C88 HydrophobicContact CZ3-CB 4.24Å
29	V	96.4	Very high	91.8	Very high	5 Å²	5	64.9 Å²	64.9	3%	0.03	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	142.7	175	-176.3	0	0	0	0	106.8	L37 E38 Y86 Y87 M97 W100	V29-L37 HydrophobicContact CG1-CB 4.24Å; V29-L37 HydrophobicContact CG1-CD2 3.91Å; V29-E38 CarbonylContact C-O 3.46Å; V29-E38 WeakPolarHBondContact CA-O 3.34Å; V29-E38 VanDerWaalsContact CG1-O 3.31Å; V29-E38 WeakPolarHBondContact CG1-O 3.37Å; V29-Y86 CarbonylContact O-C 3.58Å; V29-Y87 PolarHBondContact N-O 3.06Å; V29-Y87 PolarHBondContact O-N 3.12Å; V29-M97 HydrophobicContact CG2-CE 3.64Å; V29-M97 HydrophobicContact CG2-SD 4.09Å; V29-W100 HydrophobicContact CB-CH2 4Å; V29-W100 HydrophobicContact CB-CZ3 3.74Å; V29-W100 HydrophobicContact CG1-CH2 3.88Å; V29-W100 HydrophobicContact CG1-CZ3 3.88Å; V29-W100 HydrophobicContact CG2-CH2 3.88Å; V29-W100 HydrophobicContact CG2-CZ3 4.01Å
30	R	96	Very high	92.1	Very high	16 Å²	16	63 Å²	63	6%	0.06	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.9	174	72.7	-178.7	-177.8	-175.6	2.3	111.4	L37 E38 V40 D82 A84 M85 Y86	R30-L37 CarbonylContact O-C 3.54Å; R30-L37 WeakPolarHBondContact O-CA 3.19Å; R30-E38 HydrophobicContact CG-CB 4Å; R30-E38 IonicContact CZ-OE2 3.41Å; R30-E38 PolarHBondContact N-O 3.41Å; R30-E38 IonicContact NE-OE2 2.84Å; R30-E38 PolarHBondContact NE-OE2 3.24Å; R30-E38 IonicContact NH2-OE2 2.69Å; R30-E38 PolarHBondContact NH2-OE2 2.98Å; R30-E38 PolarHBondContact O-N 3.02Å; R30-V40 HydrophobicContact CB-CG2 3.75Å; R30-V40 HydrophobicContact CG-CG2 3.56Å; R30-D82 IonicContact CZ-OD1 3.32Å; R30-D82 IonicContact NH1-OD1 2.81Å; R30-D82 PolarHBondContact NH1-OD1 2.8Å; R30-A84 HydrophobicContact CB-CB 3.85Å; R30-A84 HydrophobicContact CG-CB 4.17Å; R30-M85 CarbonylContact C-O 3.55Å; R30-M85 WeakPolarHBondContact CA-O 3.48Å; R30-Y86 HydrophobicContact CB-CD1 3.92Å; R30-Y86 HydrophobicContact CB-CD2 4.3Å; R30-Y86 HydrophobicContact CB-CE1 3.9Å; R30-Y86 HydrophobicContact CB-CE2 4.26Å; R30-Y86 HydrophobicContact CB-CG 4.12Å; R30-Y86 PolarHBondContact NH1-OH 2.69Å
31	Q	95.4	Very high	92.2	Very high	69 Å²	69	59 Å²	59	32%	0.322	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	112.2	170.6	-166.8	176.4	30.9	0	0	109	R36 L37 A84 M85 Y87	Q31-R36 WeakPolarHBondContact CA-O 3.48Å; Q31-L37 HydrophobicContact CB-CD2 3.83Å; Q31-L37 HydrophobicContact CG-CD2 4.18Å; Q31-A84 WeakPolarHBondContact O-CA 3.5Å; Q31-A84 VanDerWaalsContact O-CB 3.26Å; Q31-A84 WeakPolarHBondContact O-CB 3.43Å; Q31-M85 PolarHBondContact N-O 2.77Å; Q31-M85 PolarHBondContact O-N 2.86Å; Q31-Y87 HydrophobicContact CB-CE2 3.97Å
32	S	89.8	Confident	92.3	Very high	21 Å²	21	60.1 Å²	60.1	15%	0.147	29%	0.294	C	S	.	.			trans	-69.7	159.4	174.8	66.9	0	0	0	0	110.8	E34 K35 R36	S32-E34 PolarHBondContact O-N 2.84Å; S32-K35 PolarHBondContact O-N 2.93Å; S32-R36 PolarHBondContact N-O 2.78Å
33	P	84.2	Confident	92.4	Very high	103 Å²	103	57.9 Å²	57.9	67%	0.669	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-27.1	174.4	-27.1	35.1	0	0	0	113.5	K35 T83	P33-K35 PolarHBondContact O-N 3.35Å; P33-T83 WeakPolarHBondContact CD-O 3.05Å
34	E	81.3	Confident	92.5	Very high	175 Å²	175	55.6 Å²	55.6	82%	0.818	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	12.7	176.3	-59.9	-179.1	-175.7	0	0	113.6	S32 R36	S32-E34 PolarHBondContact O-N 2.84Å; E34-R36 PolarHBondContact O-N 3.03Å
35	K	70.7	Confident	92.4	Very high	175 Å²	175	54.5 Å²	54.5	76%	0.761	27%	0.265	S	S	*	.	S	Bend	trans	72.1	8.9	169	-56.4	-176.9	178.5	179.5	0	117.2	S32 P33	S32-K35 PolarHBondContact O-N 2.93Å; P33-K35 PolarHBondContact O-N 3.35Å
36	R	85.6	Confident	92	Very high	190 Å²	190	56.2 Å²	56.2	72%	0.717	29%	0.285	S	S	*	.			trans	-86.3	132.1	174.2	-69.5	-173.5	177.6	-171.2	0.2	111.6	Q31 S32 E34	Q31-R36 WeakPolarHBondContact CA-O 3.48Å; S32-R36 PolarHBondContact N-O 2.78Å; E34-R36 PolarHBondContact O-N 3.03Å
37	L	91.6	Very high	91.8	Very high	103 Å²	103	57.6 Å²	57.6	54%	0.539	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	126.8	166.1	-74.6	169.2	0	0	0	108.9	V29 R30 Q31 W100	V29-L37 HydrophobicContact CG1-CB 4.24Å; V29-L37 HydrophobicContact CG1-CD2 3.91Å; R30-L37 CarbonylContact O-C 3.54Å; R30-L37 WeakPolarHBondContact O-CA 3.19Å; Q31-L37 HydrophobicContact CB-CD2 3.83Å; Q31-L37 HydrophobicContact CG-CD2 4.18Å; L37-W100 HydrophobicContact CD2-CZ3 4.49Å
38	E	93.2	Very high	91.7	Very high	65 Å²	65	63.1 Å²	63.1	30%	0.304	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.6	-178.9	-64.3	-179.4	171	0	0	109.2	V29 R30	V29-E38 CarbonylContact C-O 3.46Å; V29-E38 WeakPolarHBondContact CA-O 3.34Å; V29-E38 VanDerWaalsContact CG1-O 3.31Å; V29-E38 WeakPolarHBondContact CG1-O 3.37Å; R30-E38 HydrophobicContact CG-CB 4Å; R30-E38 IonicContact CZ-OE2 3.41Å; R30-E38 PolarHBondContact N-O 3.41Å; R30-E38 IonicContact NE-OE2 2.84Å; R30-E38 PolarHBondContact NE-OE2 3.24Å; R30-E38 IonicContact NH2-OE2 2.69Å; R30-E38 PolarHBondContact NH2-OE2 2.98Å; R30-E38 PolarHBondContact O-N 3.02Å
39	W	93.4	Very high	91.5	Very high	87 Å²	87	69.2 Å²	69.2	33%	0.33	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	138.5	169.3	-153.7	-73	0	0	0	109.5	S27 A41 E42 P53 K91 M97	S27-W39 WeakPolarHBondContact OG-CZ2 3.48Å; W39-A41 PolarHBondContact NE1-O 3.04Å; W39-E42 HydrophobicContact CZ2-CB 3.98Å; W39-E42 HydrophobicContact CZ2-CG 4.25Å; W39-E42 WeakPolarHBondContact CZ2-OE2 3.35Å; W39-P53 WeakPolarHBondContact O-CG 2.91Å; W39-K91 HydrophobicContact CH2-CD 4.35Å; W39-M97 HydrophobicContact CD2-CE 4.36Å; W39-M97 HydrophobicContact CE3-CE 3.89Å; W39-M97 HydrophobicContact CH2-CE 3.11Å; W39-M97 HydrophobicContact CH2-SD 4.18Å; W39-M97 HydrophobicContact CZ2-CE 3.59Å; W39-M97 HydrophobicContact CZ3-CE 3.26Å; W39-M97 HydrophobicContact CZ3-SD 3.86Å
40	V	96.4	Very high	91.6	Very high	1 Å²	1	70.8 Å²	70.8	1%	0.006	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-47.4	179.8	179.4	0	0	0	0	111.2	W28 R30 P53 V56 F60 L73 Y86	W28-V40 HydrophobicContact CB-CB 4.05Å; W28-V40 HydrophobicContact CB-CG1 4.45Å; W28-V40 WeakPolarHBondContact O-CA 3.41Å; W28-V40 WeakPolarHBondContact O-CB 3.26Å; W28-V40 PolarHBondContact O-N 3.13Å; R30-V40 HydrophobicContact CB-CG2 3.75Å; R30-V40 HydrophobicContact CG-CG2 3.56Å; V40-P53 WeakPolarHBondContact O-CD 3.19Å; V40-V56 HydrophobicContact CG1-CG2 4.45Å; V40-V56 VanDerWaalsContact O-CG2 3.29Å; V40-V56 WeakPolarHBondContact O-CG2 3.41Å; V40-F60 HydrophobicContact CG1-CD2 3.61Å; V40-F60 HydrophobicContact CG1-CE2 4.02Å; V40-L73 HydrophobicContact CG1-CD1 4.44Å; V40-L73 HydrophobicContact CG1-CD2 3.89Å; V40-Y86 HydrophobicContact CG1-CE1 4.32Å; V40-Y86 HydrophobicContact CG2-CD1 4.42Å; V40-Y86 HydrophobicContact CG2-CE1 4.07Å
41	A	97.4	Very high	91.6	Very high	0 Å²	0	75.2 Å²	75.2	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	153.2	176.9	0	0	0	0	0	110.7	S27 W28 W39 Y51 Y52 I62 L73	S27-A41 CarbonylContact C-O 3.6Å; S27-A41 WeakPolarHBondContact CA-O 3.38Å; W28-A41 PolarHBondContact N-O 3.07Å; W28-A41 PolarHBondContact O-N 2.98Å; W39-A41 PolarHBondContact NE1-O 3.04Å; A41-Y51 CarbonylContact C-O 3.51Å; A41-Y51 VanDerWaalsContact CA-O 3.28Å; A41-Y51 WeakPolarHBondContact CA-O 3.33Å; A41-Y52 HydrophobicContact CB-CD1 3.77Å; A41-Y52 HydrophobicContact CB-CE1 3.81Å; A41-I62 HydrophobicContact CB-CB 3.75Å; A41-I62 HydrophobicContact CB-CD1 3.87Å; A41-I62 HydrophobicContact CB-CG1 4.36Å; A41-I62 HydrophobicContact CB-CG2 3.91Å; A41-L73 HydrophobicContact CB-CD1 4.24Å
42	E	96.4	Very high	91.7	Very high	25 Å²	25	74.7 Å²	74.7	12%	0.117	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144.4	169.7	-178.6	177.3	130.4	0	0	109.8	M26 W39 A50 Y51 K91	M26-E42 CarbonylContact O-C 3.59Å; M26-E42 WeakPolarHBondContact O-CA 3.31Å; W39-E42 HydrophobicContact CZ2-CB 3.98Å; W39-E42 HydrophobicContact CZ2-CG 4.25Å; W39-E42 WeakPolarHBondContact CZ2-OE2 3.35Å; E42-A50 CarbonylContact O-C 3.51Å; E42-A50 WeakPolarHBondContact O-CA 3.09Å; E42-Y51 PolarHBondContact N-O 2.84Å; E42-Y51 PolarHBondContact O-N 3.04Å; E42-K91 IonicContact OE1-NZ 2.87Å; E42-K91 PolarHBondContact OE1-NZ 3.27Å; E42-K91 WeakPolarHBondContact OE2-CD 3.24Å; E42-K91 WeakPolarHBondContact OE2-CE 3.36Å; E42-K91 IonicContact OE2-NZ 2.88Å; E42-K91 PolarHBondContact OE2-NZ 3.35Å
43	I	97.3	Very high	91.9	Very high	8 Å²	8	74.7 Å²	74.7	4%	0.041	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134.6	171.6	-169.2	162.6	0	0	0	110.2	A25 M26 Y49 I62 R64 L71	A25-I43 VanDerWaalsContact CA-O 3.27Å; A25-I43 WeakPolarHBondContact CA-O 3.34Å; A25-I43 WeakPolarHBondContact CB-O 3.33Å; M26-I43 HydrophobicContact CB-CG2 4.16Å; M26-I43 PolarHBondContact N-O 3Å; M26-I43 PolarHBondContact O-N 3.04Å; I43-Y49 WeakPolarHBondContact CA-O 3.01Å; I43-I62 HydrophobicContact CB-CD1 3.95Å; I43-I62 HydrophobicContact CB-CG1 4.17Å; I43-I62 HydrophobicContact CB-CG2 3.97Å; I43-I62 HydrophobicContact CD1-CG2 4.48Å; I43-I62 HydrophobicContact CG2-CD1 3.71Å; I43-I62 HydrophobicContact CG2-CG1 4.02Å; I43-R64 HydrophobicContact CD1-CB 4.3Å; I43-R64 HydrophobicContact CD1-CG 3.79Å; I43-R64 HydrophobicContact CG1-CG 4.43Å; I43-R64 HydrophobicContact CG2-CB 4.49Å; I43-L71 HydrophobicContact CG2-CD1 3.56Å
44	S	95.5	Very high	92.4	Very high	23 Å²	23	77.1 Å²	77.1	16%	0.161	40%	0.396	C	S	.	.			trans	-64.4	162.1	179	70.7	0	0	0	0	112	G46 G47 S48 Y49 R64	S44-G46 PolarHBondContact O-N 3.06Å; S44-G47 PolarHBondContact O-N 2.99Å; S44-G47 PolarHBondContact OG-N 3.13Å; S44-S48 PolarHBondContact OG-N 3.07Å; S44-S48 PolarHBondContact OG-OG 2.8Å; S44-Y49 PolarHBondContact N-O 2.97Å; S44-Y49 PolarHBondContact OG-N 2.83Å; S44-R64 PolarHBondContact O-NH1 3Å
45	S	92.6	Very high	92.9	Very high	51 Å²	51	72.7 Å²	72.7	36%	0.357	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-39.8	179.2	55.8	0	0	0	0	114	S22 Y24 R64	S22-S45 WeakPolarHBondContact O-CB 3.16Å; Y24-S45 VanDerWaalsContact O-CA 3.3Å; Y24-S45 WeakPolarHBondContact O-CA 3.47Å; S45-R64 PolarHBondContact O-NE 3.39Å; S45-R64 PolarHBondContact O-NH1 3.1Å; S45-R64 VanDerWaalsContact O-NH1 3.08Å; S45-R64 PolarHBondContact O-NH2 3.27Å
46	G	87.4	Confident	94.1	Very high	56 Å²	56	64.4 Å²	64.4	58%	0.577	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-8.8	176.2	0	0	0	0	0	115.1	S44 S48	S44-G46 PolarHBondContact O-N 3.06Å; G46-S48 VanDerWaalsContact C-N 3.26Å; G46-S48 PolarHBondContact O-N 3.43Å
47	G	93.1	Very high	94.5	Very high	32 Å²	32	59 Å²	59	33%	0.33	33%	0.333	S	S	.	.	S	Bend	trans	77.2	5.5	-176.4	0	0	0	0	0	115.3	S44 Y49	S44-G47 PolarHBondContact O-N 2.99Å; S44-G47 PolarHBondContact OG-N 3.13Å; G47-Y49 VanDerWaalsContact C-N 3.29Å; G47-Y49 PolarHBondContact O-N 3.32Å
48	S	93.3	Very high	94.7	Very high	116 Å²	116	57.8 Å²	57.8	81%	0.811	35%	0.346	S	S	*	.	S	Bend	trans	-73.6	-19.7	-178.7	55.6	0	0	0	0	114.1	S44 G46	S44-S48 PolarHBondContact OG-N 3.07Å; S44-S48 PolarHBondContact OG-OG 2.8Å; G46-S48 VanDerWaalsContact C-N 3.26Å; G46-S48 PolarHBondContact O-N 3.43Å
49	Y	95.3	Very high	94.9	Very high	133 Å²	133	55.7 Å²	55.7	52%	0.522	34%	0.335	S	S	.	.			trans	-135	135.5	-177.6	176	-96.2	0	0	0	109.8	I43 S44 G47	I43-Y49 WeakPolarHBondContact CA-O 3.01Å; S44-Y49 PolarHBondContact N-O 2.97Å; S44-Y49 PolarHBondContact OG-N 2.83Å; G47-Y49 VanDerWaalsContact C-N 3.29Å; G47-Y49 PolarHBondContact O-N 3.32Å
50	A	97.2	Very high	95.1	Very high	38 Å²	38	51.8 Å²	51.8	31%	0.314	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.4	172.3	0	0	0	0	0	110.3	E42 Y52 I62	E42-A50 CarbonylContact O-C 3.51Å; E42-A50 WeakPolarHBondContact O-CA 3.09Å; A50-Y52 HydrophobicContact CB-CE2 3.79Å; A50-I62 HydrophobicContact CB-CG2 3.85Å
51	Y	96.2	Very high	95.2	Very high	109 Å²	109	55.1 Å²	55.1	43%	0.427	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.8	175.5	171	-96.5	0	0	0	110.2	A41 E42	A41-Y51 CarbonylContact C-O 3.51Å; A41-Y51 VanDerWaalsContact CA-O 3.28Å; A41-Y51 WeakPolarHBondContact CA-O 3.33Å; E42-Y51 PolarHBondContact N-O 2.84Å; E42-Y51 PolarHBondContact O-N 3.04Å
52	Y	97.1	Very high	95.2	Very high	57 Å²	57	55.5 Å²	55.5	22%	0.224	34%	0.343	C	S	.	.			trans	-135.7	136.9	176.6	-54.9	-87.3	0	0	0	109.3	A41 A50 F60 T61 I62	A41-Y52 HydrophobicContact CB-CD1 3.77Å; A41-Y52 HydrophobicContact CB-CE1 3.81Å; A50-Y52 HydrophobicContact CB-CE2 3.79Å; Y52-F60 VanDerWaalsContact CE1-O 3.29Å; Y52-F60 WeakPolarHBondContact CE1-O 3.48Å; Y52-T61 WeakPolarHBondContact OH-CA 3.37Å; Y52-I62 HydrophobicContact CE1-CB 4.28Å; Y52-I62 HydrophobicContact CE1-CG2 3.9Å; Y52-I62 WeakPolarHBondContact OH-CG2 3.44Å; Y52-I62 PolarHBondContact OH-N 3.49Å
53	P	95.2	Very high	95.3	Very high	22 Å²	22	56.1 Å²	56.1	14%	0.143	35%	0.35	C	S	.	.			trans	-75.3	153.5	166.9	30	-28.1	0	0	0	111.1	W39 V40 T55 V56 T57	W39-P53 WeakPolarHBondContact O-CG 2.91Å; V40-P53 WeakPolarHBondContact O-CD 3.19Å; P53-T55 PolarHBondContact O-N 3.08Å; P53-V56 HydrophobicContact CG-CG2 3.98Å; P53-V56 PolarHBondContact O-N 3.2Å; P53-T57 PolarHBondContact O-N 2.74Å; P53-T57 VanDerWaalsContact O-N 3.13Å; P53-T57 PolarHBondContact O-OG1 2.95Å
54	D	94.3	Very high	95.3	Very high	154 Å²	154	57.4 Å²	57.4	82%	0.824	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-26.7	-176.2	-64	-22.6	0	0	0	114.2	V56	D54-V56 PolarHBondContact O-N 2.81Å
55	T	92.1	Very high	95.4	Very high	82 Å²	82	58.2 Å²	58.2	50%	0.503	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.9	179	55	0	0	0	0	113.6	P53 R59	P53-T55 PolarHBondContact O-N 3.08Å; T55-R59 PolarHBondContact O-NH2 3.36Å
56	V	95.2	Very high	95.6	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.006	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-6.4	-176.5	-56.1	0	0	0	0	113.8	V40 P53 D54 G58 R59 F60	V40-V56 HydrophobicContact CG1-CG2 4.45Å; V40-V56 VanDerWaalsContact O-CG2 3.29Å; V40-V56 WeakPolarHBondContact O-CG2 3.41Å; P53-V56 HydrophobicContact CG-CG2 3.98Å; P53-V56 PolarHBondContact O-N 3.2Å; D54-V56 PolarHBondContact O-N 2.81Å; V56-G58 PolarHBondContact O-N 2.67Å; V56-R59 PolarHBondContact O-N 3.2Å; V56-F60 HydrophobicContact CB-CB 4.18Å; V56-F60 HydrophobicContact CB-CD2 3.63Å; V56-F60 HydrophobicContact CB-CE2 4.07Å; V56-F60 HydrophobicContact CB-CG 3.89Å; V56-F60 HydrophobicContact CG1-CD2 3.65Å; V56-F60 HydrophobicContact CG1-CE2 3.59Å; V56-F60 HydrophobicContact CG1-CG 4.34Å; V56-F60 HydrophobicContact CG1-CZ 4.23Å; V56-F60 HydrophobicContact CG2-CB 4.43Å; V56-F60 HydrophobicContact CG2-CD2 4.21Å; V56-F60 PolarHBondContact O-N 2.85Å; V56-F60 VanDerWaalsContact O-N 3.1Å
57	T	94.4	Very high	96	Very high	76 Å²	76	60.6 Å²	60.6	47%	0.466	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	132.8	175.3	-64.8	0	0	0	0	111.2	P53 R59	P53-T57 PolarHBondContact O-N 2.74Å; P53-T57 VanDerWaalsContact O-N 3.13Å; P53-T57 PolarHBondContact O-OG1 2.95Å; T57-R59 PolarHBondContact O-N 3.25Å
58	G	94.8	Very high	96.2	Very high	78 Å²	78	65.4 Å²	65.4	80%	0.804	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-3.8	-178.6	0	0	0	0	0	115.2	V56	V56-G58 PolarHBondContact O-N 2.67Å
59	R	97.5	Very high	96.3	Very high	20 Å²	20	63 Å²	63	8%	0.075	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-39.6	178.3	-60.1	-169	-57.5	116.4	-1.1	112.5	T55 V56 T57 S76 S77 D82	T55-R59 PolarHBondContact O-NH2 3.36Å; V56-R59 PolarHBondContact O-N 3.2Å; T57-R59 PolarHBondContact O-N 3.25Å; R59-S76 WeakPolarHBondContact O-CB 3.28Å; R59-S76 PolarHBondContact O-N 2.85Å; R59-S76 PolarHBondContact O-OG 3.08Å; R59-S77 PolarHBondContact NH1-O 3.33Å; R59-D82 IonicContact CZ-OD1 2.67Å; R59-D82 IonicContact CZ-OD2 3.86Å; R59-D82 IonicContact NH1-OD1 2.61Å; R59-D82 IonicContact NH1-OD2 3.72Å; R59-D82 PolarHBondContact NH1-OD2 3.29Å; R59-D82 IonicContact NH2-OD1 3.6Å; R59-D82 PolarHBondContact NH2-OD1 3.2Å; R59-D82 IonicContact NH2-OD2 3.03Å; R59-D82 PolarHBondContact NH2-OD2 2.86Å
60	F	98.1	Very high	96.5	Very high	5 Å²	5	57.4 Å²	57.4	2%	0.022	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.5	-175.9	-64.3	3.9	0	0	0	111.1	V40 Y52 V56 L73 E74 M75 L78 D82 Y86	V40-F60 HydrophobicContact CG1-CD2 3.61Å; V40-F60 HydrophobicContact CG1-CE2 4.02Å; Y52-F60 VanDerWaalsContact CE1-O 3.29Å; Y52-F60 WeakPolarHBondContact CE1-O 3.48Å; V56-F60 HydrophobicContact CB-CB 4.18Å; V56-F60 HydrophobicContact CB-CD2 3.63Å; V56-F60 HydrophobicContact CB-CE2 4.07Å; V56-F60 HydrophobicContact CB-CG 3.89Å; V56-F60 HydrophobicContact CG1-CD2 3.65Å; V56-F60 HydrophobicContact CG1-CE2 3.59Å; V56-F60 HydrophobicContact CG1-CG 4.34Å; V56-F60 HydrophobicContact CG1-CZ 4.23Å; V56-F60 HydrophobicContact CG2-CB 4.43Å; V56-F60 HydrophobicContact CG2-CD2 4.21Å; V56-F60 PolarHBondContact O-N 2.85Å; V56-F60 VanDerWaalsContact O-N 3.1Å; F60-L73 HydrophobicContact CB-CD1 4.26Å; F60-L73 HydrophobicContact CD2-CD2 4.34Å; F60-E74 CarbonylContact C-O 3.46Å; F60-E74 VanDerWaalsContact CA-O 3.25Å; F60-E74 WeakPolarHBondContact CA-O 3.49Å; F60-M75 HydrophobicContact CD1-CB 3.84Å; F60-M75 HydrophobicContact CD1-CG 4Å; F60-M75 HydrophobicContact CD2-CG 4.12Å; F60-M75 HydrophobicContact CE1-CB 3.78Å; F60-M75 HydrophobicContact CE1-CE 4.41Å; F60-M75 HydrophobicContact CE1-CG 4.05Å; F60-M75 HydrophobicContact CE2-CE 4.1Å; F60-M75 HydrophobicContact CE2-CG 4.15Å; F60-M75 HydrophobicContact CG-CB 4.4Å; F60-M75 HydrophobicContact CG-CG 4.08Å; F60-M75 HydrophobicContact CZ-CB 4.26Å; F60-M75 HydrophobicContact CZ-CE 3.82Å; F60-M75 HydrophobicContact CZ-CG 4.13Å; F60-L78 HydrophobicContact CE1-CD2 3.76Å; F60-L78 HydrophobicContact CZ-CD2 3.75Å; F60-D82 HydrophobicContact CZ-CB 4.23Å; F60-Y86 HydrophobicContact CE2-CE1 4.41Å
61	T	98.3	Very high	96.5	Very high	72 Å²	72	55.6 Å²	55.6	44%	0.442	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	118.1	179.2	-56.9	0	0	0	0	109.3	Y52 E74	Y52-T61 WeakPolarHBondContact OH-CA 3.37Å; T61-E74 PolarHBondContact N-O 2.94Å; T61-E74 PolarHBondContact O-N 2.79Å
62	I	98.5	Very high	96.6	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.036	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	137.6	171.7	-167.8	170.4	0	0	0	109.3	A41 I43 A50 Y52 L71 Y72 L73	A41-I62 HydrophobicContact CB-CB 3.75Å; A41-I62 HydrophobicContact CB-CD1 3.87Å; A41-I62 HydrophobicContact CB-CG1 4.36Å; A41-I62 HydrophobicContact CB-CG2 3.91Å; I43-I62 HydrophobicContact CB-CD1 3.95Å; I43-I62 HydrophobicContact CB-CG1 4.17Å; I43-I62 HydrophobicContact CB-CG2 3.97Å; I43-I62 HydrophobicContact CD1-CG2 4.48Å; I43-I62 HydrophobicContact CG2-CD1 3.71Å; I43-I62 HydrophobicContact CG2-CG1 4.02Å; A50-I62 HydrophobicContact CB-CG2 3.85Å; Y52-I62 HydrophobicContact CE1-CB 4.28Å; Y52-I62 HydrophobicContact CE1-CG2 3.9Å; Y52-I62 WeakPolarHBondContact OH-CG2 3.44Å; Y52-I62 PolarHBondContact OH-N 3.49Å; I62-L71 HydrophobicContact CD1-CD1 3.97Å; I62-L71 HydrophobicContact CD1-CD2 4.41Å; I62-L71 HydrophobicContact CD1-CG 4.46Å; I62-L71 HydrophobicContact CG1-CD1 3.98Å; I62-L71 HydrophobicContact CG1-CG 4.48Å; I62-Y72 WeakPolarHBondContact CA-O 3.5Å; I62-Y72 WeakPolarHBondContact CG1-O 3.47Å; I62-L73 HydrophobicContact CB-CD1 4.3Å
63	S	98.2	Very high	96.7	Very high	38 Å²	38	49.8 Å²	49.8	27%	0.266	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	163.1	172.7	60.9	0	0	0	0	110.5	Y72	S63-Y72 PolarHBondContact N-O 3.48Å; S63-Y72 PolarHBondContact O-N 2.94Å
64	R	97.9	Very high	96.8	Very high	35 Å²	35	52.7 Å²	52.7	13%	0.132	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	146.3	-177.3	65.7	-177.6	-68	152.7	5.4	111.1	F21 Y24 I43 S44 S45 N66 T70 L71	F21-R64 HydrophobicContact CE1-CB 4.1Å; F21-R64 VanDerWaalsContact CE1-NH2 3.25Å; F21-R64 HydrophobicContact CZ-CB 4.15Å; F21-R64 PolarHBondContact O-NH2 2.83Å; Y24-R64 PolarHBondContact O-NH1 3.06Å; I43-R64 HydrophobicContact CD1-CB 4.3Å; I43-R64 HydrophobicContact CD1-CG 3.79Å; I43-R64 HydrophobicContact CG1-CG 4.43Å; I43-R64 HydrophobicContact CG2-CB 4.49Å; S44-R64 PolarHBondContact O-NH1 3Å; S45-R64 PolarHBondContact O-NE 3.39Å; S45-R64 PolarHBondContact O-NH1 3.1Å; S45-R64 VanDerWaalsContact O-NH1 3.08Å; S45-R64 PolarHBondContact O-NH2 3.27Å; R64-N66 PolarHBondContact NE-OD1 3.31Å; R64-N66 PolarHBondContact NH2-OD1 2.61Å; R64-T70 WeakPolarHBondContact CA-O 3.02Å; R64-L71 HydrophobicContact CB-CD1 4.2Å
65	D	97.3	Very high	97	Very high	41 Å²	41	45.4 Å²	45.4	22%	0.219	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	107.7	170.2	-175.5	-26.6	0	0	0	108.4	A67 K68 N69 T70 Y72	D65-A67 WeakPolarHBondContact OD1-CB 3.29Å; D65-A67 PolarHBondContact OD1-N 3.18Å; D65-K68 HydrophobicContact CB-CB 4.17Å; D65-K68 PolarHBondContact O-N 2.93Å; D65-K68 PolarHBondContact OD1-N 2.92Å; D65-K68 WeakPolarHBondContact OD2-CD 3.37Å; D65-K68 WeakPolarHBondContact OD2-CE 3.48Å; D65-K68 WeakPolarHBondContact OD2-CG 3.28Å; D65-K68 IonicContact OD2-NZ 3.5Å; D65-K68 PolarHBondContact OD2-NZ 2.81Å; D65-N69 PolarHBondContact O-N 2.02Å; D65-T70 PolarHBondContact N-O 2.82Å; D65-T70 PolarHBondContact O-N 2.93Å; D65-Y72 HydrophobicContact CB-CE2 3.94Å
66	N	96.3	Very high	97.2	Very high	61 Å²	61	43.6 Å²	43.6	33%	0.326	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-27.3	-178.4	-76.5	-16.8	0	0	0	113	F21 R64 K68 N69	F21-N66 WeakPolarHBondContact CD1-OD1 3.26Å; F21-N66 WeakPolarHBondContact CE1-OD1 3.4Å; R64-N66 PolarHBondContact NE-OD1 3.31Å; R64-N66 PolarHBondContact NH2-OD1 2.61Å; N66-K68 VanDerWaalsContact C-N 3.32Å; N66-N69 PolarHBondContact O-OD1 2.77Å
67	A	95.4	Very high	97.3	Very high	95 Å²	95	46.7 Å²	46.7	79%	0.785	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-32.2	176.4	0	0	0	0	0	111	D65	D65-A67 WeakPolarHBondContact OD1-CB 3.29Å; D65-A67 PolarHBondContact OD1-N 3.18Å
68	K	96.8	Very high	97.4	Very high	134 Å²	134	43.1 Å²	43.1	58%	0.583	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	1.8	178.2	-60.2	-178.7	-165.1	161.3	0	114.2	D65 N66 T70	D65-K68 HydrophobicContact CB-CB 4.17Å; D65-K68 PolarHBondContact O-N 2.93Å; D65-K68 PolarHBondContact OD1-N 2.92Å; D65-K68 WeakPolarHBondContact OD2-CD 3.37Å; D65-K68 WeakPolarHBondContact OD2-CE 3.48Å; D65-K68 WeakPolarHBondContact OD2-CG 3.28Å; D65-K68 IonicContact OD2-NZ 3.5Å; D65-K68 PolarHBondContact OD2-NZ 2.81Å; N66-K68 VanDerWaalsContact C-N 3.32Å; K68-T70 PolarHBondContact O-N 2.84Å; K68-T70 VanDerWaalsContact O-N 3.11Å; K68-T70 PolarHBondContact O-OG1 2.85Å
69	N	96.9	Very high	97.4	Very high	64 Å²	64	45.8 Å²	45.8	34%	0.342	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	38.7	-172.6	-60.5	-41.5	0	0	0	112.8	A16 F21 D65 N66	A16-N69 WeakPolarHBondContact CB-O 3.17Å; A16-N69 PolarHBondContact N-O 2.88Å; F21-N69 HydrophobicContact CB-CB 3.93Å; F21-N69 WeakPolarHBondContact CB-OD1 3.17Å; F21-N69 HydrophobicContact CD1-CB 4.45Å; F21-N69 HydrophobicContact CG-CB 4.2Å; D65-N69 PolarHBondContact O-N 2.02Å; N66-N69 PolarHBondContact O-OD1 2.77Å
70	T	97.9	Very high	97.3	Very high	16 Å²	16	48.1 Å²	48.1	10%	0.098	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.1	-170.8	-58	0	0	0	0	111.4	C14 R64 D65 K68 Y72	C14-T70 CarbonylContact O-C 3.57Å; C14-T70 WeakPolarHBondContact O-CA 3.44Å; R64-T70 WeakPolarHBondContact CA-O 3.02Å; D65-T70 PolarHBondContact N-O 2.82Å; D65-T70 PolarHBondContact O-N 2.93Å; K68-T70 PolarHBondContact O-N 2.84Å; K68-T70 VanDerWaalsContact O-N 3.11Å; K68-T70 PolarHBondContact O-OG1 2.85Å; T70-Y72 HydrophobicContact CG2-CD1 4.16Å; T70-Y72 HydrophobicContact CG2-CD2 4.42Å; T70-Y72 HydrophobicContact CG2-CE1 3.52Å; T70-Y72 HydrophobicContact CG2-CE2 3.82Å; T70-Y72 WeakPolarHBondContact CG2-OH 3.49Å
71	L	98.3	Very high	97	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.9	171.1	-170.2	71.1	0	0	0	109.9	S13 C14 F21 M26 W28 I43 I62 R64 C88	S13-L71 CarbonylContact C-O 3.6Å; S13-L71 VanDerWaalsContact CA-O 3.28Å; S13-L71 WeakPolarHBondContact CA-O 3.13Å; C14-L71 HydrophobicContact CB-CB 4.35Å; C14-L71 PolarHBondContact N-O 2.84Å; C14-L71 PolarHBondContact O-N 2.95Å; F21-L71 HydrophobicContact CE2-CB 4.3Å; F21-L71 HydrophobicContact CZ-CB 4.15Å; M26-L71 HydrophobicContact CB-CD1 3.74Å; M26-L71 HydrophobicContact CB-CD2 3.92Å; M26-L71 HydrophobicContact CB-CG 4.38Å; W28-L71 HydrophobicContact CD2-CD2 4.44Å; W28-L71 HydrophobicContact CG-CD2 4.32Å; W28-L71 HydrophobicContact CZ2-CD2 4.5Å; W28-L71 VanDerWaalsContact NE1-CD2 3.3Å; I43-L71 HydrophobicContact CG2-CD1 3.56Å; I62-L71 HydrophobicContact CD1-CD1 3.97Å; I62-L71 HydrophobicContact CD1-CD2 4.41Å; I62-L71 HydrophobicContact CD1-CG 4.46Å; I62-L71 HydrophobicContact CG1-CD1 3.98Å; I62-L71 HydrophobicContact CG1-CG 4.48Å; R64-L71 HydrophobicContact CB-CD1 4.2Å; L71-C88 HydrophobicContact CD2-CB 4.03Å
72	Y	98.3	Very high	96.8	Very high	45 Å²	45	50.4 Å²	50.4	18%	0.176	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	149.6	177.2	-56.4	-79.4	0	0	0	111.5	L12 W28 I62 S63 D65 T70	L12-Y72 VanDerWaalsContact O-CA 3.24Å; L12-Y72 WeakPolarHBondContact O-CA 3.07Å; W28-Y72 PolarHBondContact NE1-O 2.92Å; I62-Y72 WeakPolarHBondContact CA-O 3.5Å; I62-Y72 WeakPolarHBondContact CG1-O 3.47Å; S63-Y72 PolarHBondContact N-O 3.48Å; S63-Y72 PolarHBondContact O-N 2.94Å; D65-Y72 HydrophobicContact CB-CE2 3.94Å; T70-Y72 HydrophobicContact CG2-CD1 4.16Å; T70-Y72 HydrophobicContact CG2-CD2 4.42Å; T70-Y72 HydrophobicContact CG2-CE1 3.52Å; T70-Y72 HydrophobicContact CG2-CE2 3.82Å; T70-Y72 WeakPolarHBondContact CG2-OH 3.49Å
73	L	98.6	Very high	96.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	110.2	167.5	-171.6	68.4	0	0	0	108.4	K11 L12 W28 V40 A41 F60 I62 M75 Y86	K11-L73 CarbonylContact C-O 3.6Å; K11-L73 WeakPolarHBondContact CA-O 3.27Å; L12-L73 HydrophobicContact CB-CB 4.25Å; L12-L73 HydrophobicContact CD1-CD2 4.43Å; L12-L73 PolarHBondContact N-O 3.23Å; L12-L73 PolarHBondContact O-N 2.87Å; W28-L73 HydrophobicContact CB-CD2 4.18Å; W28-L73 HydrophobicContact CD2-CB 4.14Å; W28-L73 HydrophobicContact CD2-CD2 4.29Å; W28-L73 HydrophobicContact CG-CB 4.11Å; W28-L73 HydrophobicContact CG-CD1 4.41Å; W28-L73 HydrophobicContact CG-CD2 4.01Å; W28-L73 HydrophobicContact CG-CG 4.42Å; W28-L73 HydrophobicContact CZ2-CB 4.38Å; V40-L73 HydrophobicContact CG1-CD1 4.44Å; V40-L73 HydrophobicContact CG1-CD2 3.89Å; A41-L73 HydrophobicContact CB-CD1 4.24Å; F60-L73 HydrophobicContact CB-CD1 4.26Å; F60-L73 HydrophobicContact CD2-CD2 4.34Å; I62-L73 HydrophobicContact CB-CD1 4.3Å; L73-M75 HydrophobicContact CD2-CG 3.82Å; L73-M75 HydrophobicContact CD2-SD 3.82Å; L73-M75 HydrophobicContact CG-CG 3.8Å; L73-M75 HydrophobicContact CG-SD 4.33Å; L73-Y86 HydrophobicContact CD2-CD1 4.1Å; L73-Y86 HydrophobicContact CD2-CE1 4.15Å
74	E	98.2	Very high	96.7	Very high	82 Å²	82	50.2 Å²	50.2	38%	0.383	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	122.9	169.5	-70	176.5	-169.2	0	0	108.1	K11 F60 T61	K11-E74 HydrophobicContact CB-CG 4.41Å; K11-E74 HydrophobicContact CD-CG 3.84Å; K11-E74 WeakPolarHBondContact CE-OE1 3.26Å; K11-E74 HydrophobicContact CG-CG 3.9Å; K11-E74 IonicContact NZ-OE1 3.96Å; K11-E74 PolarHBondContact NZ-OE1 3.07Å; F60-E74 CarbonylContact C-O 3.46Å; F60-E74 VanDerWaalsContact CA-O 3.25Å; F60-E74 WeakPolarHBondContact CA-O 3.49Å; T61-E74 PolarHBondContact N-O 2.94Å; T61-E74 PolarHBondContact O-N 2.79Å
75	M	97.9	Very high	96.6	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.2	-175.2	-62.5	166	58.2	0	0	107.5	S9 L10 L12 F60 L73 L78 Y86 V106	S9-M75 CarbonylContact C-O 3.54Å; S9-M75 WeakPolarHBondContact CA-O 3.42Å; S9-M75 WeakPolarHBondContact CB-O 3.49Å; L10-M75 PolarHBondContact N-O 2.85Å; L10-M75 WeakPolarHBondContact O-CB 3.27Å; L10-M75 PolarHBondContact O-N 2.84Å; L12-M75 HydrophobicContact CD1-SD 3.73Å; L12-M75 HydrophobicContact CG-SD 3.88Å; F60-M75 HydrophobicContact CD1-CB 3.84Å; F60-M75 HydrophobicContact CD1-CG 4Å; F60-M75 HydrophobicContact CD2-CG 4.12Å; F60-M75 HydrophobicContact CE1-CB 3.78Å; F60-M75 HydrophobicContact CE1-CE 4.41Å; F60-M75 HydrophobicContact CE1-CG 4.05Å; F60-M75 HydrophobicContact CE2-CE 4.1Å; F60-M75 HydrophobicContact CE2-CG 4.15Å; F60-M75 HydrophobicContact CG-CB 4.4Å; F60-M75 HydrophobicContact CG-CG 4.08Å; F60-M75 HydrophobicContact CZ-CB 4.26Å; F60-M75 HydrophobicContact CZ-CE 3.82Å; F60-M75 HydrophobicContact CZ-CG 4.13Å; L73-M75 HydrophobicContact CD2-CG 3.82Å; L73-M75 HydrophobicContact CD2-SD 3.82Å; L73-M75 HydrophobicContact CG-CG 3.8Å; L73-M75 HydrophobicContact CG-SD 4.33Å; M75-L78 HydrophobicContact CB-CD1 4.17Å; M75-L78 HydrophobicContact CB-CD2 4.06Å; M75-L78 HydrophobicContact CB-CG 4.24Å; M75-L78 HydrophobicContact CE-CD1 4.25Å; M75-L78 HydrophobicContact CE-CD2 3.37Å; M75-L78 HydrophobicContact CE-CG 4.41Å; M75-Y86 HydrophobicContact CE-CE1 3.95Å; M75-Y86 HydrophobicContact CE-CE2 4.11Å; M75-Y86 WeakPolarHBondContact CE-OH 3.25Å; M75-Y86 HydrophobicContact SD-CE1 4.22Å; M75-V106 HydrophobicContact CE-CG1 4.09Å; M75-V106 HydrophobicContact CE-CG2 4.49Å
76	S	97.4	Very high	96.6	Very high	43 Å²	43	49.5 Å²	49.5	30%	0.301	27%	0.267	S	S	.	.			trans	-116	162.9	176.4	72.1	0	0	0	0	111	R59 L78	R59-S76 WeakPolarHBondContact O-CB 3.28Å; R59-S76 PolarHBondContact O-N 2.85Å; R59-S76 PolarHBondContact O-OG 3.08Å; S76-L78 VanDerWaalsContact C-N 3.29Å; S76-L78 PolarHBondContact O-N 2.92Å
77	S	96.5	Very high	96.7	Very high	66 Å²	66	48.6 Å²	48.6	46%	0.462	26%	0.259	S	S	.	.	S	Bend	trans	49.6	50.3	178.7	-57.4	0	0	0	0	112.3	G8 R59	G8-S77 PolarHBondContact O-N 3.23Å; R59-S77 PolarHBondContact NH1-O 3.33Å
78	L	96.8	Very high	96.8	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.225	C	C	.	.			trans	-66.3	141	-175.1	-80.9	167.6	0	0	0	112.3	V4 P6 G7 G8 L10 F60 M75 S76 D82 V108	V4-L78 HydrophobicContact CG2-CD1 3.65Å; P6-L78 CarbonylContact C-O 3.43Å; P6-L78 WeakPolarHBondContact CA-O 3.5Å; G7-L78 PolarHBondContact N-O 2.88Å; G8-L78 PolarHBondContact O-N 2.99Å; G8-L78 VanDerWaalsContact O-N 3.08Å; L10-L78 HydrophobicContact CB-CD1 3.95Å; F60-L78 HydrophobicContact CE1-CD2 3.76Å; F60-L78 HydrophobicContact CZ-CD2 3.75Å; M75-L78 HydrophobicContact CB-CD1 4.17Å; M75-L78 HydrophobicContact CB-CD2 4.06Å; M75-L78 HydrophobicContact CB-CG 4.24Å; M75-L78 HydrophobicContact CE-CD1 4.25Å; M75-L78 HydrophobicContact CE-CD2 3.37Å; M75-L78 HydrophobicContact CE-CG 4.41Å; S76-L78 VanDerWaalsContact C-N 3.29Å; S76-L78 PolarHBondContact O-N 2.92Å; L78-D82 HydrophobicContact CD2-CB 3.59Å; L78-V108 HydrophobicContact CB-CG1 4.28Å; L78-V108 HydrophobicContact CB-CG2 4.09Å; L78-V108 HydrophobicContact CD2-CG2 4.42Å
79	R	95.3	Very high	96.7	Very high	134 Å²	134	38.2 Å²	38.2	51%	0.506	20%	0.198	S	C	.	.			trans	-118.9	162.9	-179.3	-51	178	178.6	168.5	-1.3	110.4	E81 D82 V108	R79-E81 WeakPolarHBondContact CB-OE2 3.37Å; R79-E81 PolarHBondContact O-N 2.95Å; R79-E81 VanDerWaalsContact O-N 3.17Å; R79-D82 PolarHBondContact N-OD2 2.8Å; R79-D82 WeakPolarHBondContact O-CB 3.1Å; R79-D82 PolarHBondContact O-N 3.48Å; R79-V108 VanDerWaalsContact O-CB 3.31Å; R79-V108 WeakPolarHBondContact O-CB 3.15Å; R79-V108 WeakPolarHBondContact O-CG1 3.11Å; R79-V108 WeakPolarHBondContact O-CG2 3.46Å
80	S	93.8	Very high	96.6	Very high	69 Å²	69	36.1 Å²	36.1	48%	0.483	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-50.7	-38.7	175.1	25.2	0	0	0	0	112.3	D82 T83	S80-D82 PolarHBondContact O-N 2.93Å; S80-T83 VanDerWaalsContact O-CB 3.26Å; S80-T83 WeakPolarHBondContact O-CB 3.39Å; S80-T83 PolarHBondContact O-N 2.81Å; S80-T83 VanDerWaalsContact O-N 3.07Å; S80-T83 PolarHBondContact O-OG1 2.67Å
81	E	92.7	Very high	96.2	Very high	124 Å²	124	37.1 Å²	37.1	58%	0.579	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-69.9	-13.3	-178.8	-53.5	72	-133.4	0	0	113.1	R79	R79-E81 WeakPolarHBondContact CB-OE2 3.37Å; R79-E81 PolarHBondContact O-N 2.95Å; R79-E81 VanDerWaalsContact O-N 3.17Å
82	D	94.9	Very high	95.4	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.011	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-84.4	0.7	173.6	-57.2	-51.3	0	0	0	112.6	R30 R59 F60 L78 R79 S80 A84 Y86 V108	R30-D82 IonicContact CZ-OD1 3.32Å; R30-D82 IonicContact NH1-OD1 2.81Å; R30-D82 PolarHBondContact NH1-OD1 2.8Å; R59-D82 IonicContact CZ-OD1 2.67Å; R59-D82 IonicContact CZ-OD2 3.86Å; R59-D82 IonicContact NH1-OD1 2.61Å; R59-D82 IonicContact NH1-OD2 3.72Å; R59-D82 PolarHBondContact NH1-OD2 3.29Å; R59-D82 IonicContact NH2-OD1 3.6Å; R59-D82 PolarHBondContact NH2-OD1 3.2Å; R59-D82 IonicContact NH2-OD2 3.03Å; R59-D82 PolarHBondContact NH2-OD2 2.86Å; F60-D82 HydrophobicContact CZ-CB 4.23Å; L78-D82 HydrophobicContact CD2-CB 3.59Å; R79-D82 PolarHBondContact N-OD2 2.8Å; R79-D82 WeakPolarHBondContact O-CB 3.1Å; R79-D82 PolarHBondContact O-N 3.48Å; S80-D82 PolarHBondContact O-N 2.93Å; D82-A84 PolarHBondContact O-N 3Å; D82-Y86 WeakPolarHBondContact O-CE2 3.43Å; D82-Y86 PolarHBondContact O-OH 2.82Å; D82-V108 HydrophobicContact CB-CG2 4.38Å
83	T	96.1	Very high	94.2	Very high	35 Å²	35	43 Å²	43	22%	0.215	23%	0.229	C	C	.	.			trans	-67.4	113.1	171.2	-63	0	0	0	0	110.1	P33 S80 V106 T107 V108	P33-T83 WeakPolarHBondContact CD-O 3.05Å; S80-T83 VanDerWaalsContact O-CB 3.26Å; S80-T83 WeakPolarHBondContact O-CB 3.39Å; S80-T83 PolarHBondContact O-N 2.81Å; S80-T83 VanDerWaalsContact O-N 3.07Å; S80-T83 PolarHBondContact O-OG1 2.67Å; T83-V106 WeakPolarHBondContact CA-O 3.42Å; T83-T107 HydrophobicContact CG2-CG2 4.37Å; T83-V108 PolarHBondContact OG1-N 3.42Å
84	A	96.6	Very high	93	Very high	5 Å²	5	47 Å²	47	4%	0.041	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	168.3	-176.4	0	0	0	0	0	111.7	R30 Q31 D82 Y86 V106	R30-A84 HydrophobicContact CB-CB 3.85Å; R30-A84 HydrophobicContact CG-CB 4.17Å; Q31-A84 WeakPolarHBondContact O-CA 3.5Å; Q31-A84 VanDerWaalsContact O-CB 3.26Å; Q31-A84 WeakPolarHBondContact O-CB 3.43Å; D82-A84 PolarHBondContact O-N 3Å; A84-Y86 HydrophobicContact CB-CD2 4.18Å; A84-Y86 HydrophobicContact CB-CE2 3.75Å; A84-Y86 WeakPolarHBondContact O-CD2 3.17Å; A84-V106 PolarHBondContact N-O 2.96Å; A84-V106 PolarHBondContact O-N 3.08Å
85	M	97.3	Very high	91.6	Very high	61 Å²	61	51.9 Å²	51.9	30%	0.3	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.5	160.5	-77.5	-65.9	-67.4	0	0	109.5	R30 Q31 Y87 S105	R30-M85 CarbonylContact C-O 3.55Å; R30-M85 WeakPolarHBondContact CA-O 3.48Å; Q31-M85 PolarHBondContact N-O 2.77Å; Q31-M85 PolarHBondContact O-N 2.86Å; M85-Y87 HydrophobicContact CB-CE2 3.56Å; M85-Y87 WeakPolarHBondContact CB-OH 3.5Å; M85-Y87 WeakPolarHBondContact O-CD2 3.29Å; M85-Y87 WeakPolarHBondContact O-CE2 3.35Å; M85-S105 WeakPolarHBondContact SD-CA 3.46Å; M85-S105 PolarHBondContact SD-N 3.43Å; M85-S105 VanDerWaalsContact SD-N 3.43Å
86	Y	97.8	Very high	90.6	Very high	1 Å²	1	54 Å²	54	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.3	-179.3	-76.3	-104.7	0	0	0	111.1	L12 V29 R30 V40 F60 L73 M75 D82 A84 G103 T104 V106	L12-Y86 HydrophobicContact CD1-CD1 3.98Å; L12-Y86 HydrophobicContact CD1-CD2 4.45Å; L12-Y86 HydrophobicContact CD1-CG 3.79Å; V29-Y86 CarbonylContact O-C 3.58Å; R30-Y86 HydrophobicContact CB-CD1 3.92Å; R30-Y86 HydrophobicContact CB-CD2 4.3Å; R30-Y86 HydrophobicContact CB-CE1 3.9Å; R30-Y86 HydrophobicContact CB-CE2 4.26Å; R30-Y86 HydrophobicContact CB-CG 4.12Å; R30-Y86 PolarHBondContact NH1-OH 2.69Å; V40-Y86 HydrophobicContact CG1-CE1 4.32Å; V40-Y86 HydrophobicContact CG2-CD1 4.42Å; V40-Y86 HydrophobicContact CG2-CE1 4.07Å; F60-Y86 HydrophobicContact CE2-CE1 4.41Å; L73-Y86 HydrophobicContact CD2-CD1 4.1Å; L73-Y86 HydrophobicContact CD2-CE1 4.15Å; M75-Y86 HydrophobicContact CE-CE1 3.95Å; M75-Y86 HydrophobicContact CE-CE2 4.11Å; M75-Y86 WeakPolarHBondContact CE-OH 3.25Å; M75-Y86 HydrophobicContact SD-CE1 4.22Å; D82-Y86 WeakPolarHBondContact O-CE2 3.43Å; D82-Y86 PolarHBondContact O-OH 2.82Å; A84-Y86 HydrophobicContact CB-CD2 4.18Å; A84-Y86 HydrophobicContact CB-CE2 3.75Å; A84-Y86 WeakPolarHBondContact O-CD2 3.17Å; Y86-G103 CarbonylContact O-C 3.5Å; Y86-G103 WeakPolarHBondContact O-CA 3.45Å; Y86-T104 PolarHBondContact N-O 2.8Å; Y86-T104 PolarHBondContact O-N 3.35Å; Y86-V106 HydrophobicContact CD2-CB 3.86Å; Y86-V106 HydrophobicContact CD2-CG2 3.63Å; Y86-V106 HydrophobicContact CE2-CB 3.77Å; Y86-V106 HydrophobicContact CE2-CG1 4.43Å; Y86-V106 HydrophobicContact CE2-CG2 3.94Å; Y86-V106 HydrophobicContact CG-CG2 4.38Å
87	Y	97.3	Very high	89.9	Confident	42 Å²	42	54 Å²	54	17%	0.165	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.7	-178.3	-55.1	-91.7	0	0	0	109.6	W28 V29 Q31 M85 W100 G101 G103	W28-Y87 CarbonylContact C-O 3.39Å; W28-Y87 WeakPolarHBondContact CA-O 3.48Å; W28-Y87 VanDerWaalsContact CE3-C 3.5Å; V29-Y87 PolarHBondContact N-O 3.06Å; V29-Y87 PolarHBondContact O-N 3.12Å; Q31-Y87 HydrophobicContact CB-CE2 3.97Å; M85-Y87 HydrophobicContact CB-CE2 3.56Å; M85-Y87 WeakPolarHBondContact CB-OH 3.5Å; M85-Y87 WeakPolarHBondContact O-CD2 3.29Å; M85-Y87 WeakPolarHBondContact O-CE2 3.35Å; Y87-W100 HydrophobicContact CG-CE3 4.2Å; Y87-W100 HydrophobicContact CG-CZ3 4.46Å; Y87-G101 WeakPolarHBondContact CD1-O 3.41Å; Y87-G103 VanDerWaalsContact CE1-CA 3.46Å
88	C	96.9	Very high	89.5	Confident	10 Å²	10	54.6 Å²	54.6	7%	0.068	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	143.2	161.4	54.4	0	0	0	0	109	C14 S27 W28 L71 W100 G101	C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 3.26Å; C14-C88 WeakPolarHBondContact SG-CB 3.38Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 3.22Å; S27-C88 CarbonylContact O-C 3.59Å; S27-C88 VanDerWaalsContact O-CA 3.27Å; S27-C88 WeakPolarHBondContact O-CA 3.02Å; W28-C88 HydrophobicContact CD2-CB 4.46Å; W28-C88 HydrophobicContact CE3-CB 4.34Å; W28-C88 HydrophobicContact CH2-CB 4.27Å; W28-C88 HydrophobicContact CZ2-CB 4.38Å; W28-C88 HydrophobicContact CZ3-CB 4.24Å; L71-C88 HydrophobicContact CD2-CB 4.03Å; C88-W100 CarbonylContact O-C 3.5Å; C88-W100 WeakPolarHBondContact O-CA 3.37Å; C88-G101 PolarHBondContact O-N 2.8Å
89	A	96.1	Very high	89.2	Confident	1 Å²	1	60 Å²	60	1%	0.008	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	148.2	177.2	0	0	0	0	0	111.4	M26 S27 M97 Y99 W100	M26-A89 WeakPolarHBondContact CA-O 3.36Å; M26-A89 WeakPolarHBondContact CE-O 3.28Å; S27-A89 PolarHBondContact N-O 2.94Å; S27-A89 PolarHBondContact O-N 3.37Å; A89-M97 HydrophobicContact CB-CB 4.47Å; A89-M97 HydrophobicContact CB-CE 3.97Å; A89-M97 HydrophobicContact CB-CG 4.34Å; A89-M97 HydrophobicContact CB-SD 4.17Å; A89-Y99 CarbonylContact C-O 3.43Å; A89-Y99 WeakPolarHBondContact CA-O 3.25Å; A89-W100 HydrophobicContact CB-CD2 3.96Å; A89-W100 HydrophobicContact CB-CE3 4.15Å; A89-W100 HydrophobicContact CB-CG 4.38Å; A89-W100 HydrophobicContact CB-CZ2 4.41Å; A89-W100 HydrophobicContact CB-CZ3 4.46Å
90	R	95	Very high	89.1	Confident	19 Å²	19	58.6 Å²	58.6	7%	0.072	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	137.7	172.3	-174.4	-177.9	80.3	169.8	12.9	109.4	F19 Y24 M26 M97 D98 Y99	F19-R90 HydrophobicContact CE2-CG 4.13Å; F19-R90 HydrophobicContact CZ-CB 4.3Å; F19-R90 HydrophobicContact CZ-CG 4.33Å; Y24-R90 HydrophobicContact CD1-CG 4.02Å; Y24-R90 HydrophobicContact CG-CG 3.82Å; M26-R90 HydrophobicContact CE-CB 4.42Å; M26-R90 HydrophobicContact SD-CB 4.06Å; M26-R90 HydrophobicContact SD-CG 4.12Å; R90-M97 WeakPolarHBondContact O-CA 3.3Å; R90-D98 IonicContact CZ-OD1 2.93Å; R90-D98 IonicContact CZ-OD2 3.87Å; R90-D98 IonicContact NE-OD1 3.42Å; R90-D98 PolarHBondContact NE-OD1 3.11Å; R90-D98 IonicContact NE-OD2 3.18Å; R90-D98 IonicContact NH2-OD1 2.72Å; R90-D98 PolarHBondContact NH2-OD1 2.99Å; R90-D98 IonicContact NH2-OD2 3.41Å; R90-D98 PolarHBondContact NH2-OD2 3.02Å; R90-Y99 PolarHBondContact N-O 2.76Å
91	K	88	Confident	89.2	Confident	37 Å²	37	56.6 Å²	56.6	16%	0.161	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129	171.6	-178.8	-179.2	179.6	-178.3	0	110.6	A25 W39 E42 Y95	A25-K91 HydrophobicContact CB-CB 4.2Å; A25-K91 HydrophobicContact CB-CD 4.47Å; A25-K91 PolarHBondContact O-N 3.25Å; W39-K91 HydrophobicContact CH2-CD 4.35Å; E42-K91 IonicContact OE1-NZ 2.87Å; E42-K91 PolarHBondContact OE1-NZ 3.27Å; E42-K91 WeakPolarHBondContact OE2-CD 3.24Å; E42-K91 WeakPolarHBondContact OE2-CE 3.36Å; E42-K91 IonicContact OE2-NZ 2.88Å; E42-K91 PolarHBondContact OE2-NZ 3.35Å; K91-Y95 VanDerWaalsContact CE-CD1 3.46Å
92	T	81.9	Confident	89.2	Confident	23 Å²	23	59.5 Å²	59.5	14%	0.141	30%	0.304	C	S	.	.			trans	-95.9	173.3	176.1	61.4	0	0	0	0	112	S94 Y95 A96 D98	T92-S94 PolarHBondContact O-N 3Å; T92-S94 PolarHBondContact OG1-OG 3.17Å; T92-Y95 PolarHBondContact O-N 2.94Å; T92-Y95 VanDerWaalsContact O-N 3.08Å; T92-A96 PolarHBondContact N-O 2.83Å; T92-A96 PolarHBondContact OG1-O 3.45Å; T92-D98 WeakPolarHBondContact CG2-OD1 3.49Å; T92-D98 VanDerWaalsContact CG2-OD2 3.28Å; T92-D98 WeakPolarHBondContact CG2-OD2 3.42Å
93	T	72.9	Confident	89.2	Confident	146 Å²	146	60.8 Å²	60.8	90%	0.896	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.8	-179	48.4	0	0	0	0	114.1	Y95	T93-Y95 VanDerWaalsContact C-N 3.33Å
94	S	73.9	Confident	89.3	Confident	85 Å²	85	61 Å²	61	59%	0.594	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	13.3	175.8	58.6	0	0	0	0	113.7	T92 A96	T92-S94 PolarHBondContact O-N 3Å; T92-S94 PolarHBondContact OG1-OG 3.17Å; S94-A96 PolarHBondContact O-N 3.33Å; S94-A96 VanDerWaalsContact O-N 3.13Å
95	Y	68.9	Low	89.3	Confident	183 Å²	183	63.5 Å²	63.5	72%	0.718	34%	0.337	S	S	*	.	S	Bend	trans	62.9	7.8	-172.4	-51.8	-87.3	0	0	0	114.6	K91 T92 T93	K91-Y95 VanDerWaalsContact CE-CD1 3.46Å; T92-Y95 PolarHBondContact O-N 2.94Å; T92-Y95 VanDerWaalsContact O-N 3.08Å; T93-Y95 VanDerWaalsContact C-N 3.33Å
96	A	77.2	Confident	89.2	Confident	46 Å²	46	60.6 Å²	60.6	38%	0.38	32%	0.322	S	S	.	.			trans	-76	138.9	175	0	0	0	0	0	111.3	T92 S94	T92-A96 PolarHBondContact N-O 2.83Å; T92-A96 PolarHBondContact OG1-O 3.45Å; S94-A96 PolarHBondContact O-N 3.33Å; S94-A96 VanDerWaalsContact O-N 3.13Å
97	M	83.2	Confident	89.2	Confident	43 Å²	43	63 Å²	63	21%	0.212	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	94.5	170.8	-72.3	176.2	146.5	0	0	109.8	S27 V29 W39 A89 R90 W100	S27-M97 VanDerWaalsContact CB-CE 3.46Å; V29-M97 HydrophobicContact CG2-CE 3.64Å; V29-M97 HydrophobicContact CG2-SD 4.09Å; W39-M97 HydrophobicContact CD2-CE 4.36Å; W39-M97 HydrophobicContact CE3-CE 3.89Å; W39-M97 HydrophobicContact CH2-CE 3.11Å; W39-M97 HydrophobicContact CH2-SD 4.18Å; W39-M97 HydrophobicContact CZ2-CE 3.59Å; W39-M97 HydrophobicContact CZ3-CE 3.26Å; W39-M97 HydrophobicContact CZ3-SD 3.86Å; A89-M97 HydrophobicContact CB-CB 4.47Å; A89-M97 HydrophobicContact CB-CE 3.97Å; A89-M97 HydrophobicContact CB-CG 4.34Å; A89-M97 HydrophobicContact CB-SD 4.17Å; R90-M97 WeakPolarHBondContact O-CA 3.3Å; M97-W100 HydrophobicContact CB-CZ2 3.8Å; M97-W100 HydrophobicContact CG-CZ2 4.36Å; M97-W100 PolarHBondContact O-NE1 2.85Å; M97-W100 HydrophobicContact SD-CH2 3.96Å; M97-W100 HydrophobicContact SD-CZ2 3.61Å
98	D	86.3	Confident	89.1	Confident	79 Å²	79	61.3 Å²	61.3	42%	0.422	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-20.1	-171.3	57.8	-8.6	0	0	0	114.1	R90 T92	R90-D98 IonicContact CZ-OD1 2.93Å; R90-D98 IonicContact CZ-OD2 3.87Å; R90-D98 IonicContact NE-OD1 3.42Å; R90-D98 PolarHBondContact NE-OD1 3.11Å; R90-D98 IonicContact NE-OD2 3.18Å; R90-D98 IonicContact NH2-OD1 2.72Å; R90-D98 PolarHBondContact NH2-OD1 2.99Å; R90-D98 IonicContact NH2-OD2 3.41Å; R90-D98 PolarHBondContact NH2-OD2 3.02Å; T92-D98 WeakPolarHBondContact CG2-OD1 3.49Å; T92-D98 VanDerWaalsContact CG2-OD2 3.28Å; T92-D98 WeakPolarHBondContact CG2-OD2 3.42Å
99	Y	90.4	Very high	88.9	Confident	116 Å²	116	63.4 Å²	63.4	46%	0.455	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129	172.1	-72.7	-96.1	0	0	0	111	A89 R90	A89-Y99 CarbonylContact C-O 3.43Å; A89-Y99 WeakPolarHBondContact CA-O 3.25Å; R90-Y99 PolarHBondContact N-O 2.76Å
100	W	94.8	Very high	88.2	Confident	104 Å²	104	70.3 Å²	70.3	39%	0.394	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.8	178.3	-68.3	73.3	0	0	0	110.1	V29 L37 Y87 C88 A89 M97	V29-W100 HydrophobicContact CB-CH2 4Å; V29-W100 HydrophobicContact CB-CZ3 3.74Å; V29-W100 HydrophobicContact CG1-CH2 3.88Å; V29-W100 HydrophobicContact CG1-CZ3 3.88Å; V29-W100 HydrophobicContact CG2-CH2 3.88Å; V29-W100 HydrophobicContact CG2-CZ3 4.01Å; L37-W100 HydrophobicContact CD2-CZ3 4.49Å; Y87-W100 HydrophobicContact CG-CE3 4.2Å; Y87-W100 HydrophobicContact CG-CZ3 4.46Å; C88-W100 CarbonylContact O-C 3.5Å; C88-W100 WeakPolarHBondContact O-CA 3.37Å; A89-W100 HydrophobicContact CB-CD2 3.96Å; A89-W100 HydrophobicContact CB-CE3 4.15Å; A89-W100 HydrophobicContact CB-CG 4.38Å; A89-W100 HydrophobicContact CB-CZ2 4.41Å; A89-W100 HydrophobicContact CB-CZ3 4.46Å; M97-W100 HydrophobicContact CB-CZ2 3.8Å; M97-W100 HydrophobicContact CG-CZ2 4.36Å; M97-W100 PolarHBondContact O-NE1 2.85Å; M97-W100 HydrophobicContact SD-CH2 3.96Å; M97-W100 HydrophobicContact SD-CZ2 3.61Å
101	G	94.8	Very high	87.8	Confident	26 Å²	26	72.9 Å²	72.9	27%	0.268	41%	0.41	S	S	.	.			trans	-69.3	165.5	168	0	0	0	0	0	111.6	Y87 C88 G103	Y87-G101 WeakPolarHBondContact CD1-O 3.41Å; C88-G101 PolarHBondContact O-N 2.8Å; G101-G103 PolarHBondContact O-N 3.26Å; G101-G103 VanDerWaalsContact O-N 3.07Å
102	Q	93.9	Very high	87.8	Confident	186 Å²	186	74.7 Å²	74.7	87%	0.869	42%	0.423	S	S	*	.			trans	-63.5	-14.6	178.7	-66.5	-62.9	-37.6	0	0	113.9
103	G	95	Very high	88.2	Confident	28 Å²	28	77.6 Å²	77.6	29%	0.289	44%	0.439	S	S	.	.			trans	86.7	158.9	-176.7	0	0	0	0	0	112.7	Y86 Y87 G101	Y86-G103 CarbonylContact O-C 3.5Å; Y86-G103 WeakPolarHBondContact O-CA 3.45Å; Y87-G103 VanDerWaalsContact CE1-CA 3.46Å; G101-G103 PolarHBondContact O-N 3.26Å; G101-G103 VanDerWaalsContact O-N 3.07Å
104	T	96.7	Very high	89.1	Confident	39 Å²	39	73.6 Å²	73.6	24%	0.239	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	133.7	174.9	-155.4	0	0	0	0	111	G1 L12 Y86	G1-T104 WeakPolarHBondContact CA-OG1 3.43Å; G1-T104 PolarHBondContact N-OG1 2.72Å; L12-T104 HydrophobicContact CD1-CG2 4.03Å; L12-T104 HydrophobicContact CD2-CG2 3.88Å; L12-T104 HydrophobicContact CG-CG2 4.5Å; Y86-T104 PolarHBondContact N-O 2.8Å; Y86-T104 PolarHBondContact O-N 3.35Å
105	S	96.4	Very high	90	Very high	59 Å²	59	72.9 Å²	72.9	41%	0.413	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	130.5	-179.7	-166.2	0	0	0	0	110.5	G1 G2 M85	G1-S105 CarbonylContact C-O 3.56Å; G1-S105 WeakPolarHBondContact CA-O 3.43Å; G2-S105 PolarHBondContact N-O 3.01Å; M85-S105 WeakPolarHBondContact SD-CA 3.46Å; M85-S105 PolarHBondContact SD-N 3.43Å; M85-S105 VanDerWaalsContact SD-N 3.43Å
106	V	97	Very high	91.4	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	125.8	166.8	177.9	0	0	0	0	107.3	L10 L12 M75 T83 A84 Y86 V108	L10-V106 HydrophobicContact CD2-CB 4.48Å; L10-V106 HydrophobicContact CD2-CG1 3.97Å; L10-V106 HydrophobicContact CD2-CG2 3.76Å; L12-V106 HydrophobicContact CD1-CG2 4.11Å; L12-V106 HydrophobicContact CD2-CG2 3.99Å; M75-V106 HydrophobicContact CE-CG1 4.09Å; M75-V106 HydrophobicContact CE-CG2 4.49Å; T83-V106 WeakPolarHBondContact CA-O 3.42Å; A84-V106 PolarHBondContact N-O 2.96Å; A84-V106 PolarHBondContact O-N 3.08Å; Y86-V106 HydrophobicContact CD2-CB 3.86Å; Y86-V106 HydrophobicContact CD2-CG2 3.63Å; Y86-V106 HydrophobicContact CE2-CB 3.77Å; Y86-V106 HydrophobicContact CE2-CG1 4.43Å; Y86-V106 HydrophobicContact CE2-CG2 3.94Å; Y86-V106 HydrophobicContact CG-CG2 4.38Å; V106-V108 HydrophobicContact CG1-CG2 4.37Å
107	T	96.6	Very high	92.4	Very high	51 Å²	51	66.9 Å²	66.9	31%	0.313	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.1	178.5	-54.7	0	0	0	0	109	G2 L3 V4 T83	G2-T107 PolarHBondContact O-N 3.38Å; L3-T107 WeakPolarHBondContact CA-O 3.34Å; L3-T107 HydrophobicContact CD1-CG2 3.72Å; V4-T107 PolarHBondContact N-O 3.46Å; T83-T107 HydrophobicContact CG2-CG2 4.37Å
108	V	95.5	Very high	93.2	Very high	7 Å²	7	68.8 Å²	68.8	4%	0.042	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	103.1	177.1	-168.5	0	0	0	0	108.8	V4 P6 L78 R79 D82 T83 V106	V4-V108 HydrophobicContact CG2-CG2 3.98Å; V4-V108 VanDerWaalsContact O-CA 3.26Å; V4-V108 WeakPolarHBondContact O-CA 3.33Å; P6-V108 HydrophobicContact CB-CG1 4.43Å; P6-V108 HydrophobicContact CG-CG1 4.14Å; L78-V108 HydrophobicContact CB-CG1 4.28Å; L78-V108 HydrophobicContact CB-CG2 4.09Å; L78-V108 HydrophobicContact CD2-CG2 4.42Å; R79-V108 VanDerWaalsContact O-CB 3.31Å; R79-V108 WeakPolarHBondContact O-CB 3.15Å; R79-V108 WeakPolarHBondContact O-CG1 3.11Å; R79-V108 WeakPolarHBondContact O-CG2 3.46Å; D82-V108 HydrophobicContact CB-CG2 4.38Å; T83-V108 PolarHBondContact OG1-N 3.42Å; V106-V108 HydrophobicContact CG1-CG2 4.37Å
109	S	91.7	Very high	93.7	Very high	54 Å²	54	67.9 Å²	67.9	38%	0.378	39%	0.389	S	S	.	.			trans	-145.6	154	-179.6	69	0	0	0	0	111.8	L3 V4	L3-S109 WeakPolarHBondContact CD1-OG 3.37Å; V4-S109 PolarHBondContact O-N 2.94Å; V4-S109 VanDerWaalsContact O-N 3.12Å
110	S	82	Confident	94	Very high	145 Å²	145	63.5 Å²	63.5	100%	1.014	38%	0.384	S	S	*	.			trans	-73	0	178.2	57.4	0	0	0	0	113.1

Retrieved 110 of 110 residues in 132.9 ms (Link to these results)

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