X5J5B2_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J5B2, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 102 aa.

						>X5J5B2_MOUSE|X5J5B2
SCAASGFDFSRYWMSWVRQAPGKGLEWIGEINPDSSTINYTPSLKDKFIISRDNAKNTLYLQMSKVRSEDTALYYCAIIYYGNLYYYAMDYWGQGTSATVSS
					

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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	S	96.9	Very high	93.2	Very high	108 Å²	108	72 Å²	72	76%	0.755	46%	0.46	S	S	*	.				0	166.1	0	49	0	0	0	0	109	L59	S1-L59 CarbonylContact C-O 3.43Å; S1-L59 WeakPolarHBondContact CA-O 3.33Å
2	C	97.3	Very high	93	Very high	20 Å²	20	72.3 Å²	72.3	14%	0.135	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	113.6	175.4	165.8	0	0	0	0	108.8	W16 T58 L59 C76	C2-W16 HydrophobicContact CB-CH2 3.78Å; C2-W16 HydrophobicContact CB-CZ2 3.99Å; C2-T58 WeakPolarHBondContact O-CA 3.35Å; C2-L59 HydrophobicContact CB-CB 4.41Å; C2-L59 PolarHBondContact N-O 3.19Å; C2-L59 PolarHBondContact O-N 3.31Å; C2-C76 HydrophobicContact CB-CB 3.39Å; C2-C76 WeakPolarHBondContact CB-SG 3.37Å; C2-C76 WeakPolarHBondContact SG-CB 3.31Å; C2-C76 CovalentContact SG-SG 2.02Å; C2-C76 PolarHBondContact SG-SG 2.63Å
3	A	96.8	Very high	93.1	Very high	79 Å²	79	70.7 Å²	70.7	65%	0.653	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	129.8	174	0	0	0	0	0	109.3
4	A	93.8	Very high	93.2	Very high	16 Å²	16	65.9 Å²	65.9	13%	0.132	40%	0.398	C	S	.	.			trans	-97.2	145.1	179.2	0	0	0	0	0	111.2	F7 F9 N57	A4-F7 HydrophobicContact CB-CE1 3.71Å; A4-F7 HydrophobicContact CB-CE2 4.41Å; A4-F7 HydrophobicContact CB-CZ 3.49Å; A4-F7 VanDerWaalsContact CB-CZ 3.49Å; A4-F9 HydrophobicContact CB-CB 4.31Å; A4-F9 HydrophobicContact CB-CD2 3.42Å; A4-F9 VanDerWaalsContact CB-CD2 3.42Å; A4-F9 HydrophobicContact CB-CE2 4.05Å; A4-F9 HydrophobicContact CB-CG 4.19Å; A4-N57 HydrophobicContact CB-CB 4.48Å; A4-N57 WeakPolarHBondContact CB-O 3.19Å; A4-N57 PolarHBondContact N-O 2.96Å
5	S	93	Very high	93.5	Very high	107 Å²	107	61.5 Å²	61.5	75%	0.748	37%	0.372	S	S	*	.			trans	-148.7	157.2	174.3	62.1	0	0	0	0	110.1	F7	S5-F7 WeakPolarHBondContact O-CD1 3.47Å
6	G	90.5	Very high	93.7	Very high	89 Å²	89	58.3 Å²	58.3	92%	0.918	35%	0.351	S	S	*	.	S	Bend	trans	86.7	0.3	177.7	0	0	0	0	0	115.9
7	F	88.3	Confident	93.9	Very high	57 Å²	57	55 Å²	55	25%	0.25	33%	0.331	C	S	.	.	S	Bend	trans	-152.9	165	175.4	65.2	-79.7	0	0	0	111.2	A4 S5 F9 Y12 M14 I78	A4-F7 HydrophobicContact CB-CE1 3.71Å; A4-F7 HydrophobicContact CB-CE2 4.41Å; A4-F7 HydrophobicContact CB-CZ 3.49Å; A4-F7 VanDerWaalsContact CB-CZ 3.49Å; S5-F7 WeakPolarHBondContact O-CD1 3.47Å; F7-F9 HydrophobicContact CE2-CB 4.21Å; F7-F9 HydrophobicContact CE2-CD2 4.21Å; F7-F9 HydrophobicContact CZ-CD2 4.22Å; F7-F9 PolarHBondContact O-N 3.22Å; F7-Y12 AromaticContact CD2-CD2 3.73Å; F7-Y12 HydrophobicContact CD2-CD2 3.73Å; F7-Y12 HydrophobicContact CD2-CE2 4.14Å; F7-Y12 HydrophobicContact CD2-CG 4.44Å; F7-Y12 HydrophobicContact CE2-CD2 4.29Å; F7-M14 HydrophobicContact CE2-SD 4.1Å; F7-M14 HydrophobicContact CZ-CE 4.27Å; F7-M14 HydrophobicContact CZ-SD 4.16Å; F7-I78 HydrophobicContact CD1-CD1 3.56Å; F7-I78 HydrophobicContact CD2-CD1 3.78Å; F7-I78 HydrophobicContact CE1-CD1 3.26Å; F7-I78 HydrophobicContact CE1-CG1 4.01Å; F7-I78 HydrophobicContact CE2-CD1 3.45Å; F7-I78 VanDerWaalsContact CE2-CD1 3.45Å; F7-I78 HydrophobicContact CE2-CG1 3.87Å; F7-I78 HydrophobicContact CG-CD1 3.83Å; F7-I78 HydrophobicContact CZ-CD1 3.18Å; F7-I78 HydrophobicContact CZ-CG1 3.52Å
8	D	91.4	Very high	94.1	Very high	80 Å²	80	53.1 Å²	53.1	43%	0.428	32%	0.317	S	S	.	.			trans	-76.9	86.9	174.7	-177.6	-2.9	0	0	0	110.6	S10 R11 Y12	D8-S10 PolarHBondContact O-N 3.24Å; D8-S10 WeakPolarHBondContact OD1-CB 3.28Å; D8-S10 PolarHBondContact OD1-N 2.92Å; D8-S10 PolarHBondContact OD1-OG 3.12Å; D8-R11 HydrophobicContact CB-CG 4.41Å; D8-R11 PolarHBondContact O-N 2.98Å; D8-R11 WeakPolarHBondContact OD2-CD 3.36Å; D8-R11 VanDerWaalsContact OD2-CG 3.23Å; D8-R11 WeakPolarHBondContact OD2-CG 3.32Å; D8-Y12 WeakPolarHBondContact O-CD2 3.24Å
9	F	92.8	Very high	94.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-47.4	-36.9	-178.9	179.2	-99.7	0	0	0	113.2	A4 F7 R11 Y12 M14 R52 N54 N57 L59	A4-F9 HydrophobicContact CB-CB 4.31Å; A4-F9 HydrophobicContact CB-CD2 3.42Å; A4-F9 VanDerWaalsContact CB-CD2 3.42Å; A4-F9 HydrophobicContact CB-CE2 4.05Å; A4-F9 HydrophobicContact CB-CG 4.19Å; F7-F9 HydrophobicContact CE2-CB 4.21Å; F7-F9 HydrophobicContact CE2-CD2 4.21Å; F7-F9 HydrophobicContact CZ-CD2 4.22Å; F7-F9 PolarHBondContact O-N 3.22Å; F9-R11 PolarHBondContact O-N 3.31Å; F9-R11 VanDerWaalsContact O-N 3.14Å; F9-Y12 PolarHBondContact O-N 2.97Å; F9-M14 HydrophobicContact CD2-CE 4.3Å; F9-M14 HydrophobicContact CD2-CG 4.07Å; F9-M14 HydrophobicContact CD2-SD 3.91Å; F9-M14 HydrophobicContact CE2-CE 3.95Å; F9-M14 HydrophobicContact CE2-CG 3.52Å; F9-M14 HydrophobicContact CE2-SD 3.83Å; F9-M14 HydrophobicContact CZ-CG 4Å; F9-R52 VanDerWaalsContact CD1-NH2 3.26Å; F9-R52 HydrophobicContact CE1-CB 4.2Å; F9-R52 HydrophobicContact CZ-CB 4.14Å; F9-R52 PolarHBondContact O-NH2 3.12Å; F9-N54 WeakPolarHBondContact CD1-OD1 3.42Å; F9-N54 WeakPolarHBondContact CE1-OD1 3.45Å; F9-N57 HydrophobicContact CB-CB 3.93Å; F9-N57 WeakPolarHBondContact CB-OD1 3.47Å; F9-N57 HydrophobicContact CD1-CB 4.38Å; F9-N57 HydrophobicContact CG-CB 4.14Å; F9-L59 HydrophobicContact CE2-CB 4.32Å; F9-L59 HydrophobicContact CZ-CB 4.22Å
10	S	92.8	Very high	94.4	Very high	48 Å²	48	52.2 Å²	52.2	34%	0.336	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-65.6	-16.4	-175.8	77.6	0	0	0	0	114	D8 P33	D8-S10 PolarHBondContact O-N 3.24Å; D8-S10 WeakPolarHBondContact OD1-CB 3.28Å; D8-S10 PolarHBondContact OD1-N 2.92Å; D8-S10 PolarHBondContact OD1-OG 3.12Å; S10-P33 VanDerWaalsContact O-CB 3.28Å; S10-P33 WeakPolarHBondContact O-CB 3.29Å
11	R	91.2	Very high	94.5	Very high	188 Å²	188	54.7 Å²	54.7	71%	0.709	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-99.4	-11	-176.7	-66.4	-172.7	70.9	178	2.6	114.6	D8 F9	D8-R11 HydrophobicContact CB-CG 4.41Å; D8-R11 PolarHBondContact O-N 2.98Å; D8-R11 WeakPolarHBondContact OD2-CD 3.36Å; D8-R11 VanDerWaalsContact OD2-CG 3.23Å; D8-R11 WeakPolarHBondContact OD2-CG 3.32Å; F9-R11 PolarHBondContact O-N 3.31Å; F9-R11 VanDerWaalsContact O-N 3.14Å
12	Y	91.2	Very high	94.4	Very high	75 Å²	75	53.8 Å²	53.8	29%	0.294	34%	0.335	S	S	.	.	S	Bend	trans	-111.3	150.9	-174.7	-61.1	-94.5	0	0	0	111.9	F7 D8 F9 R52 I78 Y80	F7-Y12 AromaticContact CD2-CD2 3.73Å; F7-Y12 HydrophobicContact CD2-CD2 3.73Å; F7-Y12 HydrophobicContact CD2-CE2 4.14Å; F7-Y12 HydrophobicContact CD2-CG 4.44Å; F7-Y12 HydrophobicContact CE2-CD2 4.29Å; D8-Y12 WeakPolarHBondContact O-CD2 3.24Å; F9-Y12 PolarHBondContact O-N 2.97Å; Y12-R52 PolarHBondContact O-NH1 2.85Å; Y12-I78 HydrophobicContact CD1-CG2 3.91Å; Y12-I78 HydrophobicContact CG-CG2 3.99Å; Y12-Y80 HydrophobicContact CD1-CD2 4.01Å; Y12-Y80 AromaticContact CE1-CD2 3.58Å; Y12-Y80 HydrophobicContact CE1-CD2 3.58Å; Y12-Y80 HydrophobicContact CE1-CE2 4.03Å
13	W	94	Very high	94.4	Very high	52 Å²	52	59.9 Å²	59.9	20%	0.197	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	147.8	164.2	-72.4	65.1	0	0	0	109.1	E30 I31 N32 P33 T37 I79 Y81	W13-E30 HydrophobicContact CE3-CB 4.28Å; W13-E30 HydrophobicContact CE3-CG 3.58Å; W13-E30 HydrophobicContact CZ3-CG 3.69Å; W13-E30 WeakPolarHBondContact CZ3-OE1 3.38Å; W13-I31 WeakPolarHBondContact CA-O 3.3Å; W13-N32 VanDerWaalsContact CD2-CA 3.5Å; W13-N32 HydrophobicContact CD2-CB 3.56Å; W13-N32 HydrophobicContact CE3-CB 3.8Å; W13-N32 HydrophobicContact CG-CB 4.29Å; W13-N32 HydrophobicContact CH2-CB 3.6Å; W13-N32 HydrophobicContact CZ2-CB 3.33Å; W13-N32 HydrophobicContact CZ3-CB 3.82Å; W13-P33 VanDerWaalsContact CD1-CD 3.42Å; W13-T37 HydrophobicContact CH2-CG2 3.92Å; W13-T37 HydrophobicContact CZ3-CG2 4.4Å; W13-I79 HydrophobicContact CB-CB 4.21Å; W13-I79 PolarHBondContact O-N 2.8Å; W13-Y81 HydrophobicContact CB-CD2 4.16Å; W13-Y81 HydrophobicContact CB-CE2 3.53Å; W13-Y81 AromaticContact CD1-CD2 3.43Å; W13-Y81 VanDerWaalsContact CD1-CD2 3.43Å; W13-Y81 AromaticContact CD1-CE2 3.37Å; W13-Y81 HydrophobicContact CD2-CD2 4.2Å; W13-Y81 AromaticContact CD2-CE2 3.37Å; W13-Y81 HydrophobicContact CD2-CE2 3.37Å; W13-Y81 AromaticContact CD2-CZ 3.79Å; W13-Y81 AromaticContact CE2-CE2 3.71Å; W13-Y81 AromaticContact CE3-CE2 4Å; W13-Y81 HydrophobicContact CE3-CE2 4Å; W13-Y81 AromaticContact CG-CD2 3.71Å; W13-Y81 HydrophobicContact CG-CD2 3.71Å; W13-Y81 AromaticContact CG-CE2 3.16Å; W13-Y81 HydrophobicContact CG-CE2 3.16Å; W13-Y81 AromaticContact NE1-CD2 3.78Å; W13-Y81 AromaticContact NE1-CE2 3.7Å
14	M	95.6	Very high	94.3	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.02	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.4	-175.8	-62.2	-59.1	-52.8	0	0	109.2	F7 F9 E30 I31 L59 I78	F7-M14 HydrophobicContact CE2-SD 4.1Å; F7-M14 HydrophobicContact CZ-CE 4.27Å; F7-M14 HydrophobicContact CZ-SD 4.16Å; F9-M14 HydrophobicContact CD2-CE 4.3Å; F9-M14 HydrophobicContact CD2-CG 4.07Å; F9-M14 HydrophobicContact CD2-SD 3.91Å; F9-M14 HydrophobicContact CE2-CE 3.95Å; F9-M14 HydrophobicContact CE2-CG 3.52Å; F9-M14 HydrophobicContact CE2-SD 3.83Å; F9-M14 HydrophobicContact CZ-CG 4Å; M14-E30 CarbonylContact O-C 3.54Å; M14-E30 WeakPolarHBondContact O-CA 3.36Å; M14-I31 HydrophobicContact CB-CG2 4.28Å; M14-I31 PolarHBondContact N-O 3.09Å; M14-I31 PolarHBondContact O-N 3.2Å; M14-L59 HydrophobicContact CB-CD1 3.66Å; M14-L59 HydrophobicContact CB-CD2 3.84Å; M14-L59 HydrophobicContact CB-CG 4.26Å; M14-L59 HydrophobicContact CG-CD1 4.5Å; M14-I78 HydrophobicContact CE-CG1 3.99Å; M14-I78 HydrophobicContact SD-CB 4.48Å; M14-I78 HydrophobicContact SD-CG1 4.03Å
15	S	96.4	Very high	94.4	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	153.6	-175.7	-95.4	0	0	0	0	112.6	W27 G29 E30 C76 A77 I79	S15-W27 PolarHBondContact OG-NE1 2.75Å; S15-G29 WeakPolarHBondContact CA-O 3.45Å; S15-G29 PolarHBondContact OG-O 2.76Å; S15-E30 VanDerWaalsContact OG-CB 3.29Å; S15-E30 WeakPolarHBondContact OG-CB 3.44Å; S15-C76 CarbonylContact O-C 3.53Å; S15-C76 VanDerWaalsContact O-CA 3.26Å; S15-C76 WeakPolarHBondContact O-CA 3.42Å; S15-A77 PolarHBondContact N-O 3.21Å; S15-A77 PolarHBondContact O-N 3.22Å; S15-I79 WeakPolarHBondContact OG-CD1 3.23Å
16	W	97.8	Very high	94.5	Very high	9 Å²	9	60.8 Å²	60.8	3%	0.034	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	137.9	160.8	-75.9	99.5	0	0	0	110.4	C2 I28 G29 L59 Y60 L61 Y75 C76	C2-W16 HydrophobicContact CB-CH2 3.78Å; C2-W16 HydrophobicContact CB-CZ2 3.99Å; W16-I28 HydrophobicContact CB-CB 4.09Å; W16-I28 HydrophobicContact CB-CD1 4.18Å; W16-I28 WeakPolarHBondContact O-CB 3.37Å; W16-I28 PolarHBondContact O-N 3.14Å; W16-G29 PolarHBondContact N-O 2.85Å; W16-G29 PolarHBondContact O-N 2.88Å; W16-L59 HydrophobicContact CD2-CD2 4.26Å; W16-L59 HydrophobicContact CG-CD2 4.26Å; W16-L59 HydrophobicContact CZ2-CD2 4.13Å; W16-L59 HydrophobicContact CZ2-CG 4.24Å; W16-L59 VanDerWaalsContact NE1-CG 3.31Å; W16-Y60 PolarHBondContact NE1-O 3.05Å; W16-Y60 VanDerWaalsContact NE1-O 3.12Å; W16-L61 HydrophobicContact CB-CD1 4.28Å; W16-L61 HydrophobicContact CB-CD2 4.29Å; W16-L61 HydrophobicContact CD2-CB 3.81Å; W16-L61 HydrophobicContact CD2-CD1 4.49Å; W16-L61 HydrophobicContact CD2-CD2 3.9Å; W16-L61 HydrophobicContact CD2-CG 4.3Å; W16-L61 HydrophobicContact CE3-CB 4.39Å; W16-L61 HydrophobicContact CE3-CD2 4.02Å; W16-L61 HydrophobicContact CG-CB 4.11Å; W16-L61 HydrophobicContact CG-CD1 3.96Å; W16-L61 HydrophobicContact CG-CD2 4.02Å; W16-L61 HydrophobicContact CG-CG 4.28Å; W16-L61 HydrophobicContact CZ2-CB 3.91Å; W16-Y75 CarbonylContact C-O 3.39Å; W16-Y75 WeakPolarHBondContact CA-O 3.41Å; W16-C76 HydrophobicContact CE3-CB 4.41Å; W16-C76 HydrophobicContact CH2-CB 4.25Å; W16-C76 HydrophobicContact CZ2-CB 4.46Å; W16-C76 HydrophobicContact CZ3-CB 4.23Å
17	V	97.4	Very high	94.8	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.018	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	145.7	177.1	-178.1	0	0	0	0	107.6	L25 E26 Y74 Y75 M89 W92	V17-L25 HydrophobicContact CG1-CB 3.9Å; V17-L25 HydrophobicContact CG1-CD2 3.81Å; V17-L25 HydrophobicContact CG1-CG 4.39Å; V17-E26 CarbonylContact C-O 3.59Å; V17-E26 WeakPolarHBondContact CA-O 3.3Å; V17-E26 WeakPolarHBondContact CG1-O 3.21Å; V17-Y74 CarbonylContact O-C 3.41Å; V17-Y74 WeakPolarHBondContact O-CA 3.47Å; V17-Y75 PolarHBondContact N-O 2.97Å; V17-Y75 PolarHBondContact O-N 2.77Å; V17-M89 HydrophobicContact CG2-CE 3.91Å; V17-M89 HydrophobicContact CG2-SD 3.84Å; V17-W92 HydrophobicContact CB-CH2 3.95Å; V17-W92 HydrophobicContact CB-CZ3 3.68Å; V17-W92 HydrophobicContact CG1-CH2 3.85Å; V17-W92 HydrophobicContact CG1-CZ3 3.83Å; V17-W92 HydrophobicContact CG2-CH2 3.7Å; V17-W92 HydrophobicContact CG2-CZ3 3.83Å
18	R	97.2	Very high	95.2	Very high	20 Å²	20	57.1 Å²	57.1	8%	0.075	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	158.5	172.3	66	179.1	-168.5	172.7	6.6	112.7	E26 I28 L44 D70 A72 L73 Y74	R18-E26 HydrophobicContact CG-CB 4.17Å; R18-E26 IonicContact CZ-OE2 3.89Å; R18-E26 PolarHBondContact N-O 2.97Å; R18-E26 IonicContact NE-OE2 2.73Å; R18-E26 PolarHBondContact NE-OE2 2.77Å; R18-E26 IonicContact NH2-OE1 3.73Å; R18-E26 IonicContact NH2-OE2 2.77Å; R18-E26 PolarHBondContact NH2-OE2 2.81Å; R18-E26 PolarHBondContact O-N 3.09Å; R18-I28 HydrophobicContact CB-CD1 3.98Å; R18-I28 HydrophobicContact CB-CG1 4.36Å; R18-I28 HydrophobicContact CG-CD1 4.09Å; R18-I28 HydrophobicContact CG-CG1 4.02Å; R18-L44 VanDerWaalsContact NH2-CD2 3.29Å; R18-D70 IonicContact CZ-OD1 3.19Å; R18-D70 IonicContact NH1-OD1 3.76Å; R18-D70 PolarHBondContact NH1-OD1 2.79Å; R18-D70 IonicContact NH2-OD1 3.95Å; R18-A72 HydrophobicContact CB-CB 3.97Å; R18-L73 CarbonylContact C-O 3.59Å; R18-L73 WeakPolarHBondContact CA-O 3.38Å; R18-L73 WeakPolarHBondContact CB-O 3.5Å; R18-Y74 HydrophobicContact CB-CD1 3.87Å; R18-Y74 HydrophobicContact CB-CE1 3.85Å; R18-Y74 HydrophobicContact CB-CG 4.34Å
19	Q	97.7	Very high	95.4	Very high	66 Å²	66	53.3 Å²	53.3	31%	0.308	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	105.9	172.6	-169.6	176.9	23.7	0	0	109.4	K23 L25 A72 L73 Y75	Q19-K23 WeakPolarHBondContact CG-O 3.49Å; Q19-K23 PolarHBondContact NE2-O 2.77Å; Q19-L25 HydrophobicContact CB-CD2 4.07Å; Q19-A72 WeakPolarHBondContact O-CA 3.28Å; Q19-A72 VanDerWaalsContact O-CB 3.3Å; Q19-A72 WeakPolarHBondContact O-CB 3.45Å; Q19-L73 HydrophobicContact CB-CB 4.46Å; Q19-L73 PolarHBondContact N-O 3.1Å; Q19-L73 PolarHBondContact O-N 3.39Å; Q19-Y75 HydrophobicContact CB-CE2 4.05Å
20	A	96.6	Very high	95.6	Very high	22 Å²	22	54.1 Å²	54.1	18%	0.182	29%	0.293	C	S	.	.			trans	-71.8	152.8	172.7	0	0	0	0	0	110.6	G22 K23 A72	A20-G22 PolarHBondContact O-N 2.78Å; A20-K23 HydrophobicContact CB-CB 4.09Å; A20-K23 HydrophobicContact CB-CG 3.96Å; A20-K23 WeakPolarHBondContact O-CB 3.48Å; A20-K23 PolarHBondContact O-N 2.61Å; A20-A72 HydrophobicContact CB-CB 4.48Å
21	P	95.8	Very high	95.8	Very high	106 Å²	106	51.9 Å²	51.9	69%	0.688	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	126.5	177.3	-27	34.6	0	0	0	112.2	K23 T71	P21-K23 PolarHBondContact O-N 2.93Å; P21-T71 VanDerWaalsContact CD-O 3.24Å; P21-T71 WeakPolarHBondContact CD-O 3.21Å
22	G	95.7	Very high	96	Very high	89 Å²	89	43.6 Å²	43.6	92%	0.918	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.6	11.9	-179	0	0	0	0	0	115.2	A20	A20-G22 PolarHBondContact O-N 2.78Å
23	K	95.6	Very high	96.2	Very high	147 Å²	147	41.6 Å²	41.6	64%	0.639	24%	0.243	S	C	*	.			trans	-115.2	162.7	176.3	-58.8	-64.5	-175.6	177.6	0	111.6	Q19 A20 P21	Q19-K23 WeakPolarHBondContact CG-O 3.49Å; Q19-K23 PolarHBondContact NE2-O 2.77Å; A20-K23 HydrophobicContact CB-CB 4.09Å; A20-K23 HydrophobicContact CB-CG 3.96Å; A20-K23 WeakPolarHBondContact O-CB 3.48Å; A20-K23 PolarHBondContact O-N 2.61Å; P21-K23 PolarHBondContact O-N 2.93Å
24	G	95.3	Very high	96.2	Very high	54 Å²	54	44.2 Å²	44.2	56%	0.557	26%	0.261	S	S	*	.			trans	-73	178.8	169.4	0	0	0	0	0	112.3
25	L	95.4	Very high	96.3	Very high	102 Å²	102	46.5 Å²	46.5	53%	0.534	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.2	172.1	-68.2	166.7	0	0	0	110.1	V17 Q19 Y75 W92	V17-L25 HydrophobicContact CG1-CB 3.9Å; V17-L25 HydrophobicContact CG1-CD2 3.81Å; V17-L25 HydrophobicContact CG1-CG 4.39Å; Q19-L25 HydrophobicContact CB-CD2 4.07Å; L25-Y75 HydrophobicContact CD2-CD2 4.24Å; L25-Y75 HydrophobicContact CD2-CE2 4.15Å; L25-W92 HydrophobicContact CD1-CH2 3.98Å; L25-W92 HydrophobicContact CD1-CZ3 4.4Å; L25-W92 HydrophobicContact CD2-CZ3 4.27Å
26	E	95.9	Very high	96.3	Very high	65 Å²	65	50.6 Å²	50.6	30%	0.304	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119	175.7	-176.3	-176.8	-162.3	0	0	108.7	V17 R18 L44	V17-E26 CarbonylContact C-O 3.59Å; V17-E26 WeakPolarHBondContact CA-O 3.3Å; V17-E26 WeakPolarHBondContact CG1-O 3.21Å; R18-E26 HydrophobicContact CG-CB 4.17Å; R18-E26 IonicContact CZ-OE2 3.89Å; R18-E26 PolarHBondContact N-O 2.97Å; R18-E26 IonicContact NE-OE2 2.73Å; R18-E26 PolarHBondContact NE-OE2 2.77Å; R18-E26 IonicContact NH2-OE1 3.73Å; R18-E26 IonicContact NH2-OE2 2.77Å; R18-E26 PolarHBondContact NH2-OE2 2.81Å; R18-E26 PolarHBondContact O-N 3.09Å; E26-L44 HydrophobicContact CG-CD1 4.27Å
27	W	96.1	Very high	96.2	Very high	70 Å²	70	52.8 Å²	52.8	27%	0.265	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	132.7	175.7	179.1	75.4	0	0	0	110.5	S15 G29 E30 N39 T41 M89	S15-W27 PolarHBondContact OG-NE1 2.75Å; W27-G29 VanDerWaalsContact CE2-C 3.48Å; W27-G29 VanDerWaalsContact CE2-CA 3.45Å; W27-G29 PolarHBondContact NE1-O 2.82Å; W27-E30 HydrophobicContact CH2-CG 4.46Å; W27-E30 HydrophobicContact CZ2-CB 3.79Å; W27-E30 HydrophobicContact CZ2-CG 3.68Å; W27-N39 HydrophobicContact CH2-CB 3.75Å; W27-N39 HydrophobicContact CZ2-CB 4.36Å; W27-T41 VanDerWaalsContact CE3-OG1 3.29Å; W27-T41 WeakPolarHBondContact O-CB 3.11Å; W27-T41 PolarHBondContact O-OG1 2.73Å; W27-M89 VanDerWaalsContact CD1-CE 3.45Å; W27-M89 HydrophobicContact CG-CE 4.41Å
28	I	96.9	Very high	96.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-48.2	178.9	-62.9	177	0	0	0	110.1	W16 R18 Y40 T41 L44 F48 L61 Y74	W16-I28 HydrophobicContact CB-CB 4.09Å; W16-I28 HydrophobicContact CB-CD1 4.18Å; W16-I28 WeakPolarHBondContact O-CB 3.37Å; W16-I28 PolarHBondContact O-N 3.14Å; R18-I28 HydrophobicContact CB-CD1 3.98Å; R18-I28 HydrophobicContact CB-CG1 4.36Å; R18-I28 HydrophobicContact CG-CD1 4.09Å; R18-I28 HydrophobicContact CG-CG1 4.02Å; I28-Y40 WeakPolarHBondContact O-CA 3.42Å; I28-T41 PolarHBondContact O-N 2.8Å; I28-L44 HydrophobicContact CB-CD1 4.46Å; I28-L44 HydrophobicContact CG1-CD1 4.1Å; I28-F48 HydrophobicContact CG2-CB 4Å; I28-F48 HydrophobicContact CG2-CD2 3.78Å; I28-F48 HydrophobicContact CG2-CG 4.01Å; I28-L61 HydrophobicContact CD1-CD2 3.9Å; I28-L61 HydrophobicContact CG2-CD1 4.31Å; I28-Y74 HydrophobicContact CD1-CD1 3.65Å; I28-Y74 HydrophobicContact CD1-CE1 3.6Å
29	G	96.4	Very high	96.2	Very high	0 Å²	0	58 Å²	58	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.8	172.8	-172.1	0	0	0	0	0	112.2	S15 W16 W27 N39 I50	S15-G29 WeakPolarHBondContact CA-O 3.45Å; S15-G29 PolarHBondContact OG-O 2.76Å; W16-G29 PolarHBondContact N-O 2.85Å; W16-G29 PolarHBondContact O-N 2.88Å; W27-G29 VanDerWaalsContact CE2-C 3.48Å; W27-G29 VanDerWaalsContact CE2-CA 3.45Å; W27-G29 PolarHBondContact NE1-O 2.82Å; G29-N39 CarbonylContact C-O 3.56Å; G29-N39 WeakPolarHBondContact CA-O 3.02Å; G29-I50 WeakPolarHBondContact O-CD1 3.36Å
30	E	96.1	Very high	96.1	Very high	16 Å²	16	56.9 Å²	56.9	8%	0.075	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.6	180	72.2	-167.7	175.2	0	0	111.5	W13 M14 S15 W27 I38 N39 I79 Y81	W13-E30 HydrophobicContact CE3-CB 4.28Å; W13-E30 HydrophobicContact CE3-CG 3.58Å; W13-E30 HydrophobicContact CZ3-CG 3.69Å; W13-E30 WeakPolarHBondContact CZ3-OE1 3.38Å; M14-E30 CarbonylContact O-C 3.54Å; M14-E30 WeakPolarHBondContact O-CA 3.36Å; S15-E30 VanDerWaalsContact OG-CB 3.29Å; S15-E30 WeakPolarHBondContact OG-CB 3.44Å; W27-E30 HydrophobicContact CH2-CG 4.46Å; W27-E30 HydrophobicContact CZ2-CB 3.79Å; W27-E30 HydrophobicContact CZ2-CG 3.68Å; E30-I38 VanDerWaalsContact O-CA 3.28Å; E30-I38 WeakPolarHBondContact O-CA 3.44Å; E30-I38 WeakPolarHBondContact O-CG2 3.35Å; E30-N39 HydrophobicContact CG-CB 4.03Å; E30-N39 PolarHBondContact N-O 3.18Å; E30-N39 PolarHBondContact O-N 2.77Å; E30-N39 PolarHBondContact OE1-ND2 2.83Å; E30-I79 HydrophobicContact CB-CD1 4.37Å; E30-I79 WeakPolarHBondContact OE2-CD1 3.21Å; E30-Y81 PolarHBondContact OE1-OH 2.79Å; E30-Y81 PolarHBondContact OE2-OH 3Å
31	I	97.1	Very high	96.1	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.6	176.3	-174.9	161.3	0	0	0	110.2	W13 M14 I38 I50 R52 L59	W13-I31 WeakPolarHBondContact CA-O 3.3Å; M14-I31 HydrophobicContact CB-CG2 4.28Å; M14-I31 PolarHBondContact N-O 3.09Å; M14-I31 PolarHBondContact O-N 3.2Å; I31-I38 HydrophobicContact CB-CG1 4.42Å; I31-I38 HydrophobicContact CD1-CD1 3.93Å; I31-I38 HydrophobicContact CD1-CG1 3.98Å; I31-I38 HydrophobicContact CG1-CD1 4.49Å; I31-I38 HydrophobicContact CG1-CG1 3.99Å; I31-I50 HydrophobicContact CB-CG2 3.82Å; I31-I50 HydrophobicContact CD1-CG2 4.49Å; I31-I50 HydrophobicContact CG2-CG2 3.61Å; I31-R52 HydrophobicContact CD1-CG 3.93Å; I31-R52 HydrophobicContact CG1-CG 4.37Å; I31-R52 HydrophobicContact CG2-CB 4.47Å; I31-L59 HydrophobicContact CG2-CD1 3.51Å
32	N	94.9	Very high	96.1	Very high	13 Å²	13	57.8 Å²	57.8	7%	0.07	35%	0.346	C	S	.	.			trans	-78.5	166.8	-179.7	79.4	-30	0	0	0	112.3	W13 D34 S35 S36 T37 R52	W13-N32 VanDerWaalsContact CD2-CA 3.5Å; W13-N32 HydrophobicContact CD2-CB 3.56Å; W13-N32 HydrophobicContact CE3-CB 3.8Å; W13-N32 HydrophobicContact CG-CB 4.29Å; W13-N32 HydrophobicContact CH2-CB 3.6Å; W13-N32 HydrophobicContact CZ2-CB 3.33Å; W13-N32 HydrophobicContact CZ3-CB 3.82Å; N32-D34 VanDerWaalsContact C-N 3.33Å; N32-D34 VanDerWaalsContact CG-OD1 3.24Å; N32-D34 PolarHBondContact ND2-OD1 2.92Å; N32-D34 PolarHBondContact O-N 2.93Å; N32-D34 PolarHBondContact OD1-OD1 3.28Å; N32-S35 PolarHBondContact O-N 3.39Å; N32-S35 VanDerWaalsContact OD1-C 3.29Å; N32-S35 VanDerWaalsContact OD1-CA 3.24Å; N32-S35 WeakPolarHBondContact OD1-CA 2.99Å; N32-S35 PolarHBondContact OD1-N 2.97Å; N32-S36 PolarHBondContact ND2-OG 3.5Å; N32-S36 PolarHBondContact OD1-N 3Å; N32-T37 PolarHBondContact N-O 2.02Å; N32-T37 VanDerWaalsContact N-O 3.11Å; N32-T37 PolarHBondContact OD1-N 2.96Å; N32-T37 PolarHBondContact OD1-O 3.21Å; N32-R52 VanDerWaalsContact O-CD 3.31Å; N32-R52 WeakPolarHBondContact O-CD 3.17Å; N32-R52 PolarHBondContact O-NH1 3.17Å
33	P	95.3	Very high	95.9	Very high	33 Å²	33	57.4 Å²	57.4	21%	0.214	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.9	-47.6	179.2	-41.8	44.2	0	0	0	116.7	S10 W13 R52 N54	S10-P33 VanDerWaalsContact O-CB 3.28Å; S10-P33 WeakPolarHBondContact O-CB 3.29Å; W13-P33 VanDerWaalsContact CD1-CD 3.42Å; P33-R52 VanDerWaalsContact CA-NH1 3.26Å; P33-N54 PolarHBondContact O-ND2 2.82Å
34	D	95.2	Very high	95.8	Very high	108 Å²	108	50.6 Å²	50.6	58%	0.578	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	4.4	-174.1	66.1	11.9	0	0	0	113.5	N32 S36	N32-D34 VanDerWaalsContact C-N 3.33Å; N32-D34 VanDerWaalsContact CG-OD1 3.24Å; N32-D34 PolarHBondContact ND2-OD1 2.92Å; N32-D34 PolarHBondContact O-N 2.93Å; N32-D34 PolarHBondContact OD1-OD1 3.28Å; D34-S36 PolarHBondContact O-N 2.87Å; D34-S36 VanDerWaalsContact OD1-CB 3.25Å; D34-S36 WeakPolarHBondContact OD1-CB 3.45Å; D34-S36 PolarHBondContact OD1-N 3.22Å; D34-S36 PolarHBondContact OD1-OG 2.86Å; D34-S36 PolarHBondContact OD2-OG 2.92Å
35	S	96.8	Very high	95.7	Very high	52 Å²	52	54.1 Å²	54.1	36%	0.364	30%	0.3	S	S	.	.	S	Bend	trans	63	10.4	-178.2	-46.1	0	0	0	0	115.6	N32 T37 R52	N32-S35 PolarHBondContact O-N 3.39Å; N32-S35 VanDerWaalsContact OD1-C 3.29Å; N32-S35 VanDerWaalsContact OD1-CA 3.24Å; N32-S35 WeakPolarHBondContact OD1-CA 2.99Å; N32-S35 PolarHBondContact OD1-N 2.97Å; S35-T37 VanDerWaalsContact C-N 3.29Å; S35-T37 PolarHBondContact O-N 2.61Å; S35-R52 WeakPolarHBondContact OG-CD 3.3Å; S35-R52 WeakPolarHBondContact OG-CG 3.46Å
36	S	96.9	Very high	95.6	Very high	86 Å²	86	55.1 Å²	55.1	60%	0.601	31%	0.306	S	S	*	.	S	Bend	trans	-72.8	-22.7	177.2	62.8	0	0	0	0	113.3	N32 D34	N32-S36 PolarHBondContact ND2-OG 3.5Å; N32-S36 PolarHBondContact OD1-N 3Å; D34-S36 PolarHBondContact O-N 2.87Å; D34-S36 VanDerWaalsContact OD1-CB 3.25Å; D34-S36 WeakPolarHBondContact OD1-CB 3.45Å; D34-S36 PolarHBondContact OD1-N 3.22Å; D34-S36 PolarHBondContact OD1-OG 2.86Å; D34-S36 PolarHBondContact OD2-OG 2.92Å
37	T	96.6	Very high	95.6	Very high	55 Å²	55	53 Å²	53	34%	0.337	30%	0.296	S	S	.	.			trans	-127.5	130.5	-178	-55.2	0	0	0	0	110.8	W13 N32 S35	W13-T37 HydrophobicContact CH2-CG2 3.92Å; W13-T37 HydrophobicContact CZ3-CG2 4.4Å; N32-T37 PolarHBondContact N-O 2.02Å; N32-T37 VanDerWaalsContact N-O 3.11Å; N32-T37 PolarHBondContact OD1-N 2.96Å; N32-T37 PolarHBondContact OD1-O 3.21Å; S35-T37 VanDerWaalsContact C-N 3.29Å; S35-T37 PolarHBondContact O-N 2.61Å
38	I	97.1	Very high	95.6	Very high	64 Å²	64	49.7 Å²	49.7	33%	0.328	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	120.2	173.7	-44.7	178.3	0	0	0	108.8	E30 I31 Y40 I50	E30-I38 VanDerWaalsContact O-CA 3.28Å; E30-I38 WeakPolarHBondContact O-CA 3.44Å; E30-I38 WeakPolarHBondContact O-CG2 3.35Å; I31-I38 HydrophobicContact CB-CG1 4.42Å; I31-I38 HydrophobicContact CD1-CD1 3.93Å; I31-I38 HydrophobicContact CD1-CG1 3.98Å; I31-I38 HydrophobicContact CG1-CD1 4.49Å; I31-I38 HydrophobicContact CG1-CG1 3.99Å; I38-Y40 HydrophobicContact CB-CE2 3.92Å; I38-Y40 HydrophobicContact CG2-CD2 4.02Å; I38-Y40 HydrophobicContact CG2-CE1 4.41Å; I38-Y40 HydrophobicContact CG2-CE2 3.26Å; I38-I50 HydrophobicContact CG2-CB 4.18Å
39	N	96.2	Very high	95.6	Very high	67 Å²	67	53.6 Å²	53.6	36%	0.358	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	148	175.1	-57.9	-45.7	0	0	0	109.7	W27 G29 E30	W27-N39 HydrophobicContact CH2-CB 3.75Å; W27-N39 HydrophobicContact CZ2-CB 4.36Å; G29-N39 CarbonylContact C-O 3.56Å; G29-N39 WeakPolarHBondContact CA-O 3.02Å; E30-N39 HydrophobicContact CG-CB 4.03Å; E30-N39 PolarHBondContact N-O 3.18Å; E30-N39 PolarHBondContact O-N 2.77Å; E30-N39 PolarHBondContact OE1-ND2 2.83Å
40	Y	96.8	Very high	95.6	Very high	44 Å²	44	53.7 Å²	53.7	17%	0.173	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.6	-178.8	-70.2	-88.7	0	0	0	110.9	I28 I38 K45 F48 I50	I28-Y40 WeakPolarHBondContact O-CA 3.42Å; I38-Y40 HydrophobicContact CB-CE2 3.92Å; I38-Y40 HydrophobicContact CG2-CD2 4.02Å; I38-Y40 HydrophobicContact CG2-CE1 4.41Å; I38-Y40 HydrophobicContact CG2-CE2 3.26Å; Y40-K45 HydrophobicContact CD2-CD 4.38Å; Y40-K45 HydrophobicContact CD2-CG 3.94Å; Y40-K45 HydrophobicContact CG-CB 4.1Å; Y40-K45 HydrophobicContact CG-CG 3.98Å; Y40-F48 WeakPolarHBondContact CE1-O 3.48Å; Y40-I50 HydrophobicContact CD1-CD1 4.37Å; Y40-I50 HydrophobicContact CE1-CD1 3.88Å; Y40-I50 HydrophobicContact CE1-CG1 3.88Å; Y40-I50 PolarHBondContact OH-N 2.77Å
41	T	96.1	Very high	95.7	Very high	30 Å²	30	55.3 Å²	55.3	18%	0.184	32%	0.317	C	S	.	.			trans	-64.7	124.9	157.2	-68	0	0	0	0	108.8	W27 I28 S43 L44 K45	W27-T41 VanDerWaalsContact CE3-OG1 3.29Å; W27-T41 WeakPolarHBondContact O-CB 3.11Å; W27-T41 PolarHBondContact O-OG1 2.73Å; I28-T41 PolarHBondContact O-N 2.8Å; T41-S43 VanDerWaalsContact C-N 3.28Å; T41-S43 WeakPolarHBondContact CG2-OG 3.26Å; T41-S43 PolarHBondContact O-N 3.03Å; T41-S43 VanDerWaalsContact O-N 3.14Å; T41-L44 HydrophobicContact CG2-CD1 4.29Å; T41-L44 HydrophobicContact CG2-CG 4.11Å; T41-L44 PolarHBondContact O-N 2.91Å; T41-K45 PolarHBondContact O-N 3.14Å
42	P	95.1	Very high	95.8	Very high	116 Å²	116	56.4 Å²	56.4	75%	0.753	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-38.9	-171.4	-30.7	35.8	0	0	0	114.9	L44	P42-L44 PolarHBondContact O-N 3.28Å
43	S	92.5	Very high	95.9	Very high	82 Å²	82	57.7 Å²	57.7	57%	0.573	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.7	179	55.1	0	0	0	0	114.2	T41	T41-S43 VanDerWaalsContact C-N 3.28Å; T41-S43 WeakPolarHBondContact CG2-OG 3.26Å; T41-S43 PolarHBondContact O-N 3.03Å; T41-S43 VanDerWaalsContact O-N 3.14Å
44	L	93.6	Very high	96	Very high	3 Å²	3	59 Å²	59	2%	0.016	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-15.8	-172.6	-57.9	-172.4	0	0	0	113.3	R18 E26 I28 T41 P42 D46 K47 F48	R18-L44 VanDerWaalsContact NH2-CD2 3.29Å; E26-L44 HydrophobicContact CG-CD1 4.27Å; I28-L44 HydrophobicContact CB-CD1 4.46Å; I28-L44 HydrophobicContact CG1-CD1 4.1Å; T41-L44 HydrophobicContact CG2-CD1 4.29Å; T41-L44 HydrophobicContact CG2-CG 4.11Å; T41-L44 PolarHBondContact O-N 2.91Å; P42-L44 PolarHBondContact O-N 3.28Å; L44-D46 VanDerWaalsContact C-N 3.26Å; L44-D46 PolarHBondContact O-N 3.47Å; L44-K47 PolarHBondContact O-N 2.91Å; L44-F48 HydrophobicContact CB-CD2 3.95Å; L44-F48 HydrophobicContact CB-CE2 4.22Å; L44-F48 HydrophobicContact CD2-CE2 4.26Å; L44-F48 WeakPolarHBondContact O-CD2 3.16Å; L44-F48 PolarHBondContact O-N 2.83Å
45	K	92.6	Very high	96.1	Very high	129 Å²	129	58.4 Å²	58.4	56%	0.561	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-35.6	-175.8	-175.3	178	178.1	-179	0	114.1	Y40 T41 K47	Y40-K45 HydrophobicContact CD2-CD 4.38Å; Y40-K45 HydrophobicContact CD2-CG 3.94Å; Y40-K45 HydrophobicContact CG-CB 4.1Å; Y40-K45 HydrophobicContact CG-CG 3.98Å; T41-K45 PolarHBondContact O-N 3.14Å; K45-K47 VanDerWaalsContact C-N 3.3Å; K45-K47 PolarHBondContact O-N 2.62Å
46	D	93.5	Very high	96.1	Very high	123 Å²	123	62.1 Å²	62.1	66%	0.658	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.3	-177.8	-67.2	-27.1	0	0	0	113.8	L44	L44-D46 VanDerWaalsContact C-N 3.26Å; L44-D46 PolarHBondContact O-N 3.47Å
47	K	95.3	Very high	96.1	Very high	21 Å²	21	61.1 Å²	61.1	9%	0.091	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-33.3	-176.7	-58.5	-172.2	-178.4	-168.9	0	112.5	L44 K45 S64 D70	L44-K47 PolarHBondContact O-N 2.91Å; K45-K47 VanDerWaalsContact C-N 3.3Å; K45-K47 PolarHBondContact O-N 2.62Å; K47-S64 PolarHBondContact O-N 2.86Å; K47-D70 WeakPolarHBondContact CD-OD2 3.29Å; K47-D70 IonicContact NZ-OD1 2.76Å; K47-D70 PolarHBondContact NZ-OD1 2.72Å; K47-D70 IonicContact NZ-OD2 2.8Å; K47-D70 PolarHBondContact NZ-OD2 2.87Å
48	F	96.2	Very high	96.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.9	-169.5	-58.9	-67.6	0	0	0	112	I28 Y40 L44 L61 Q62 M63 V66 D70 Y74	I28-F48 HydrophobicContact CG2-CB 4Å; I28-F48 HydrophobicContact CG2-CD2 3.78Å; I28-F48 HydrophobicContact CG2-CG 4.01Å; Y40-F48 WeakPolarHBondContact CE1-O 3.48Å; L44-F48 HydrophobicContact CB-CD2 3.95Å; L44-F48 HydrophobicContact CB-CE2 4.22Å; L44-F48 HydrophobicContact CD2-CE2 4.26Å; L44-F48 WeakPolarHBondContact O-CD2 3.16Å; L44-F48 PolarHBondContact O-N 2.83Å; F48-L61 HydrophobicContact CB-CD1 3.8Å; F48-L61 HydrophobicContact CD1-CD1 4.19Å; F48-L61 HydrophobicContact CD1-CD2 4.2Å; F48-L61 HydrophobicContact CD1-CG 4.12Å; F48-L61 HydrophobicContact CG-CD1 4.23Å; F48-Q62 CarbonylContact C-O 3.58Å; F48-Q62 WeakPolarHBondContact CA-O 3.48Å; F48-M63 HydrophobicContact CD1-CB 4.37Å; F48-M63 HydrophobicContact CD1-CG 3.79Å; F48-M63 HydrophobicContact CE1-CB 4.35Å; F48-M63 HydrophobicContact CE1-CE 4.04Å; F48-M63 HydrophobicContact CE1-CG 3.74Å; F48-M63 HydrophobicContact CE1-SD 4.11Å; F48-V66 HydrophobicContact CE1-CG1 3.91Å; F48-V66 HydrophobicContact CZ-CG1 4.27Å; F48-D70 HydrophobicContact CZ-CB 4.5Å; F48-Y74 AromaticContact CE1-CE1 3.97Å; F48-Y74 HydrophobicContact CE1-CE1 3.97Å; F48-Y74 HydrophobicContact CZ-CE1 4.01Å
49	I	96.9	Very high	96.2	Very high	81 Å²	81	56.2 Å²	56.2	42%	0.415	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119.8	172.7	-57.3	170	0	0	0	107.6	Q62	I49-Q62 HydrophobicContact CB-CB 4.21Å; I49-Q62 PolarHBondContact N-O 3.04Å; I49-Q62 PolarHBondContact O-N 2.82Å
50	I	97.9	Very high	96.3	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	134.8	175.4	-59.6	172.6	0	0	0	108.7	G29 I31 I38 Y40 L59 Y60 L61	G29-I50 WeakPolarHBondContact O-CD1 3.36Å; I31-I50 HydrophobicContact CB-CG2 3.82Å; I31-I50 HydrophobicContact CD1-CG2 4.49Å; I31-I50 HydrophobicContact CG2-CG2 3.61Å; I38-I50 HydrophobicContact CG2-CB 4.18Å; Y40-I50 HydrophobicContact CD1-CD1 4.37Å; Y40-I50 HydrophobicContact CE1-CD1 3.88Å; Y40-I50 HydrophobicContact CE1-CG1 3.88Å; Y40-I50 PolarHBondContact OH-N 2.77Å; I50-L59 HydrophobicContact CG2-CD1 4.07Å; I50-Y60 WeakPolarHBondContact CA-O 3.2Å; I50-L61 HydrophobicContact CG1-CD1 3.77Å
51	S	98.2	Very high	96.4	Very high	51 Å²	51	55.5 Å²	55.5	36%	0.357	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	165.6	171.5	63.1	0	0	0	0	110.5	Y60	S51-Y60 PolarHBondContact N-O 3.13Å; S51-Y60 PolarHBondContact O-N 3.43Å; S51-Y60 WeakPolarHBondContact OG-CB 3.36Å
52	R	98.1	Very high	96.5	Very high	24 Å²	24	59.4 Å²	59.4	9%	0.091	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	152.5	-178.1	64	-176.2	-66.8	160.2	3	111.6	F9 Y12 I31 N32 P33 S35 N54 T58 L59	F9-R52 VanDerWaalsContact CD1-NH2 3.26Å; F9-R52 HydrophobicContact CE1-CB 4.2Å; F9-R52 HydrophobicContact CZ-CB 4.14Å; F9-R52 PolarHBondContact O-NH2 3.12Å; Y12-R52 PolarHBondContact O-NH1 2.85Å; I31-R52 HydrophobicContact CD1-CG 3.93Å; I31-R52 HydrophobicContact CG1-CG 4.37Å; I31-R52 HydrophobicContact CG2-CB 4.47Å; N32-R52 VanDerWaalsContact O-CD 3.31Å; N32-R52 WeakPolarHBondContact O-CD 3.17Å; N32-R52 PolarHBondContact O-NH1 3.17Å; P33-R52 VanDerWaalsContact CA-NH1 3.26Å; S35-R52 WeakPolarHBondContact OG-CD 3.3Å; S35-R52 WeakPolarHBondContact OG-CG 3.46Å; R52-N54 PolarHBondContact NE-OD1 2.8Å; R52-N54 PolarHBondContact NH2-OD1 3.05Å; R52-T58 WeakPolarHBondContact CA-O 3.5Å; R52-L59 HydrophobicContact CB-CD1 4.17Å
53	D	97.9	Very high	96.5	Very high	41 Å²	41	57.1 Å²	57.1	22%	0.219	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	106.8	171.5	-175.8	-25.6	0	0	0	108.3	A55 K56 N57 T58 Y60	D53-A55 VanDerWaalsContact C-N 3.35Å; D53-A55 WeakPolarHBondContact OD1-CB 3.42Å; D53-A55 PolarHBondContact OD1-N 2.78Å; D53-K56 HydrophobicContact CB-CB 4.21Å; D53-K56 PolarHBondContact O-N 2.9Å; D53-K56 PolarHBondContact OD1-N 2.94Å; D53-K56 VanDerWaalsContact OD1-N 3.1Å; D53-K56 WeakPolarHBondContact OD2-CD 3.44Å; D53-K56 VanDerWaalsContact OD2-CE 3.23Å; D53-K56 WeakPolarHBondContact OD2-CE 3.25Å; D53-K56 WeakPolarHBondContact OD2-CG 3.39Å; D53-K56 IonicContact OD2-NZ 2.77Å; D53-K56 PolarHBondContact OD2-NZ 2.89Å; D53-N57 PolarHBondContact O-N 3.01Å; D53-T58 PolarHBondContact N-O 2.97Å; D53-T58 PolarHBondContact O-N 2.87Å; D53-Y60 HydrophobicContact CB-CE2 3.85Å
54	N	97	Very high	96.4	Very high	59 Å²	59	56.4 Å²	56.4	32%	0.316	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-28.6	-178.2	-72.6	-15.7	0	0	0	112.5	F9 P33 R52 K56 N57	F9-N54 WeakPolarHBondContact CD1-OD1 3.42Å; F9-N54 WeakPolarHBondContact CE1-OD1 3.45Å; P33-N54 PolarHBondContact O-ND2 2.82Å; R52-N54 PolarHBondContact NE-OD1 2.8Å; R52-N54 PolarHBondContact NH2-OD1 3.05Å; N54-K56 VanDerWaalsContact C-N 3.27Å; N54-K56 PolarHBondContact O-N 2.98Å; N54-N57 PolarHBondContact O-N 2.94Å; N54-N57 PolarHBondContact O-OD1 2.93Å
55	A	96.4	Very high	96.2	Very high	96 Å²	96	63 Å²	63	79%	0.793	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-28.4	176.9	0	0	0	0	0	111.6	D53	D53-A55 VanDerWaalsContact C-N 3.35Å; D53-A55 WeakPolarHBondContact OD1-CB 3.42Å; D53-A55 PolarHBondContact OD1-N 2.78Å
56	K	97.4	Very high	96.3	Very high	131 Å²	131	59 Å²	59	57%	0.57	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	2.1	177.6	-61.9	-177.5	-166.2	127.8	0	114.1	D53 N54 T58	D53-K56 HydrophobicContact CB-CB 4.21Å; D53-K56 PolarHBondContact O-N 2.9Å; D53-K56 PolarHBondContact OD1-N 2.94Å; D53-K56 VanDerWaalsContact OD1-N 3.1Å; D53-K56 WeakPolarHBondContact OD2-CD 3.44Å; D53-K56 VanDerWaalsContact OD2-CE 3.23Å; D53-K56 WeakPolarHBondContact OD2-CE 3.25Å; D53-K56 WeakPolarHBondContact OD2-CG 3.39Å; D53-K56 IonicContact OD2-NZ 2.77Å; D53-K56 PolarHBondContact OD2-NZ 2.89Å; N54-K56 VanDerWaalsContact C-N 3.27Å; N54-K56 PolarHBondContact O-N 2.98Å; K56-T58 PolarHBondContact O-N 3.46Å; K56-T58 VanDerWaalsContact O-N 3.13Å; K56-T58 PolarHBondContact O-OG1 2.92Å
57	N	96.9	Very high	96.3	Very high	65 Å²	65	59.9 Å²	59.9	35%	0.348	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	41.3	-171.8	-61.8	-35	0	0	0	112.7	A4 F9 D53 N54	A4-N57 HydrophobicContact CB-CB 4.48Å; A4-N57 WeakPolarHBondContact CB-O 3.19Å; A4-N57 PolarHBondContact N-O 2.96Å; F9-N57 HydrophobicContact CB-CB 3.93Å; F9-N57 WeakPolarHBondContact CB-OD1 3.47Å; F9-N57 HydrophobicContact CD1-CB 4.38Å; F9-N57 HydrophobicContact CG-CB 4.14Å; D53-N57 PolarHBondContact O-N 3.01Å; N54-N57 PolarHBondContact O-N 2.94Å; N54-N57 PolarHBondContact O-OD1 2.93Å
58	T	98.1	Very high	96.3	Very high	15 Å²	15	62.1 Å²	62.1	9%	0.092	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.2	-170.4	-60.1	0	0	0	0	111.9	C2 R52 D53 K56 Y60	C2-T58 WeakPolarHBondContact O-CA 3.35Å; R52-T58 WeakPolarHBondContact CA-O 3.5Å; D53-T58 PolarHBondContact N-O 2.97Å; D53-T58 PolarHBondContact O-N 2.87Å; K56-T58 PolarHBondContact O-N 3.46Å; K56-T58 VanDerWaalsContact O-N 3.13Å; K56-T58 PolarHBondContact O-OG1 2.92Å; T58-Y60 HydrophobicContact CG2-CD1 4.34Å; T58-Y60 HydrophobicContact CG2-CD2 4.31Å; T58-Y60 HydrophobicContact CG2-CE1 3.72Å; T58-Y60 HydrophobicContact CG2-CE2 3.7Å; T58-Y60 WeakPolarHBondContact CG2-OH 3.35Å
59	L	98.4	Very high	96.2	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	141.6	171.1	-171.1	71.3	0	0	0	110.5	S1 C2 F9 M14 W16 I31 I50 R52 C76	S1-L59 CarbonylContact C-O 3.43Å; S1-L59 WeakPolarHBondContact CA-O 3.33Å; C2-L59 HydrophobicContact CB-CB 4.41Å; C2-L59 PolarHBondContact N-O 3.19Å; C2-L59 PolarHBondContact O-N 3.31Å; F9-L59 HydrophobicContact CE2-CB 4.32Å; F9-L59 HydrophobicContact CZ-CB 4.22Å; M14-L59 HydrophobicContact CB-CD1 3.66Å; M14-L59 HydrophobicContact CB-CD2 3.84Å; M14-L59 HydrophobicContact CB-CG 4.26Å; M14-L59 HydrophobicContact CG-CD1 4.5Å; W16-L59 HydrophobicContact CD2-CD2 4.26Å; W16-L59 HydrophobicContact CG-CD2 4.26Å; W16-L59 HydrophobicContact CZ2-CD2 4.13Å; W16-L59 HydrophobicContact CZ2-CG 4.24Å; W16-L59 VanDerWaalsContact NE1-CG 3.31Å; I31-L59 HydrophobicContact CG2-CD1 3.51Å; I50-L59 HydrophobicContact CG2-CD1 4.07Å; R52-L59 HydrophobicContact CB-CD1 4.17Å; L59-C76 HydrophobicContact CD2-CB 4.07Å
60	Y	98.4	Very high	96.1	Very high	73 Å²	73	64.4 Å²	64.4	29%	0.286	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.5	179.9	-59.4	-85.2	0	0	0	111	W16 I50 S51 D53 T58	W16-Y60 PolarHBondContact NE1-O 3.05Å; W16-Y60 VanDerWaalsContact NE1-O 3.12Å; I50-Y60 WeakPolarHBondContact CA-O 3.2Å; S51-Y60 PolarHBondContact N-O 3.13Å; S51-Y60 PolarHBondContact O-N 3.43Å; S51-Y60 WeakPolarHBondContact OG-CB 3.36Å; D53-Y60 HydrophobicContact CB-CE2 3.85Å; T58-Y60 HydrophobicContact CG2-CD1 4.34Å; T58-Y60 HydrophobicContact CG2-CD2 4.31Å; T58-Y60 HydrophobicContact CG2-CE1 3.72Å; T58-Y60 HydrophobicContact CG2-CE2 3.7Å; T58-Y60 WeakPolarHBondContact CG2-OH 3.35Å
61	L	98.2	Very high	96	Very high	23 Å²	23	65.8 Å²	65.8	12%	0.12	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	104.7	169.9	-172.3	66	0	0	0	106.4	W16 I28 F48 I50 M63 Y74	W16-L61 HydrophobicContact CB-CD1 4.28Å; W16-L61 HydrophobicContact CB-CD2 4.29Å; W16-L61 HydrophobicContact CD2-CB 3.81Å; W16-L61 HydrophobicContact CD2-CD1 4.49Å; W16-L61 HydrophobicContact CD2-CD2 3.9Å; W16-L61 HydrophobicContact CD2-CG 4.3Å; W16-L61 HydrophobicContact CE3-CB 4.39Å; W16-L61 HydrophobicContact CE3-CD2 4.02Å; W16-L61 HydrophobicContact CG-CB 4.11Å; W16-L61 HydrophobicContact CG-CD1 3.96Å; W16-L61 HydrophobicContact CG-CD2 4.02Å; W16-L61 HydrophobicContact CG-CG 4.28Å; W16-L61 HydrophobicContact CZ2-CB 3.91Å; I28-L61 HydrophobicContact CD1-CD2 3.9Å; I28-L61 HydrophobicContact CG2-CD1 4.31Å; F48-L61 HydrophobicContact CB-CD1 3.8Å; F48-L61 HydrophobicContact CD1-CD1 4.19Å; F48-L61 HydrophobicContact CD1-CD2 4.2Å; F48-L61 HydrophobicContact CD1-CG 4.12Å; F48-L61 HydrophobicContact CG-CD1 4.23Å; I50-L61 HydrophobicContact CG1-CD1 3.77Å; L61-M63 HydrophobicContact CD2-CE 3.6Å; L61-M63 HydrophobicContact CG-CE 4.29Å; L61-Y74 HydrophobicContact CD2-CD1 3.69Å; L61-Y74 HydrophobicContact CD2-CE1 4.09Å
62	Q	97.6	Very high	96	Very high	113 Å²	113	63.5 Å²	63.5	53%	0.528	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	130.2	171.9	175.4	178.8	-14.4	0	0	108.7	F48 I49	F48-Q62 CarbonylContact C-O 3.58Å; F48-Q62 WeakPolarHBondContact CA-O 3.48Å; I49-Q62 HydrophobicContact CB-CB 4.21Å; I49-Q62 PolarHBondContact N-O 3.04Å; I49-Q62 PolarHBondContact O-N 2.82Å
63	M	95.1	Very high	96	Very high	67 Å²	67	65.5 Å²	65.5	33%	0.33	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	113.9	-177.1	-59.6	-171.4	171.4	0	0	108.6	F48 L61 V66 Y74	F48-M63 HydrophobicContact CD1-CB 4.37Å; F48-M63 HydrophobicContact CD1-CG 3.79Å; F48-M63 HydrophobicContact CE1-CB 4.35Å; F48-M63 HydrophobicContact CE1-CE 4.04Å; F48-M63 HydrophobicContact CE1-CG 3.74Å; F48-M63 HydrophobicContact CE1-SD 4.11Å; L61-M63 HydrophobicContact CD2-CE 3.6Å; L61-M63 HydrophobicContact CG-CE 4.29Å; M63-V66 HydrophobicContact CB-CG1 3.76Å; M63-V66 HydrophobicContact CG-CG1 4.38Å; M63-V66 HydrophobicContact SD-CG1 4.42Å; M63-Y74 HydrophobicContact CE-CD1 3.47Å; M63-Y74 VanDerWaalsContact CE-CD1 3.47Å; M63-Y74 HydrophobicContact CE-CD2 3.97Å; M63-Y74 HydrophobicContact CE-CE1 3.32Å; M63-Y74 HydrophobicContact CE-CE2 3.86Å; M63-Y74 HydrophobicContact CE-CG 3.79Å
64	S	90.4	Very high	96	Very high	67 Å²	67	63.8 Å²	63.8	47%	0.469	33%	0.331	S	S	.	.			trans	-114	-46.5	-171.1	-58	0	0	0	0	113.5	K47	K47-S64 PolarHBondContact O-N 2.86Å
65	K	90.2	Very high	96.1	Very high	142 Å²	142	62.7 Å²	62.7	62%	0.617	32%	0.322	S	S	*	.	S	Bend	trans	-114.2	41.6	-175.3	-60.3	-178.2	-174	169.6	0	111.9
66	V	93.7	Very high	96.1	Very high	46 Å²	46	58.6 Å²	58.6	28%	0.279	29%	0.288	S	S	.	.			trans	-73.8	146	-178.3	-69.9	0	0	0	0	111.7	F48 M63 D70 V100	F48-V66 HydrophobicContact CE1-CG1 3.91Å; F48-V66 HydrophobicContact CZ-CG1 4.27Å; M63-V66 HydrophobicContact CB-CG1 3.76Å; M63-V66 HydrophobicContact CG-CG1 4.38Å; M63-V66 HydrophobicContact SD-CG1 4.42Å; V66-D70 WeakPolarHBondContact CA-OD2 3.35Å; V66-D70 HydrophobicContact CB-CB 4.19Å; V66-D70 HydrophobicContact CG1-CB 4.21Å; V66-V100 HydrophobicContact CB-CG2 4.23Å; V66-V100 HydrophobicContact CG2-CG1 4.41Å; V66-V100 HydrophobicContact CG2-CG2 4.08Å
67	R	94.6	Very high	96	Very high	140 Å²	140	52.5 Å²	52.5	53%	0.528	26%	0.262	S	S	.	.			trans	-123.3	173.2	176.1	-65.4	179.3	-119.3	172.8	-4.3	109.6	E69 D70 V100	R67-E69 IonicContact NH1-OE1 2.75Å; R67-E69 PolarHBondContact O-N 3Å; R67-E69 VanDerWaalsContact O-N 3.14Å; R67-D70 PolarHBondContact N-OD2 3.04Å; R67-D70 WeakPolarHBondContact O-CB 3.04Å; R67-D70 PolarHBondContact O-N 3.36Å; R67-V100 WeakPolarHBondContact O-CB 2.95Å
68	S	94.8	Very high	95.7	Very high	69 Å²	69	49.8 Å²	49.8	48%	0.483	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-53.4	-34.6	176.3	53	0	0	0	0	113.2	D70 T71 V100	S68-D70 PolarHBondContact O-N 3.03Å; S68-T71 VanDerWaalsContact O-CB 3.3Å; S68-T71 WeakPolarHBondContact O-CB 2.96Å; S68-T71 PolarHBondContact O-N 3.14Å; S68-T71 VanDerWaalsContact O-N 3.09Å; S68-T71 PolarHBondContact O-OG1 3.11Å; S68-V100 WeakPolarHBondContact CA-O 3.25Å
69	E	93	Very high	95	Very high	127 Å²	127	49.3 Å²	49.3	59%	0.593	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-59.3	-22.3	174	-57.5	165.8	-124.3	0	0	114	R67 T71	R67-E69 IonicContact NH1-OE1 2.75Å; R67-E69 PolarHBondContact O-N 3Å; R67-E69 VanDerWaalsContact O-N 3.14Å; E69-T71 VanDerWaalsContact C-N 3.27Å
70	D	95.3	Very high	93.6	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-88.8	6.6	179.4	-57	-59	0	0	0	112.2	R18 K47 F48 V66 R67 S68 A72 Y74	R18-D70 IonicContact CZ-OD1 3.19Å; R18-D70 IonicContact NH1-OD1 3.76Å; R18-D70 PolarHBondContact NH1-OD1 2.79Å; R18-D70 IonicContact NH2-OD1 3.95Å; K47-D70 WeakPolarHBondContact CD-OD2 3.29Å; K47-D70 IonicContact NZ-OD1 2.76Å; K47-D70 PolarHBondContact NZ-OD1 2.72Å; K47-D70 IonicContact NZ-OD2 2.8Å; K47-D70 PolarHBondContact NZ-OD2 2.87Å; F48-D70 HydrophobicContact CZ-CB 4.5Å; V66-D70 WeakPolarHBondContact CA-OD2 3.35Å; V66-D70 HydrophobicContact CB-CB 4.19Å; V66-D70 HydrophobicContact CG1-CB 4.21Å; R67-D70 PolarHBondContact N-OD2 3.04Å; R67-D70 WeakPolarHBondContact O-CB 3.04Å; R67-D70 PolarHBondContact O-N 3.36Å; S68-D70 PolarHBondContact O-N 3.03Å; D70-A72 PolarHBondContact O-N 3.45Å; D70-Y74 PolarHBondContact O-OH 3.03Å
71	T	97.1	Very high	92.1	Very high	31 Å²	31	55.8 Å²	55.8	19%	0.19	27%	0.269	C	S	.	.			trans	-62.2	117.4	169.4	-66.3	0	0	0	0	110	P21 S68 E69 A98 T99 V100	P21-T71 VanDerWaalsContact CD-O 3.24Å; P21-T71 WeakPolarHBondContact CD-O 3.21Å; S68-T71 VanDerWaalsContact O-CB 3.3Å; S68-T71 WeakPolarHBondContact O-CB 2.96Å; S68-T71 PolarHBondContact O-N 3.14Å; S68-T71 VanDerWaalsContact O-N 3.09Å; S68-T71 PolarHBondContact O-OG1 3.11Å; E69-T71 VanDerWaalsContact C-N 3.27Å; T71-A98 WeakPolarHBondContact CA-O 3.24Å; T71-T99 HydrophobicContact CG2-CG2 4.16Å; T71-V100 PolarHBondContact OG1-N 3.2Å; T71-V100 PolarHBondContact OG1-O 3.16Å
72	A	97.6	Very high	90.2	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.033	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	166.7	-174.6	0	0	0	0	0	112.2	R18 Q19 A20 D70 Y74 A98	R18-A72 HydrophobicContact CB-CB 3.97Å; Q19-A72 WeakPolarHBondContact O-CA 3.28Å; Q19-A72 VanDerWaalsContact O-CB 3.3Å; Q19-A72 WeakPolarHBondContact O-CB 3.45Å; A20-A72 HydrophobicContact CB-CB 4.48Å; D70-A72 PolarHBondContact O-N 3.45Å; A72-Y74 HydrophobicContact CB-CD2 4.24Å; A72-Y74 HydrophobicContact CB-CE2 3.7Å; A72-Y74 VanDerWaalsContact O-CD2 3.29Å; A72-Y74 WeakPolarHBondContact O-CD2 3.45Å; A72-Y74 WeakPolarHBondContact O-CE2 3.49Å; A72-A98 PolarHBondContact N-O 3.5Å; A72-A98 VanDerWaalsContact N-O 3.12Å; A72-A98 PolarHBondContact O-N 2.99Å
73	L	98.1	Very high	88.2	Confident	65 Å²	65	58.7 Å²	58.7	34%	0.34	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	134.1	157.3	-72.1	165	0	0	0	108.9	R18 Q19 Y75 T96	R18-L73 CarbonylContact C-O 3.59Å; R18-L73 WeakPolarHBondContact CA-O 3.38Å; R18-L73 WeakPolarHBondContact CB-O 3.5Å; Q19-L73 HydrophobicContact CB-CB 4.46Å; Q19-L73 PolarHBondContact N-O 3.1Å; Q19-L73 PolarHBondContact O-N 3.39Å; L73-Y75 HydrophobicContact CB-CE2 3.58Å; L73-Y75 WeakPolarHBondContact CB-OH 3.48Å; L73-Y75 VanDerWaalsContact CD1-OH 3.28Å; L73-Y75 WeakPolarHBondContact CD1-OH 3.18Å; L73-T96 CarbonylContact C-O 3.48Å; L73-T96 WeakPolarHBondContact CA-O 3.4Å
74	Y	98.2	Very high	85.9	Confident	6 Å²	6	61.9 Å²	61.9	2%	0.024	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.8	-179.4	-71.4	-98.2	0	0	0	110.2	V17 R18 I28 F48 L61 M63 D70 A72 G95 T96 A98	V17-Y74 CarbonylContact O-C 3.41Å; V17-Y74 WeakPolarHBondContact O-CA 3.47Å; R18-Y74 HydrophobicContact CB-CD1 3.87Å; R18-Y74 HydrophobicContact CB-CE1 3.85Å; R18-Y74 HydrophobicContact CB-CG 4.34Å; I28-Y74 HydrophobicContact CD1-CD1 3.65Å; I28-Y74 HydrophobicContact CD1-CE1 3.6Å; F48-Y74 AromaticContact CE1-CE1 3.97Å; F48-Y74 HydrophobicContact CE1-CE1 3.97Å; F48-Y74 HydrophobicContact CZ-CE1 4.01Å; L61-Y74 HydrophobicContact CD2-CD1 3.69Å; L61-Y74 HydrophobicContact CD2-CE1 4.09Å; M63-Y74 HydrophobicContact CE-CD1 3.47Å; M63-Y74 VanDerWaalsContact CE-CD1 3.47Å; M63-Y74 HydrophobicContact CE-CD2 3.97Å; M63-Y74 HydrophobicContact CE-CE1 3.32Å; M63-Y74 HydrophobicContact CE-CE2 3.86Å; M63-Y74 HydrophobicContact CE-CG 3.79Å; D70-Y74 PolarHBondContact O-OH 3.03Å; A72-Y74 HydrophobicContact CB-CD2 4.24Å; A72-Y74 HydrophobicContact CB-CE2 3.7Å; A72-Y74 VanDerWaalsContact O-CD2 3.29Å; A72-Y74 WeakPolarHBondContact O-CD2 3.45Å; A72-Y74 WeakPolarHBondContact O-CE2 3.49Å; Y74-G95 CarbonylContact O-C 3.6Å; Y74-G95 WeakPolarHBondContact O-CA 3.19Å; Y74-T96 PolarHBondContact N-O 2.95Å; Y74-T96 PolarHBondContact O-N 3.26Å; Y74-A98 HydrophobicContact CD2-CB 3.87Å; Y74-A98 HydrophobicContact CE2-CB 3.78Å
75	Y	97.9	Very high	83.7	Confident	35 Å²	35	69 Å²	69	14%	0.137	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.5	-176.1	-53.9	-92.8	0	0	0	109.8	W16 V17 Q19 L25 L73 W92	W16-Y75 CarbonylContact C-O 3.39Å; W16-Y75 WeakPolarHBondContact CA-O 3.41Å; V17-Y75 PolarHBondContact N-O 2.97Å; V17-Y75 PolarHBondContact O-N 2.77Å; Q19-Y75 HydrophobicContact CB-CE2 4.05Å; L25-Y75 HydrophobicContact CD2-CD2 4.24Å; L25-Y75 HydrophobicContact CD2-CE2 4.15Å; L73-Y75 HydrophobicContact CB-CE2 3.58Å; L73-Y75 WeakPolarHBondContact CB-OH 3.48Å; L73-Y75 VanDerWaalsContact CD1-OH 3.28Å; L73-Y75 WeakPolarHBondContact CD1-OH 3.18Å; Y75-W92 HydrophobicContact CD1-CE3 4.47Å; Y75-W92 HydrophobicContact CG-CE3 4.15Å; Y75-W92 HydrophobicContact CG-CZ3 4.29Å
76	C	96.8	Very high	81.8	Confident	11 Å²	11	71.5 Å²	71.5	7%	0.074	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	147.1	160.5	53.9	0	0	0	0	109.2	C2 S15 W16 L59 G93	C2-C76 HydrophobicContact CB-CB 3.39Å; C2-C76 WeakPolarHBondContact CB-SG 3.37Å; C2-C76 WeakPolarHBondContact SG-CB 3.31Å; C2-C76 CovalentContact SG-SG 2.02Å; C2-C76 PolarHBondContact SG-SG 2.63Å; S15-C76 CarbonylContact O-C 3.53Å; S15-C76 VanDerWaalsContact O-CA 3.26Å; S15-C76 WeakPolarHBondContact O-CA 3.42Å; W16-C76 HydrophobicContact CE3-CB 4.41Å; W16-C76 HydrophobicContact CH2-CB 4.25Å; W16-C76 HydrophobicContact CZ2-CB 4.46Å; W16-C76 HydrophobicContact CZ3-CB 4.23Å; L59-C76 HydrophobicContact CD2-CB 4.07Å; C76-G93 PolarHBondContact O-N 2.73Å
77	A	95.4	Very high	80.2	Confident	2 Å²	2	77.2 Å²	77.2	2%	0.017	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.6	174.7	0	0	0	0	0	111.3	S15 M89 Y91 W92	S15-A77 PolarHBondContact N-O 3.21Å; S15-A77 PolarHBondContact O-N 3.22Å; A77-M89 HydrophobicContact CB-CB 4.18Å; A77-M89 HydrophobicContact CB-CG 4.15Å; A77-M89 HydrophobicContact CB-SD 4.03Å; A77-Y91 CarbonylContact C-O 3.55Å; A77-Y91 WeakPolarHBondContact CA-O 3.05Å; A77-Y91 WeakPolarHBondContact CB-O 3.23Å; A77-W92 HydrophobicContact CB-CD2 3.97Å; A77-W92 HydrophobicContact CB-CE3 4.17Å; A77-W92 HydrophobicContact CB-CG 4.36Å; A77-W92 HydrophobicContact CB-CZ2 4.46Å
78	I	91.1	Very high	78.7	Confident	9 Å²	9	72.3 Å²	72.3	5%	0.046	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	142.7	169	-55.7	176.9	0	0	0	108.3	F7 Y12 M14 M89 Y91	F7-I78 HydrophobicContact CD1-CD1 3.56Å; F7-I78 HydrophobicContact CD2-CD1 3.78Å; F7-I78 HydrophobicContact CE1-CD1 3.26Å; F7-I78 HydrophobicContact CE1-CG1 4.01Å; F7-I78 HydrophobicContact CE2-CD1 3.45Å; F7-I78 VanDerWaalsContact CE2-CD1 3.45Å; F7-I78 HydrophobicContact CE2-CG1 3.87Å; F7-I78 HydrophobicContact CG-CD1 3.83Å; F7-I78 HydrophobicContact CZ-CD1 3.18Å; F7-I78 HydrophobicContact CZ-CG1 3.52Å; Y12-I78 HydrophobicContact CD1-CG2 3.91Å; Y12-I78 HydrophobicContact CG-CG2 3.99Å; M14-I78 HydrophobicContact CE-CG1 3.99Å; M14-I78 HydrophobicContact SD-CB 4.48Å; M14-I78 HydrophobicContact SD-CG1 4.03Å; I78-M89 VanDerWaalsContact O-CA 3.3Å; I78-M89 WeakPolarHBondContact O-CA 3.46Å; I78-Y91 HydrophobicContact CD1-CD2 3.66Å; I78-Y91 HydrophobicContact CD1-CG 3.85Å; I78-Y91 PolarHBondContact N-O 3.18Å
79	I	83	Confident	77.7	Confident	5 Å²	5	71.5 Å²	71.5	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127	163.8	-66.9	178.7	0	0	0	109.3	W13 S15 E30 Y81 M89	W13-I79 HydrophobicContact CB-CB 4.21Å; W13-I79 PolarHBondContact O-N 2.8Å; S15-I79 WeakPolarHBondContact OG-CD1 3.23Å; E30-I79 HydrophobicContact CB-CD1 4.37Å; E30-I79 WeakPolarHBondContact OE2-CD1 3.21Å; I79-Y81 HydrophobicContact CB-CE2 4.18Å; I79-Y81 HydrophobicContact CG2-CD2 3.88Å; I79-Y81 HydrophobicContact CG2-CE2 3.38Å; I79-M89 HydrophobicContact CD1-CE 3.95Å; I79-M89 HydrophobicContact CG1-CE 4.3Å; I79-M89 HydrophobicContact CG1-CG 3.94Å
80	Y	69.6	Low	76.7	Confident	118 Å²	118	69.7 Å²	69.7	46%	0.463	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-97.8	122.4	172	-173.7	-116	0	0	0	111.1	Y12	Y12-Y80 HydrophobicContact CD1-CD2 4.01Å; Y12-Y80 AromaticContact CE1-CD2 3.58Å; Y12-Y80 HydrophobicContact CE1-CD2 3.58Å; Y12-Y80 HydrophobicContact CE1-CE2 4.03Å
81	Y	65.7	Low	76.3	Confident	90 Å²	90	77.2 Å²	77.2	35%	0.353	36%	0.357	S	S	.	.			trans	-97.6	81.8	170.2	-66.1	-98.1	0	0	0	108.7	W13 E30 I79 Y87	W13-Y81 HydrophobicContact CB-CD2 4.16Å; W13-Y81 HydrophobicContact CB-CE2 3.53Å; W13-Y81 AromaticContact CD1-CD2 3.43Å; W13-Y81 VanDerWaalsContact CD1-CD2 3.43Å; W13-Y81 AromaticContact CD1-CE2 3.37Å; W13-Y81 HydrophobicContact CD2-CD2 4.2Å; W13-Y81 AromaticContact CD2-CE2 3.37Å; W13-Y81 HydrophobicContact CD2-CE2 3.37Å; W13-Y81 AromaticContact CD2-CZ 3.79Å; W13-Y81 AromaticContact CE2-CE2 3.71Å; W13-Y81 AromaticContact CE3-CE2 4Å; W13-Y81 HydrophobicContact CE3-CE2 4Å; W13-Y81 AromaticContact CG-CD2 3.71Å; W13-Y81 HydrophobicContact CG-CD2 3.71Å; W13-Y81 AromaticContact CG-CE2 3.16Å; W13-Y81 HydrophobicContact CG-CE2 3.16Å; W13-Y81 AromaticContact NE1-CD2 3.78Å; W13-Y81 AromaticContact NE1-CE2 3.7Å; E30-Y81 PolarHBondContact OE1-OH 2.79Å; E30-Y81 PolarHBondContact OE2-OH 3Å; I79-Y81 HydrophobicContact CB-CE2 4.18Å; I79-Y81 HydrophobicContact CG2-CD2 3.88Å; I79-Y81 HydrophobicContact CG2-CE2 3.38Å; Y81-Y87 HydrophobicContact CD1-CE1 4.3Å; Y81-Y87 HydrophobicContact CE1-CD1 4.04Å; Y81-Y87 AromaticContact CE1-CE1 3.64Å; Y81-Y87 HydrophobicContact CE1-CE1 3.64Å
82	G	60.2	Low	76.1	Confident	25 Å²	25	80.5 Å²	80.5	26%	0.258	37%	0.366	S	S	.	.			trans	-82	170.6	174	0	0	0	0	0	113.6	L84	G82-L84 PolarHBondContact O-N 2.59Å
83	N	54.8	Low	75.9	Confident	173 Å²	173	81.5 Å²	81.5	93%	0.925	38%	0.378	S	S	*	.	S	Bend	trans	-64.3	0.3	-178.2	-84.1	-33.2	0	0	0	116
84	L	45.6	Very low	75.7	Confident	134 Å²	134	87.4 Å²	87.4	70%	0.702	40%	0.403	S	S	*	.	S	Bend	trans	-135.5	91.5	177.4	-67.5	169.7	0	0	0	107.4	G82 Y86	G82-L84 PolarHBondContact O-N 2.59Å; L84-Y86 HydrophobicContact CB-CD2 4.46Å; L84-Y86 VanDerWaalsContact O-CD2 3.25Å; L84-Y86 WeakPolarHBondContact O-CD2 3.42Å; L84-Y86 PolarHBondContact O-N 3.05Å
85	Y	45.3	Very low	75.6	Confident	217 Å²	217	88.7 Å²	88.7	85%	0.851	42%	0.419	S	S	*	.	S	Bend	trans	16.6	23.9	157.8	-66.1	-81.4	0	0	0	122.6
86	Y	51	Low	75.6	Confident	193 Å²	193	91.1 Å²	91.1	76%	0.757	44%	0.437	S	S	*	.			trans	-111.6	107.3	-177.8	-72.5	-75	0	0	0	109.7	L84 A88	L84-Y86 HydrophobicContact CB-CD2 4.46Å; L84-Y86 VanDerWaalsContact O-CD2 3.25Å; L84-Y86 WeakPolarHBondContact O-CD2 3.42Å; L84-Y86 PolarHBondContact O-N 3.05Å; Y86-A88 PolarHBondContact O-N 3.47Å
87	Y	59.4	Low	75.6	Confident	167 Å²	167	94.3 Å²	94.3	66%	0.655	46%	0.459	S	S	*	.			trans	-72.1	71.7	170.4	-59.1	-90.8	0	0	0	109.6	Y81	Y81-Y87 HydrophobicContact CD1-CE1 4.3Å; Y81-Y87 HydrophobicContact CE1-CD1 4.04Å; Y81-Y87 AromaticContact CE1-CE1 3.64Å; Y81-Y87 HydrophobicContact CE1-CE1 3.64Å
88	A	62.3	Low	75.6	Confident	37 Å²	37	95.5 Å²	95.5	31%	0.306	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-86.9	122.4	177.8	0	0	0	0	0	109.8	Y86 D90	Y86-A88 PolarHBondContact O-N 3.47Å; A88-D90 VanDerWaalsContact C-N 3.34Å; A88-D90 WeakPolarHBondContact CB-OD1 3.45Å; A88-D90 PolarHBondContact O-N 3.05Å
89	M	74.3	Confident	75.8	Confident	51 Å²	51	100.3 Å²	100.3	25%	0.251	50%	0.499	S	S	.	.			trans	-83.6	84.8	167.3	-72.8	179.2	-174.3	0	0	108.4	V17 W27 A77 I78 I79 W92	V17-M89 HydrophobicContact CG2-CE 3.91Å; V17-M89 HydrophobicContact CG2-SD 3.84Å; W27-M89 VanDerWaalsContact CD1-CE 3.45Å; W27-M89 HydrophobicContact CG-CE 4.41Å; A77-M89 HydrophobicContact CB-CB 4.18Å; A77-M89 HydrophobicContact CB-CG 4.15Å; A77-M89 HydrophobicContact CB-SD 4.03Å; I78-M89 VanDerWaalsContact O-CA 3.3Å; I78-M89 WeakPolarHBondContact O-CA 3.46Å; I79-M89 HydrophobicContact CD1-CE 3.95Å; I79-M89 HydrophobicContact CG1-CE 4.3Å; I79-M89 HydrophobicContact CG1-CG 3.94Å; M89-W92 HydrophobicContact CB-CZ2 3.7Å; M89-W92 HydrophobicContact CG-CZ2 4.17Å; M89-W92 PolarHBondContact O-NE1 3.15Å; M89-W92 HydrophobicContact SD-CH2 3.63Å; M89-W92 HydrophobicContact SD-CZ2 3.35Å; M89-W92 WeakPolarHBondContact SD-CZ2 3.28Å
90	D	72.4	Confident	76.3	Confident	89 Å²	89	101.8 Å²	101.8	48%	0.476	51%	0.509	S	S	.	.			trans	-73.9	-28.2	-168.5	-65.9	-35	0	0	0	113.4	A88	A88-D90 VanDerWaalsContact C-N 3.34Å; A88-D90 WeakPolarHBondContact CB-OD1 3.45Å; A88-D90 PolarHBondContact O-N 3.05Å
91	Y	85.7	Confident	77.2	Confident	159 Å²	159	101.3 Å²	101.3	62%	0.624	52%	0.522	S	S	*	.			trans	-134.6	132.2	-177.1	-63	-88.1	0	0	0	110.8	A77 I78	A77-Y91 CarbonylContact C-O 3.55Å; A77-Y91 WeakPolarHBondContact CA-O 3.05Å; A77-Y91 WeakPolarHBondContact CB-O 3.23Å; I78-Y91 HydrophobicContact CD1-CD2 3.66Å; I78-Y91 HydrophobicContact CD1-CG 3.85Å; I78-Y91 PolarHBondContact N-O 3.18Å
92	W	93.1	Very high	77.8	Confident	100 Å²	100	105.6 Å²	105.6	38%	0.379	57%	0.565	S	S	.	*	B	Isolated β-bridge	trans	-121.1	140.2	-177.9	-69.3	73.8	0	0	0	110.9	V17 L25 Y75 A77 M89	V17-W92 HydrophobicContact CB-CH2 3.95Å; V17-W92 HydrophobicContact CB-CZ3 3.68Å; V17-W92 HydrophobicContact CG1-CH2 3.85Å; V17-W92 HydrophobicContact CG1-CZ3 3.83Å; V17-W92 HydrophobicContact CG2-CH2 3.7Å; V17-W92 HydrophobicContact CG2-CZ3 3.83Å; L25-W92 HydrophobicContact CD1-CH2 3.98Å; L25-W92 HydrophobicContact CD1-CZ3 4.4Å; L25-W92 HydrophobicContact CD2-CZ3 4.27Å; Y75-W92 HydrophobicContact CD1-CE3 4.47Å; Y75-W92 HydrophobicContact CG-CE3 4.15Å; Y75-W92 HydrophobicContact CG-CZ3 4.29Å; A77-W92 HydrophobicContact CB-CD2 3.97Å; A77-W92 HydrophobicContact CB-CE3 4.17Å; A77-W92 HydrophobicContact CB-CG 4.36Å; A77-W92 HydrophobicContact CB-CZ2 4.46Å; M89-W92 HydrophobicContact CB-CZ2 3.7Å; M89-W92 HydrophobicContact CG-CZ2 4.17Å; M89-W92 PolarHBondContact O-NE1 3.15Å; M89-W92 HydrophobicContact SD-CH2 3.63Å; M89-W92 HydrophobicContact SD-CZ2 3.35Å; M89-W92 WeakPolarHBondContact SD-CZ2 3.28Å
93	G	93.9	Very high	78.7	Confident	26 Å²	26	109.6 Å²	109.6	27%	0.268	58%	0.581	S	S	.	*			trans	-68	159.9	162.1	0	0	0	0	0	110.9	C76 G95	C76-G93 PolarHBondContact O-N 2.73Å; G93-G95 PolarHBondContact O-N 2.95Å; G93-G95 VanDerWaalsContact O-N 3.09Å
94	Q	94.4	Very high	80	Confident	189 Å²	189	106.3 Å²	106.3	88%	0.883	56%	0.563	S	S	*	*			trans	-63.8	-16	179.2	-64.6	-61.8	-51.3	0	0	113.8
95	G	95.4	Very high	81.9	Confident	33 Å²	33	104.7 Å²	104.7	34%	0.34	56%	0.555	S	S	.	*			trans	87.6	158.5	-176.7	0	0	0	0	0	113	Y74 G93	Y74-G95 CarbonylContact O-C 3.6Å; Y74-G95 WeakPolarHBondContact O-CA 3.19Å; G93-G95 PolarHBondContact O-N 2.95Å; G93-G95 VanDerWaalsContact O-N 3.09Å
96	T	97.4	Very high	84	Confident	85 Å²	85	98.1 Å²	98.1	52%	0.521	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	138.5	173.2	-171.8	0	0	0	0	110.4	L73 Y74	L73-T96 CarbonylContact C-O 3.48Å; L73-T96 WeakPolarHBondContact CA-O 3.4Å; Y74-T96 PolarHBondContact N-O 2.95Å; Y74-T96 PolarHBondContact O-N 3.26Å
97	S	96.9	Very high	86.1	Confident	78 Å²	78	92.2 Å²	92.2	55%	0.545	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	127.1	177.9	-171.6	0	0	0	0	109.9
98	A	96	Very high	87.9	Confident	28 Å²	28	87.2 Å²	87.2	23%	0.231	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.8	168.1	0	0	0	0	0	108.8	T71 A72 Y74	T71-A98 WeakPolarHBondContact CA-O 3.24Å; A72-A98 PolarHBondContact N-O 3.5Å; A72-A98 VanDerWaalsContact N-O 3.12Å; A72-A98 PolarHBondContact O-N 2.99Å; Y74-A98 HydrophobicContact CD2-CB 3.87Å; Y74-A98 HydrophobicContact CE2-CB 3.78Å
99	T	96.1	Very high	89.7	Confident	109 Å²	109	90.8 Å²	90.8	67%	0.669	53%	0.53	S	S	*	.			trans	-106.6	128.7	178.3	-55.4	0	0	0	0	109.2	T71	T71-T99 HydrophobicContact CG2-CG2 4.16Å
100	V	93.2	Very high	90.9	Very high	37 Å²	37	93.8 Å²	93.8	22%	0.224	55%	0.551	C	S	.	*			trans	-115.4	119.2	176.9	-175	0	0	0	0	107.8	V66 R67 S68 T71	V66-V100 HydrophobicContact CB-CG2 4.23Å; V66-V100 HydrophobicContact CG2-CG1 4.41Å; V66-V100 HydrophobicContact CG2-CG2 4.08Å; R67-V100 WeakPolarHBondContact O-CB 2.95Å; S68-V100 WeakPolarHBondContact CA-O 3.25Å; T71-V100 PolarHBondContact OG1-N 3.2Å; T71-V100 PolarHBondContact OG1-O 3.16Å
101	S	88.6	Confident	92.4	Very high	107 Å²	107	94.3 Å²	94.3	75%	0.748	56%	0.558	S	S	*	*			trans	-107.4	152.6	173.7	56.7	0	0	0	0	110.5
102	S	78.3	Confident	93	Very high	180 Å²	180	88.4 Å²	88.4	100%	1.259	55%	0.552	S	S	*	*			trans	-74.8	0	172.9	57	0	0	0	0	112.7

Retrieved 102 of 102 residues in 25.5 ms (Link to these results)

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