A0A068LRX1_HUMAN Loading...

Ig heavy chain variable region

AlphaFold DB , UniProt , Accession A0A068LRX1, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 100 aa.

						>A0A068LRX1_HUMAN|A0A068LRX1
AASKFTFSNYSINWVRQAPGKGLEWVSSFSSIPNYIYYADSVKGRFTISRDSAKNSLYLQMNSLRVEDTAVYYCARGRITTGLTPYMDVWAKGTTVTVSS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	A	37.5	Very low	54.6	Low	157 Å²	157	85.5 Å²	85.5	100%	1.298	51%	0.512	S	S	*	.				0	117.3	0	0	0	0	0	0	108.6
2	A	39.5	Very low	56.9	Low	87 Å²	87	78.7 Å²	78.7	72%	0.719	47%	0.471	S	S	*	.			trans	-79.3	119.7	167.3	0	0	0	0	0	107.1	K4	A2-K4 PolarHBondContact O-N 3.19Å
3	S	46.8	Very low	59.1	Low	62 Å²	62	72.9 Å²	72.9	43%	0.434	44%	0.437	S	S	.	.			trans	-55.2	128.4	177.4	48.6	0	0	0	0	110.6	F5	S3-F5 VanDerWaalsContact CB-CD2 3.41Å; S3-F5 PolarHBondContact O-N 3Å; S3-F5 WeakPolarHBondContact OG-CD2 3.35Å; S3-F5 WeakPolarHBondContact OG-CE2 3.36Å
4	K	46	Very low	61.4	Low	213 Å²	213	70.4 Å²	70.4	93%	0.926	42%	0.416	S	S	*	.			trans	-67.2	68	173.3	-72.6	-179.4	176.6	178.6	0	110.7	A2	A2-K4 PolarHBondContact O-N 3.19Å
5	F	52.7	Low	63.4	Low	107 Å²	107	65.9 Å²	65.9	47%	0.469	39%	0.389	S	S	.	.			trans	-93	124.4	169.4	-68.7	-63	0	0	0	109.2	S3 F7	S3-F5 VanDerWaalsContact CB-CD2 3.41Å; S3-F5 PolarHBondContact O-N 3Å; S3-F5 WeakPolarHBondContact OG-CD2 3.35Å; S3-F5 WeakPolarHBondContact OG-CE2 3.36Å; F5-F7 WeakPolarHBondContact O-CD2 3.41Å; F5-F7 PolarHBondContact O-N 3.24Å
6	T	52.5	Low	65.4	Low	106 Å²	106	62.4 Å²	62.4	65%	0.65	37%	0.367	S	S	*	.			trans	-71.2	110.5	169.2	-27.2	0	0	0	0	107.2	S8	T6-S8 WeakPolarHBondContact CG2-OG 3.42Å; T6-S8 PolarHBondContact O-N 3.32Å
7	F	54.4	Low	67.1	Low	26 Å²	26	63.3 Å²	63.3	11%	0.114	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-58	-3	174.3	-74.3	-101.8	0	0	0	113.6	F5 N9 Y10 I12 R50 N55 L57	F5-F7 WeakPolarHBondContact O-CD2 3.41Å; F5-F7 PolarHBondContact O-N 3.24Å; F7-N9 PolarHBondContact O-N 2.83Å; F7-Y10 PolarHBondContact O-N 2.82Å; F7-I12 HydrophobicContact CD1-CD1 3.53Å; F7-I12 HydrophobicContact CD1-CG1 4.27Å; F7-I12 HydrophobicContact CE1-CD1 4.09Å; F7-R50 VanDerWaalsContact CB-NH2 3.3Å; F7-N55 WeakPolarHBondContact CD2-OD1 3.27Å; F7-N55 VanDerWaalsContact CE2-CG 3.5Å; F7-N55 WeakPolarHBondContact CE2-OD1 3.44Å; F7-L57 HydrophobicContact CE1-CD1 4.15Å
8	S	59.3	Low	68.7	Low	38 Å²	38	60.5 Å²	60.5	27%	0.266	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-57.4	-29.2	-179.6	57	0	0	0	0	113.6	T6 S31 I32	T6-S8 WeakPolarHBondContact CG2-OG 3.42Å; T6-S8 PolarHBondContact O-N 3.32Å; S8-S31 WeakPolarHBondContact CA-OG 2.79Å; S8-S31 PolarHBondContact O-OG 2.94Å; S8-I32 WeakPolarHBondContact O-CD1 3.34Å; S8-I32 WeakPolarHBondContact O-CG1 3.49Å
9	N	65.2	Low	70.1	Confident	95 Å²	95	63.3 Å²	63.3	51%	0.508	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-106.3	10.2	-173.1	-58	-2.9	0	0	0	113.4	F7 I79	F7-N9 PolarHBondContact O-N 2.83Å; N9-I79 PolarHBondContact O-N 2.87Å; N9-I79 VanDerWaalsContact O-N 3.15Å
10	Y	69.8	Low	71.3	Confident	29 Å²	29	64.8 Å²	64.8	11%	0.114	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.5	-176.2	-68.8	-90.2	0	0	0	110.7	F7 R76 G77 R78	F7-Y10 PolarHBondContact O-N 2.82Å; Y10-R76 HydrophobicContact CD1-CB 4.26Å; Y10-R76 HydrophobicContact CD1-CG 4.37Å; Y10-G77 CarbonylContact C-O 3.47Å; Y10-G77 VanDerWaalsContact CA-O 3.28Å; Y10-G77 WeakPolarHBondContact CA-O 3.43Å; Y10-R78 HydrophobicContact CD1-CG 3.92Å; Y10-R78 HydrophobicContact CE1-CB 4.39Å; Y10-R78 HydrophobicContact CE1-CG 3.3Å; Y10-R78 PolarHBondContact OH-NE 2.97Å
11	S	77.1	Confident	72.4	Confident	20 Å²	20	67.3 Å²	67.3	14%	0.14	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	143.3	159.8	66.9	0	0	0	0	108.8	N13 F29 R76 G77	S11-N13 PolarHBondContact O-ND2 3.38Å; S11-N13 PolarHBondContact OG-ND2 3.08Å; S11-F29 CarbonylContact C-O 3.55Å; S11-F29 WeakPolarHBondContact CA-O 3.47Å; S11-R76 CarbonylContact O-C 3.57Å; S11-R76 WeakPolarHBondContact O-CA 3.42Å; S11-G77 PolarHBondContact N-O 3.3Å; S11-G77 PolarHBondContact O-N 2.84Å; S11-G77 PolarHBondContact OG-O 3.36Å
12	I	81.6	Confident	74.9	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.3	-179.7	-60.1	171.2	0	0	0	107.1	F7 S28 F29 L57	F7-I12 HydrophobicContact CD1-CD1 3.53Å; F7-I12 HydrophobicContact CD1-CG1 4.27Å; F7-I12 HydrophobicContact CE1-CD1 4.09Å; I12-S28 CarbonylContact O-C 3.46Å; I12-S28 VanDerWaalsContact O-CA 3.3Å; I12-S28 WeakPolarHBondContact O-CA 3.44Å; I12-F29 HydrophobicContact CD1-CD1 4.48Å; I12-F29 PolarHBondContact N-O 2.88Å; I12-F29 PolarHBondContact O-N 3.22Å; I12-L57 HydrophobicContact CB-CD1 4.39Å; I12-L57 HydrophobicContact CD1-CD1 3.82Å; I12-L57 HydrophobicContact CD1-CD2 3.33Å; I12-L57 HydrophobicContact CD1-CG 4.1Å; I12-L57 HydrophobicContact CG1-CD1 4.26Å; I12-L57 HydrophobicContact CG1-CD2 4.44Å; I12-L57 HydrophobicContact CG2-CD1 3.33Å; I12-L57 HydrophobicContact CG2-CD2 3.94Å; I12-L57 HydrophobicContact CG2-CG 4.1Å
13	N	85.7	Confident	77.4	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	132.7	-164.2	-58.9	-65.2	0	0	0	109.7	S11 W25 S27 S28 A75 G77	S11-N13 PolarHBondContact O-ND2 3.38Å; S11-N13 PolarHBondContact OG-ND2 3.08Å; N13-W25 HydrophobicContact CB-CE3 4.19Å; N13-W25 HydrophobicContact CB-CH2 4.32Å; N13-W25 HydrophobicContact CB-CZ3 3.44Å; N13-W25 VanDerWaalsContact CB-CZ3 3.44Å; N13-W25 VanDerWaalsContact CG-CZ3 3.43Å; N13-W25 WeakPolarHBondContact OD1-CZ3 3.44Å; N13-S27 WeakPolarHBondContact CA-O 3.23Å; N13-S28 WeakPolarHBondContact OD1-CB 3.34Å; N13-S28 PolarHBondContact OD1-OG 3.38Å; N13-A75 HydrophobicContact CB-CB 4.31Å; N13-A75 WeakPolarHBondContact CB-O 3.37Å; N13-A75 PolarHBondContact N-O 2.9Å; N13-A75 PolarHBondContact O-N 2.96Å; N13-G77 PolarHBondContact ND2-N 3.2Å
14	W	90.9	Very high	79.6	Confident	37 Å²	37	63.1 Å²	63.1	14%	0.14	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.4	163.7	-73.8	99.1	0	0	0	108.8	V26 S27 L59 Y73 C74	W14-V26 HydrophobicContact CB-CB 4.08Å; W14-V26 HydrophobicContact CB-CG1 4.49Å; W14-V26 WeakPolarHBondContact O-CB 3.31Å; W14-V26 PolarHBondContact O-N 2.98Å; W14-S27 PolarHBondContact N-O 2.85Å; W14-S27 PolarHBondContact O-N 2.99Å; W14-L59 HydrophobicContact CB-CD2 3.92Å; W14-L59 HydrophobicContact CD2-CB 3.98Å; W14-L59 HydrophobicContact CD2-CD2 3.87Å; W14-L59 HydrophobicContact CE3-CD2 4.25Å; W14-L59 HydrophobicContact CG-CB 4.17Å; W14-L59 HydrophobicContact CG-CD1 4.47Å; W14-L59 HydrophobicContact CG-CD2 3.7Å; W14-L59 HydrophobicContact CG-CG 4.35Å; W14-L59 HydrophobicContact CZ2-CB 4.05Å; W14-Y73 WeakPolarHBondContact CA-O 3.27Å; W14-C74 HydrophobicContact CE3-CB 4.3Å; W14-C74 HydrophobicContact CH2-CB 4.01Å; W14-C74 HydrophobicContact CZ2-CB 4.28Å; W14-C74 HydrophobicContact CZ3-CB 4.01Å
15	V	92.4	Very high	81.7	Confident	3 Å²	3	58 Å²	58	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148.2	172.8	-60.3	0	0	0	0	108.7	L23 E24 W25 Y72 Y73 M87	V15-L23 HydrophobicContact CG2-CD2 4.24Å; V15-E24 CarbonylContact C-O 3.59Å; V15-E24 WeakPolarHBondContact CA-O 3.21Å; V15-W25 HydrophobicContact CG1-CD2 4.02Å; V15-W25 HydrophobicContact CG1-CE3 3.7Å; V15-W25 HydrophobicContact CG1-CZ3 4.13Å; V15-Y72 CarbonylContact O-C 3.49Å; V15-Y72 WeakPolarHBondContact O-CA 3.2Å; V15-Y73 HydrophobicContact CG2-CD2 4.26Å; V15-Y73 HydrophobicContact CG2-CG 4.43Å; V15-Y73 PolarHBondContact N-O 2.82Å; V15-Y73 PolarHBondContact O-N 3.33Å; V15-M87 HydrophobicContact CG1-SD 4.24Å
16	R	94.9	Very high	83.7	Confident	11 Å²	11	52.9 Å²	52.9	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151.8	176.3	72.9	-179.3	-177.6	-175.8	5.5	111.4	E24 V26 D68 A70 V71 Y72	R16-E24 HydrophobicContact CG-CB 4.15Å; R16-E24 PolarHBondContact N-O 2.91Å; R16-E24 IonicContact NE-OE2 3.78Å; R16-E24 PolarHBondContact NE-OE2 3.14Å; R16-E24 IonicContact NH2-OE2 3.89Å; R16-E24 PolarHBondContact O-N 3.08Å; R16-V26 HydrophobicContact CB-CG2 3.73Å; R16-V26 HydrophobicContact CG-CG2 3.56Å; R16-D68 IonicContact CZ-OD1 3.38Å; R16-D68 IonicContact NH1-OD1 3.79Å; R16-D68 PolarHBondContact NH1-OD1 3.13Å; R16-A70 HydrophobicContact CB-CB 3.89Å; R16-A70 HydrophobicContact CG-CB 4.26Å; R16-V71 CarbonylContact C-O 3.58Å; R16-V71 VanDerWaalsContact CA-O 3.23Å; R16-V71 WeakPolarHBondContact CA-O 2.97Å; R16-Y72 HydrophobicContact CB-CD1 3.8Å; R16-Y72 HydrophobicContact CB-CD2 4.48Å; R16-Y72 HydrophobicContact CB-CE1 3.72Å; R16-Y72 HydrophobicContact CB-CE2 4.39Å; R16-Y72 HydrophobicContact CB-CG 4.19Å; R16-Y72 WeakPolarHBondContact CD-OH 2.78Å; R16-Y72 HydrophobicContact CG-CE1 4.38Å; R16-Y72 PolarHBondContact NH1-OH 3.32Å
17	Q	95.1	Very high	85.6	Confident	77 Å²	77	47.9 Å²	47.9	36%	0.36	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	108.9	171.6	-167	175.6	22.3	0	0	109.4	K21 L23 A70 V71 Y73	Q17-K21 WeakPolarHBondContact CG-O 3.38Å; Q17-K21 PolarHBondContact NE2-O 2.83Å; Q17-L23 HydrophobicContact CB-CD2 4.01Å; Q17-A70 WeakPolarHBondContact O-CA 3.4Å; Q17-A70 WeakPolarHBondContact O-CB 3.08Å; Q17-V71 PolarHBondContact N-O 3.1Å; Q17-V71 PolarHBondContact O-N 2.89Å; Q17-Y73 HydrophobicContact CB-CE2 4Å
18	A	96	Very high	87.2	Confident	13 Å²	13	47.5 Å²	47.5	11%	0.107	28%	0.278	C	S	.	.			trans	-76.9	154.6	170.9	0	0	0	0	0	110.3	G20 K21 A70	A18-G20 PolarHBondContact O-N 3.06Å; A18-K21 HydrophobicContact CB-CB 4.19Å; A18-K21 HydrophobicContact CB-CD 4.05Å; A18-K21 HydrophobicContact CB-CG 4.17Å; A18-K21 PolarHBondContact O-N 3.1Å; A18-A70 HydrophobicContact CB-CB 4.38Å
19	P	93.9	Very high	88.4	Confident	113 Å²	113	47.3 Å²	47.3	73%	0.734	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	126.7	176	-25.8	34.8	0	0	0	111.8	K21	P19-K21 PolarHBondContact O-N 2.78Å
20	G	94.7	Very high	89	Confident	94 Å²	94	43.4 Å²	43.4	97%	0.969	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	6.1	-179.5	0	0	0	0	0	115.6	A18	A18-G20 PolarHBondContact O-N 3.06Å
21	K	93.5	Very high	89.2	Confident	118 Å²	118	43.8 Å²	43.8	51%	0.513	26%	0.259	S	S	.	.			trans	-112	162	176.9	-62	-162.7	-177.5	178.9	0	112.8	Q17 A18 P19	Q17-K21 WeakPolarHBondContact CG-O 3.38Å; Q17-K21 PolarHBondContact NE2-O 2.83Å; A18-K21 HydrophobicContact CB-CB 4.19Å; A18-K21 HydrophobicContact CB-CD 4.05Å; A18-K21 HydrophobicContact CB-CG 4.17Å; A18-K21 PolarHBondContact O-N 3.1Å; P19-K21 PolarHBondContact O-N 2.78Å
22	G	91.6	Very high	88.8	Confident	51 Å²	51	47.4 Å²	47.4	53%	0.526	28%	0.276	S	S	.	.			trans	-71.4	179.2	168.4	0	0	0	0	0	112.6
23	L	91.6	Very high	88.3	Confident	104 Å²	104	52.1 Å²	52.1	55%	0.545	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131	172.9	-70.3	167	0	0	0	110.5	V15 Q17 Y73	V15-L23 HydrophobicContact CG2-CD2 4.24Å; Q17-L23 HydrophobicContact CB-CD2 4.01Å; L23-Y73 HydrophobicContact CD2-CD2 4.2Å; L23-Y73 HydrophobicContact CD2-CE2 4.23Å
24	E	92.3	Very high	87.9	Confident	63 Å²	63	58.1 Å²	58.1	29%	0.294	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.5	177.7	-66	177.4	177.4	0	0	110	V15 R16	V15-E24 CarbonylContact C-O 3.59Å; V15-E24 WeakPolarHBondContact CA-O 3.21Å; R16-E24 HydrophobicContact CG-CB 4.15Å; R16-E24 PolarHBondContact N-O 2.91Å; R16-E24 IonicContact NE-OE2 3.78Å; R16-E24 PolarHBondContact NE-OE2 3.14Å; R16-E24 IonicContact NH2-OE2 3.89Å; R16-E24 PolarHBondContact O-N 3.08Å
25	W	90.9	Very high	87.6	Confident	105 Å²	105	62.2 Å²	62.2	40%	0.398	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135.2	172.8	-68.2	99.1	0	0	0	110.8	N13 V15 A39 M87	N13-W25 HydrophobicContact CB-CE3 4.19Å; N13-W25 HydrophobicContact CB-CH2 4.32Å; N13-W25 HydrophobicContact CB-CZ3 3.44Å; N13-W25 VanDerWaalsContact CB-CZ3 3.44Å; N13-W25 VanDerWaalsContact CG-CZ3 3.43Å; N13-W25 WeakPolarHBondContact OD1-CZ3 3.44Å; V15-W25 HydrophobicContact CG1-CD2 4.02Å; V15-W25 HydrophobicContact CG1-CE3 3.7Å; V15-W25 HydrophobicContact CG1-CZ3 4.13Å; W25-A39 WeakPolarHBondContact O-CB 3.47Å; W25-M87 HydrophobicContact CH2-CE 3.4Å; W25-M87 HydrophobicContact CH2-CG 4.02Å; W25-M87 HydrophobicContact CH2-SD 3.2Å; W25-M87 WeakPolarHBondContact CH2-SD 3.32Å; W25-M87 HydrophobicContact CZ2-CE 2.99Å; W25-M87 HydrophobicContact CZ2-CG 4.39Å; W25-M87 HydrophobicContact CZ2-SD 3.55Å; W25-M87 VanDerWaalsContact CZ2-SD 3.55Å; W25-M87 HydrophobicContact CZ3-CE 4.3Å; W25-M87 HydrophobicContact CZ3-SD 3.87Å
26	V	94.6	Very high	87.3	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-53.8	179.5	178	0	0	0	0	110.4	W14 R16 A39 V42 F46 L59 Y72	W14-V26 HydrophobicContact CB-CB 4.08Å; W14-V26 HydrophobicContact CB-CG1 4.49Å; W14-V26 WeakPolarHBondContact O-CB 3.31Å; W14-V26 PolarHBondContact O-N 2.98Å; R16-V26 HydrophobicContact CB-CG2 3.73Å; R16-V26 HydrophobicContact CG-CG2 3.56Å; V26-A39 PolarHBondContact O-N 2.85Å; V26-V42 HydrophobicContact CG1-CG1 4.24Å; V26-V42 HydrophobicContact CG1-CG2 3.97Å; V26-V42 WeakPolarHBondContact O-CG2 3.33Å; V26-F46 HydrophobicContact CG1-CD2 3.77Å; V26-F46 HydrophobicContact CG1-CE2 4.12Å; V26-L59 HydrophobicContact CG1-CD2 4.02Å; V26-Y72 HydrophobicContact CG1-CE1 4.42Å; V26-Y72 HydrophobicContact CG2-CD1 4.33Å; V26-Y72 HydrophobicContact CG2-CE1 4.01Å
27	S	92.3	Very high	87.1	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	156.6	176.9	60.3	0	0	0	0	111.1	N13 W14 Y37	N13-S27 WeakPolarHBondContact CA-O 3.23Å; W14-S27 PolarHBondContact N-O 2.85Å; W14-S27 PolarHBondContact O-N 2.99Å; S27-Y37 CarbonylContact C-O 3.55Å; S27-Y37 WeakPolarHBondContact CA-O 3.17Å; S27-Y37 VanDerWaalsContact CB-O 3.27Å; S27-Y37 WeakPolarHBondContact CB-O 3.37Å
28	S	87.7	Confident	87.1	Confident	18 Å²	18	68.1 Å²	68.1	13%	0.126	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.9	174.9	-177.4	0	0	0	0	110	I12 N13 I36 Y37	I12-S28 CarbonylContact O-C 3.46Å; I12-S28 VanDerWaalsContact O-CA 3.3Å; I12-S28 WeakPolarHBondContact O-CA 3.44Å; N13-S28 WeakPolarHBondContact OD1-CB 3.34Å; N13-S28 PolarHBondContact OD1-OG 3.38Å; S28-I36 CarbonylContact O-C 3.6Å; S28-I36 WeakPolarHBondContact O-CA 3.49Å; S28-Y37 PolarHBondContact N-O 2.82Å; S28-Y37 PolarHBondContact O-N 3.34Å
29	F	84.1	Confident	87.1	Confident	35 Å²	35	67.9 Å²	67.9	15%	0.154	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.7	174	173	-87.5	0	0	0	109	S11 I12 Y35 I36 I48	S11-F29 CarbonylContact C-O 3.55Å; S11-F29 WeakPolarHBondContact CA-O 3.47Å; I12-F29 HydrophobicContact CD1-CD1 4.48Å; I12-F29 PolarHBondContact N-O 2.88Å; I12-F29 PolarHBondContact O-N 3.22Å; F29-Y35 WeakPolarHBondContact CA-O 3.33Å; F29-I36 HydrophobicContact CD2-CD1 3.95Å; F29-I36 HydrophobicContact CD2-CG1 3.82Å; F29-I36 HydrophobicContact CE2-CD1 4.3Å; F29-I36 HydrophobicContact CE2-CG1 4.35Å; F29-I48 HydrophobicContact CB-CD1 3.8Å; F29-I48 HydrophobicContact CB-CG2 4.31Å
30	S	79.1	Confident	87.1	Confident	12 Å²	12	68.8 Å²	68.8	8%	0.084	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	138	169.4	-176	0	0	0	0	109.5	I32 P33 N34 Y35 I79	S30-I32 PolarHBondContact OG-N 2.83Å; S30-I32 PolarHBondContact OG-O 2.92Å; S30-P33 CarbonylContact C-O 3.38Å; S30-P33 WeakPolarHBondContact CB-O 3.21Å; S30-P33 PolarHBondContact OG-O 2.71Å; S30-N34 VanDerWaalsContact O-CA 3.31Å; S30-N34 WeakPolarHBondContact O-CA 3.34Å; S30-Y35 PolarHBondContact N-O 2.67Å; S30-Y35 PolarHBondContact O-N 3.23Å; S30-I79 VanDerWaalsContact OG-CD1 3.29Å; S30-I79 WeakPolarHBondContact OG-CD1 3.47Å
31	S	72.4	Confident	87.1	Confident	37 Å²	37	66.7 Å²	66.7	26%	0.259	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-17.3	171.6	47	0	0	0	0	113.4	S8 P33	S8-S31 WeakPolarHBondContact CA-OG 2.79Å; S8-S31 PolarHBondContact O-OG 2.94Å; S31-P33 CarbonylContact C-O 3.5Å
32	I	70.3	Confident	87.2	Confident	96 Å²	96	61.1 Å²	61.1	49%	0.492	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	99.9	-176.8	-52.9	-178.6	0	0	0	109.5	S8 S30	S8-I32 WeakPolarHBondContact O-CD1 3.34Å; S8-I32 WeakPolarHBondContact O-CG1 3.49Å; S30-I32 PolarHBondContact OG-N 2.83Å; S30-I32 PolarHBondContact OG-O 2.92Å
33	P	70.7	Confident	87.4	Confident	103 Å²	103	65.3 Å²	65.3	67%	0.669	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	cis	-66.3	163	-12.8	31.6	-35.6	0	0	0	111.5	S30 S31 Y35	S30-P33 CarbonylContact C-O 3.38Å; S30-P33 WeakPolarHBondContact CB-O 3.21Å; S30-P33 PolarHBondContact OG-O 2.71Å; S31-P33 CarbonylContact C-O 3.5Å; P33-Y35 PolarHBondContact O-N 3.21Å
34	N	77.9	Confident	87.6	Confident	130 Å²	130	64.2 Å²	64.2	70%	0.695	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	101	173.1	-176.4	41.4	0	0	0	109.7	S30	S30-N34 VanDerWaalsContact O-CA 3.31Å; S30-N34 WeakPolarHBondContact O-CA 3.34Å
35	Y	82.6	Confident	87.9	Confident	124 Å²	124	62.1 Å²	62.1	49%	0.486	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.4	-173.5	174.2	-104.2	0	0	0	110.4	F29 S30 P33	F29-Y35 WeakPolarHBondContact CA-O 3.33Å; S30-Y35 PolarHBondContact N-O 2.67Å; S30-Y35 PolarHBondContact O-N 3.23Å; P33-Y35 PolarHBondContact O-N 3.21Å
36	I	88.2	Confident	88.1	Confident	72 Å²	72	57.3 Å²	57.3	37%	0.369	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126.2	175	-49.4	-171.2	0	0	0	108.9	S28 F29 Y38 I48	S28-I36 CarbonylContact O-C 3.6Å; S28-I36 WeakPolarHBondContact O-CA 3.49Å; F29-I36 HydrophobicContact CD2-CD1 3.95Å; F29-I36 HydrophobicContact CD2-CG1 3.82Å; F29-I36 HydrophobicContact CE2-CD1 4.3Å; F29-I36 HydrophobicContact CE2-CG1 4.35Å; I36-Y38 HydrophobicContact CB-CE2 4.41Å; I36-Y38 HydrophobicContact CG2-CD2 4.06Å; I36-Y38 HydrophobicContact CG2-CE1 4.4Å; I36-Y38 HydrophobicContact CG2-CE2 3.38Å; I36-I48 HydrophobicContact CG2-CG2 3.58Å
37	Y	90.5	Very high	88.1	Confident	89 Å²	89	60.2 Å²	60.2	35%	0.349	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	142.4	171.3	173.6	-100.4	0	0	0	110.3	S27 S28 A39	S27-Y37 CarbonylContact C-O 3.55Å; S27-Y37 WeakPolarHBondContact CA-O 3.17Å; S27-Y37 VanDerWaalsContact CB-O 3.27Å; S27-Y37 WeakPolarHBondContact CB-O 3.37Å; S28-Y37 PolarHBondContact N-O 2.82Å; S28-Y37 PolarHBondContact O-N 3.34Å; Y37-A39 HydrophobicContact CE1-CB 4.26Å
38	Y	94.4	Very high	88	Confident	53 Å²	53	60.7 Å²	60.7	21%	0.208	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.8	167.2	-62.8	-80.7	0	0	0	108.1	I36 F46 I48	I36-Y38 HydrophobicContact CB-CE2 4.41Å; I36-Y38 HydrophobicContact CG2-CD2 4.06Å; I36-Y38 HydrophobicContact CG2-CE1 4.4Å; I36-Y38 HydrophobicContact CG2-CE2 3.38Å; Y38-F46 VanDerWaalsContact CE1-O 3.24Å; Y38-F46 WeakPolarHBondContact CE1-O 3.43Å; Y38-I48 HydrophobicContact CE1-CB 4.44Å; Y38-I48 HydrophobicContact CE1-CG2 4.15Å; Y38-I48 PolarHBondContact OH-N 3.07Å; Y38-I48 VanDerWaalsContact OH-N 3.13Å
39	A	94.9	Very high	87.9	Confident	8 Å²	8	62.4 Å²	62.4	7%	0.066	35%	0.345	C	S	.	.			trans	-64.7	147.2	169.9	0	0	0	0	0	110.3	W25 V26 Y37 S41 V42 K43	W25-A39 WeakPolarHBondContact O-CB 3.47Å; V26-A39 PolarHBondContact O-N 2.85Å; Y37-A39 HydrophobicContact CE1-CB 4.26Å; A39-S41 PolarHBondContact O-N 2.83Å; A39-S41 VanDerWaalsContact O-N 3.14Å; A39-V42 HydrophobicContact CB-CG2 4.27Å; A39-V42 WeakPolarHBondContact O-CG2 3.21Å; A39-V42 PolarHBondContact O-N 2.85Å; A39-K43 PolarHBondContact O-N 2.97Å
40	D	95.8	Very high	87.7	Confident	133 Å²	133	64.5 Å²	64.5	71%	0.711	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.3	-175.9	-67.9	-35	0	0	0	112.5	V42	D40-V42 PolarHBondContact O-N 2.98Å
41	S	94.3	Very high	87.8	Confident	50 Å²	50	66 Å²	66	35%	0.35	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.2	175.4	55.6	0	0	0	0	113.7	A39 R45	A39-S41 PolarHBondContact O-N 2.83Å; A39-S41 VanDerWaalsContact O-N 3.14Å; S41-R45 PolarHBondContact O-NE 2.79Å; S41-R45 PolarHBondContact O-NH2 2.68Å
42	V	95.9	Very high	87.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-4.4	-173.5	-58.2	0	0	0	0	113.7	V26 A39 D40 G44 R45 F46	V26-V42 HydrophobicContact CG1-CG1 4.24Å; V26-V42 HydrophobicContact CG1-CG2 3.97Å; V26-V42 WeakPolarHBondContact O-CG2 3.33Å; A39-V42 HydrophobicContact CB-CG2 4.27Å; A39-V42 WeakPolarHBondContact O-CG2 3.21Å; A39-V42 PolarHBondContact O-N 2.85Å; D40-V42 PolarHBondContact O-N 2.98Å; V42-G44 PolarHBondContact O-N 3.14Å; V42-R45 WeakPolarHBondContact O-CB 3.28Å; V42-R45 PolarHBondContact O-N 3.24Å; V42-F46 HydrophobicContact CB-CB 4.1Å; V42-F46 HydrophobicContact CB-CD1 4.26Å; V42-F46 HydrophobicContact CB-CD2 3.6Å; V42-F46 HydrophobicContact CB-CE2 3.99Å; V42-F46 HydrophobicContact CB-CG 3.73Å; V42-F46 HydrophobicContact CB-CZ 4.45Å; V42-F46 HydrophobicContact CG1-CD2 3.6Å; V42-F46 HydrophobicContact CG1-CE1 4.43Å; V42-F46 HydrophobicContact CG1-CE2 3.46Å; V42-F46 VanDerWaalsContact CG1-CE2 3.46Å; V42-F46 HydrophobicContact CG1-CG 4.16Å; V42-F46 HydrophobicContact CG1-CZ 3.89Å; V42-F46 HydrophobicContact CG2-CB 4.4Å; V42-F46 HydrophobicContact CG2-CD2 4.15Å; V42-F46 HydrophobicContact CG2-CG 4.43Å; V42-F46 PolarHBondContact O-N 3.44Å
43	K	95.4	Very high	88.3	Confident	139 Å²	139	68.2 Å²	68.2	60%	0.604	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	130.1	-177.9	-167	173.2	-174.9	176.7	0	110.8	A39 R45	A39-K43 PolarHBondContact O-N 2.97Å; K43-R45 PolarHBondContact O-N 3.38Å
44	G	95.9	Very high	88.7	Confident	82 Å²	82	70.2 Å²	70.2	85%	0.845	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-4.8	-176.1	0	0	0	0	0	115.1	V42	V42-G44 PolarHBondContact O-N 3.14Å
45	R	97.3	Very high	88.5	Confident	19 Å²	19	67 Å²	67	7%	0.072	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-41.6	176.7	-59	-167.2	-58.2	115.7	-2.2	111.4	S41 V42 K43 N62 S63 E67 D68	S41-R45 PolarHBondContact O-NE 2.79Å; S41-R45 PolarHBondContact O-NH2 2.68Å; V42-R45 WeakPolarHBondContact O-CB 3.28Å; V42-R45 PolarHBondContact O-N 3.24Å; K43-R45 PolarHBondContact O-N 3.38Å; R45-N62 WeakPolarHBondContact CB-O 3.45Å; R45-N62 WeakPolarHBondContact O-CA 3.37Å; R45-N62 VanDerWaalsContact O-CB 3.28Å; R45-N62 WeakPolarHBondContact O-CB 3.45Å; R45-N62 PolarHBondContact O-N 3.47Å; R45-S63 PolarHBondContact NH1-O 2.92Å; R45-E67 IonicContact NH2-OE1 3.1Å; R45-D68 IonicContact CZ-OD1 2.83Å; R45-D68 IonicContact CZ-OD2 3.21Å; R45-D68 IonicContact NH1-OD1 2.92Å; R45-D68 IonicContact NH1-OD2 3.76Å; R45-D68 PolarHBondContact NH1-OD2 2.83Å; R45-D68 IonicContact NH2-OD1 3.75Å; R45-D68 PolarHBondContact NH2-OD1 2.87Å; R45-D68 IonicContact NH2-OD2 2.67Å; R45-D68 PolarHBondContact NH2-OD2 2.95Å
46	F	95.8	Very high	88.3	Confident	4 Å²	4	63 Å²	63	2%	0.018	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	148.3	-176.7	-65.1	9.9	0	0	0	111.1	V26 Y38 V42 L59 Q60 M61 L64 D68 Y72	V26-F46 HydrophobicContact CG1-CD2 3.77Å; V26-F46 HydrophobicContact CG1-CE2 4.12Å; Y38-F46 VanDerWaalsContact CE1-O 3.24Å; Y38-F46 WeakPolarHBondContact CE1-O 3.43Å; V42-F46 HydrophobicContact CB-CB 4.1Å; V42-F46 HydrophobicContact CB-CD1 4.26Å; V42-F46 HydrophobicContact CB-CD2 3.6Å; V42-F46 HydrophobicContact CB-CE2 3.99Å; V42-F46 HydrophobicContact CB-CG 3.73Å; V42-F46 HydrophobicContact CB-CZ 4.45Å; V42-F46 HydrophobicContact CG1-CD2 3.6Å; V42-F46 HydrophobicContact CG1-CE1 4.43Å; V42-F46 HydrophobicContact CG1-CE2 3.46Å; V42-F46 VanDerWaalsContact CG1-CE2 3.46Å; V42-F46 HydrophobicContact CG1-CG 4.16Å; V42-F46 HydrophobicContact CG1-CZ 3.89Å; V42-F46 HydrophobicContact CG2-CB 4.4Å; V42-F46 HydrophobicContact CG2-CD2 4.15Å; V42-F46 HydrophobicContact CG2-CG 4.43Å; V42-F46 PolarHBondContact O-N 3.44Å; F46-L59 HydrophobicContact CB-CD1 4.15Å; F46-L59 HydrophobicContact CD2-CD1 4.38Å; F46-L59 HydrophobicContact CD2-CD2 4.33Å; F46-L59 HydrophobicContact CD2-CG 4.46Å; F46-Q60 CarbonylContact C-O 3.52Å; F46-Q60 VanDerWaalsContact CA-O 3.24Å; F46-Q60 WeakPolarHBondContact CA-O 3.3Å; F46-M61 HydrophobicContact CD1-CB 3.87Å; F46-M61 HydrophobicContact CD1-CG 4.12Å; F46-M61 HydrophobicContact CD2-CG 3.97Å; F46-M61 HydrophobicContact CE1-CB 3.74Å; F46-M61 HydrophobicContact CE1-CG 4.04Å; F46-M61 HydrophobicContact CE2-CB 4.46Å; F46-M61 HydrophobicContact CE2-CE 4.43Å; F46-M61 HydrophobicContact CE2-CG 3.86Å; F46-M61 HydrophobicContact CE2-SD 4.23Å; F46-M61 HydrophobicContact CG-CB 4.35Å; F46-M61 HydrophobicContact CG-CG 4.12Å; F46-M61 HydrophobicContact CZ-CB 4.05Å; F46-M61 HydrophobicContact CZ-CG 3.91Å; F46-M61 HydrophobicContact CZ-SD 4.25Å; F46-L64 HydrophobicContact CE1-CD2 3.91Å; F46-L64 HydrophobicContact CZ-CD2 3.78Å; F46-D68 HydrophobicContact CZ-CB 4.28Å; F46-Y72 HydrophobicContact CE2-CE1 4.22Å
47	T	94	Very high	87.9	Confident	61 Å²	61	61 Å²	61	37%	0.374	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	125	178.3	-56.1	0	0	0	0	109.5	Q60	T47-Q60 PolarHBondContact N-O 3.15Å; T47-Q60 PolarHBondContact O-N 3.21Å
48	I	90.5	Very high	87.7	Confident	9 Å²	9	61.6 Å²	61.6	5%	0.046	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	135.9	172.3	-166.2	173.3	0	0	0	110	F29 I36 Y38 Y58	F29-I48 HydrophobicContact CB-CD1 3.8Å; F29-I48 HydrophobicContact CB-CG2 4.31Å; I36-I48 HydrophobicContact CG2-CG2 3.58Å; Y38-I48 HydrophobicContact CE1-CB 4.44Å; Y38-I48 HydrophobicContact CE1-CG2 4.15Å; Y38-I48 PolarHBondContact OH-N 3.07Å; Y38-I48 VanDerWaalsContact OH-N 3.13Å; I48-Y58 WeakPolarHBondContact CA-O 3.46Å
49	S	85.9	Confident	87.6	Confident	55 Å²	55	60.3 Å²	60.3	39%	0.385	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	163.7	175.5	69.7	0	0	0	0	112	Y58	S49-Y58 PolarHBondContact N-O 2.85Å; S49-Y58 PolarHBondContact O-N 3Å
50	R	80.1	Confident	87.7	Confident	79 Å²	79	65 Å²	65	30%	0.298	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132	-177.1	179.3	176.1	177.8	-136.2	-16.2	110.5	F7 L57	F7-R50 VanDerWaalsContact CB-NH2 3.3Å; R50-L57 HydrophobicContact CB-CD2 3.83Å; R50-L57 HydrophobicContact CG-CD2 3.71Å
51	D	81.3	Confident	87.6	Confident	44 Å²	44	60.7 Å²	60.7	24%	0.235	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	105.4	166.5	-174.9	-25.4	0	0	0	108.6	A53 K54 N55 S56 Y58	D51-A53 VanDerWaalsContact C-N 3.32Å; D51-A53 WeakPolarHBondContact OD1-CA 3.34Å; D51-A53 WeakPolarHBondContact OD1-CB 3.24Å; D51-A53 PolarHBondContact OD1-N 3.31Å; D51-K54 HydrophobicContact CB-CB 4.24Å; D51-K54 PolarHBondContact OD1-N 2.99Å; D51-K54 WeakPolarHBondContact OD2-CD 3.15Å; D51-K54 WeakPolarHBondContact OD2-CE 3.24Å; D51-K54 VanDerWaalsContact OD2-CG 3.32Å; D51-K54 WeakPolarHBondContact OD2-CG 3.27Å; D51-K54 IonicContact OD2-NZ 3.94Å; D51-N55 WeakPolarHBondContact O-CA 3.41Å; D51-N55 PolarHBondContact O-N 2.83Å; D51-S56 PolarHBondContact N-O 2.83Å; D51-S56 PolarHBondContact O-N 3.34Å; D51-Y58 HydrophobicContact CB-CE2 3.74Å
52	S	74	Confident	87.7	Confident	80 Å²	80	61.6 Å²	61.6	56%	0.559	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-24.5	-179.1	-62.5	0	0	0	0	112.9
53	A	79.3	Confident	87.7	Confident	99 Å²	99	66.2 Å²	66.2	82%	0.818	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-37.6	177.5	0	0	0	0	0	111.1	D51	D51-A53 VanDerWaalsContact C-N 3.32Å; D51-A53 WeakPolarHBondContact OD1-CA 3.34Å; D51-A53 WeakPolarHBondContact OD1-CB 3.24Å; D51-A53 PolarHBondContact OD1-N 3.31Å
54	K	79.6	Confident	87.7	Confident	144 Å²	144	62.9 Å²	62.9	63%	0.626	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.4	176.9	-62.8	-178.4	-166.7	163.5	0	114.1	D51 S56	D51-K54 HydrophobicContact CB-CB 4.24Å; D51-K54 PolarHBondContact OD1-N 2.99Å; D51-K54 WeakPolarHBondContact OD2-CD 3.15Å; D51-K54 WeakPolarHBondContact OD2-CE 3.24Å; D51-K54 VanDerWaalsContact OD2-CG 3.32Å; D51-K54 WeakPolarHBondContact OD2-CG 3.27Å; D51-K54 IonicContact OD2-NZ 3.94Å; K54-S56 PolarHBondContact O-N 3.07Å; K54-S56 PolarHBondContact O-OG 2.84Å
55	N	72.8	Confident	87.7	Confident	62 Å²	62	65.4 Å²	65.4	33%	0.332	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	36.9	-175.2	-155.3	47.8	0	0	0	113.4	F7 D51	F7-N55 WeakPolarHBondContact CD2-OD1 3.27Å; F7-N55 VanDerWaalsContact CE2-CG 3.5Å; F7-N55 WeakPolarHBondContact CE2-OD1 3.44Å; D51-N55 WeakPolarHBondContact O-CA 3.41Å; D51-N55 PolarHBondContact O-N 2.83Å
56	S	77.9	Confident	87.6	Confident	40 Å²	40	68.7 Å²	68.7	28%	0.28	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.9	-170	-69.5	0	0	0	0	112	D51 K54 Y58	D51-S56 PolarHBondContact N-O 2.83Å; D51-S56 PolarHBondContact O-N 3.34Å; K54-S56 PolarHBondContact O-N 3.07Å; K54-S56 PolarHBondContact O-OG 2.84Å; S56-Y58 VanDerWaalsContact CB-OH 3.27Å; S56-Y58 WeakPolarHBondContact CB-OH 3.28Å
57	L	79.7	Confident	87.6	Confident	32 Å²	32	72.8 Å²	72.8	17%	0.168	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.9	179.8	-63.5	160.3	0	0	0	109.3	F7 I12 R50	F7-L57 HydrophobicContact CE1-CD1 4.15Å; I12-L57 HydrophobicContact CB-CD1 4.39Å; I12-L57 HydrophobicContact CD1-CD1 3.82Å; I12-L57 HydrophobicContact CD1-CD2 3.33Å; I12-L57 HydrophobicContact CD1-CG 4.1Å; I12-L57 HydrophobicContact CG1-CD1 4.26Å; I12-L57 HydrophobicContact CG1-CD2 4.44Å; I12-L57 HydrophobicContact CG2-CD1 3.33Å; I12-L57 HydrophobicContact CG2-CD2 3.94Å; I12-L57 HydrophobicContact CG2-CG 4.1Å; R50-L57 HydrophobicContact CB-CD2 3.83Å; R50-L57 HydrophobicContact CG-CD2 3.71Å
58	Y	87.8	Confident	87.7	Confident	101 Å²	101	69.9 Å²	69.9	40%	0.396	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.5	-174.8	-55.6	-81.9	0	0	0	109.8	I48 S49 D51 S56	I48-Y58 WeakPolarHBondContact CA-O 3.46Å; S49-Y58 PolarHBondContact N-O 2.85Å; S49-Y58 PolarHBondContact O-N 3Å; D51-Y58 HydrophobicContact CB-CE2 3.74Å; S56-Y58 VanDerWaalsContact CB-OH 3.27Å; S56-Y58 WeakPolarHBondContact CB-OH 3.28Å
59	L	92.3	Very high	88.1	Confident	25 Å²	25	71.1 Å²	71.1	13%	0.131	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	100.6	164.9	-176.6	62	0	0	0	106.8	W14 V26 F46 M61 Y72	W14-L59 HydrophobicContact CB-CD2 3.92Å; W14-L59 HydrophobicContact CD2-CB 3.98Å; W14-L59 HydrophobicContact CD2-CD2 3.87Å; W14-L59 HydrophobicContact CE3-CD2 4.25Å; W14-L59 HydrophobicContact CG-CB 4.17Å; W14-L59 HydrophobicContact CG-CD1 4.47Å; W14-L59 HydrophobicContact CG-CD2 3.7Å; W14-L59 HydrophobicContact CG-CG 4.35Å; W14-L59 HydrophobicContact CZ2-CB 4.05Å; V26-L59 HydrophobicContact CG1-CD2 4.02Å; F46-L59 HydrophobicContact CB-CD1 4.15Å; F46-L59 HydrophobicContact CD2-CD1 4.38Å; F46-L59 HydrophobicContact CD2-CD2 4.33Å; F46-L59 HydrophobicContact CD2-CG 4.46Å; L59-M61 HydrophobicContact CD2-CE 3.41Å; L59-M61 VanDerWaalsContact CD2-CE 3.41Å; L59-M61 HydrophobicContact CD2-CG 4.47Å; L59-M61 HydrophobicContact CG-CE 3.97Å; L59-M61 HydrophobicContact CG-CG 4.16Å; L59-Y72 HydrophobicContact CD2-CD1 4.19Å; L59-Y72 HydrophobicContact CD2-CE1 4.49Å
60	Q	95.2	Very high	88.6	Confident	106 Å²	106	68.7 Å²	68.7	50%	0.495	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	123.2	172.3	-177.2	175.4	-12	0	0	108.2	F46 T47 N62	F46-Q60 CarbonylContact C-O 3.52Å; F46-Q60 VanDerWaalsContact CA-O 3.24Å; F46-Q60 WeakPolarHBondContact CA-O 3.3Å; T47-Q60 PolarHBondContact N-O 3.15Å; T47-Q60 PolarHBondContact O-N 3.21Å; Q60-N62 PolarHBondContact NE2-ND2 2.87Å; Q60-N62 PolarHBondContact NE2-OD1 3.43Å
61	M	95.6	Very high	89.4	Confident	44 Å²	44	66.7 Å²	66.7	22%	0.217	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	103.5	-179.6	-58.6	174.9	-177.7	0	0	108.8	F46 L59 L64 Y72 V96	F46-M61 HydrophobicContact CD1-CB 3.87Å; F46-M61 HydrophobicContact CD1-CG 4.12Å; F46-M61 HydrophobicContact CD2-CG 3.97Å; F46-M61 HydrophobicContact CE1-CB 3.74Å; F46-M61 HydrophobicContact CE1-CG 4.04Å; F46-M61 HydrophobicContact CE2-CB 4.46Å; F46-M61 HydrophobicContact CE2-CE 4.43Å; F46-M61 HydrophobicContact CE2-CG 3.86Å; F46-M61 HydrophobicContact CE2-SD 4.23Å; F46-M61 HydrophobicContact CG-CB 4.35Å; F46-M61 HydrophobicContact CG-CG 4.12Å; F46-M61 HydrophobicContact CZ-CB 4.05Å; F46-M61 HydrophobicContact CZ-CG 3.91Å; F46-M61 HydrophobicContact CZ-SD 4.25Å; L59-M61 HydrophobicContact CD2-CE 3.41Å; L59-M61 VanDerWaalsContact CD2-CE 3.41Å; L59-M61 HydrophobicContact CD2-CG 4.47Å; L59-M61 HydrophobicContact CG-CE 3.97Å; L59-M61 HydrophobicContact CG-CG 4.16Å; M61-L64 HydrophobicContact CB-CD1 4.27Å; M61-L64 HydrophobicContact CB-CD2 3.89Å; M61-L64 HydrophobicContact CB-CG 4.03Å; M61-L64 HydrophobicContact SD-CD2 4.08Å; M61-Y72 HydrophobicContact CE-CD1 3.46Å; M61-Y72 VanDerWaalsContact CE-CD1 3.46Å; M61-Y72 HydrophobicContact CE-CD2 4.13Å; M61-Y72 HydrophobicContact CE-CE1 3.51Å; M61-Y72 HydrophobicContact CE-CE2 4.18Å; M61-Y72 HydrophobicContact CE-CG 3.79Å; M61-V96 HydrophobicContact CE-CG2 4.44Å; M61-V96 HydrophobicContact SD-CG2 4.4Å
62	N	95.6	Very high	90	Very high	69 Å²	69	64.8 Å²	64.8	37%	0.369	35%	0.351	S	S	.	.			trans	-98.4	155.4	173.5	-53.4	-53	0	0	0	109.7	R45 Q60 L64	R45-N62 WeakPolarHBondContact CB-O 3.45Å; R45-N62 WeakPolarHBondContact O-CA 3.37Å; R45-N62 VanDerWaalsContact O-CB 3.28Å; R45-N62 WeakPolarHBondContact O-CB 3.45Å; R45-N62 PolarHBondContact O-N 3.47Å; Q60-N62 PolarHBondContact NE2-ND2 2.87Å; Q60-N62 PolarHBondContact NE2-OD1 3.43Å; N62-L64 VanDerWaalsContact C-N 3.32Å; N62-L64 PolarHBondContact O-N 2.88Å
63	S	95.4	Very high	90.8	Very high	96 Å²	96	63.1 Å²	63.1	67%	0.671	33%	0.333	S	S	*	.	S	Bend	trans	51	49.4	176.6	-54.4	0	0	0	0	113	R45	R45-S63 PolarHBondContact NH1-O 2.92Å
64	L	95.8	Very high	91.2	Very high	69 Å²	69	59.1 Å²	59.1	36%	0.361	30%	0.299	S	S	.	.			trans	-59.7	144.5	176.8	-82	169.5	0	0	0	111.2	F46 M61 N62 D68 V96 V98	F46-L64 HydrophobicContact CE1-CD2 3.91Å; F46-L64 HydrophobicContact CZ-CD2 3.78Å; M61-L64 HydrophobicContact CB-CD1 4.27Å; M61-L64 HydrophobicContact CB-CD2 3.89Å; M61-L64 HydrophobicContact CB-CG 4.03Å; M61-L64 HydrophobicContact SD-CD2 4.08Å; N62-L64 VanDerWaalsContact C-N 3.32Å; N62-L64 PolarHBondContact O-N 2.88Å; L64-D68 HydrophobicContact CD2-CB 3.68Å; L64-V96 HydrophobicContact CD1-CG1 4.5Å; L64-V98 HydrophobicContact CB-CG1 4.35Å; L64-V98 HydrophobicContact CB-CG2 3.96Å; L64-V98 HydrophobicContact CD1-CG2 4.19Å; L64-V98 HydrophobicContact CD2-CG2 4.21Å; L64-V98 HydrophobicContact CG-CG2 4.36Å
65	R	96.1	Very high	91.5	Very high	136 Å²	136	52.4 Å²	52.4	51%	0.513	27%	0.27	S	S	.	.			trans	-125.4	162	177.3	-63.8	163.3	175.3	178.4	0.5	109.4	E67 D68 V98	R65-E67 HydrophobicContact CB-CG 3.78Å; R65-E67 WeakPolarHBondContact CB-OE1 3.29Å; R65-E67 WeakPolarHBondContact CD-OE1 3.31Å; R65-E67 IonicContact CZ-OE1 3.81Å; R65-E67 IonicContact NE-OE1 3.39Å; R65-E67 IonicContact NH1-OE1 2.83Å; R65-E67 PolarHBondContact NH1-OE1 3.36Å; R65-E67 VanDerWaalsContact NH1-OE1 3.1Å; R65-E67 PolarHBondContact O-N 3.2Å; R65-E67 VanDerWaalsContact O-N 3.13Å; R65-D68 PolarHBondContact N-OD2 3Å; R65-D68 WeakPolarHBondContact O-CB 3.45Å; R65-D68 PolarHBondContact O-N 2.63Å; R65-V98 WeakPolarHBondContact O-CB 3.41Å
66	V	96	Very high	91.7	Very high	88 Å²	88	52.4 Å²	52.4	53%	0.533	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-54.6	-35.9	179.2	177.8	0	0	0	0	111.7	D68 T69	V66-D68 PolarHBondContact O-N 2.81Å; V66-T69 VanDerWaalsContact O-CB 3.27Å; V66-T69 WeakPolarHBondContact O-CB 3.45Å; V66-T69 PolarHBondContact O-N 3.29Å; V66-T69 VanDerWaalsContact O-N 3.08Å; V66-T69 PolarHBondContact O-OG1 2.93Å
67	E	94.9	Very high	91.5	Very high	90 Å²	90	50.5 Å²	50.5	42%	0.421	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-64.6	-14.3	175.9	45.3	94.1	176.1	0	0	115.3	R45 R65 T69	R45-E67 IonicContact NH2-OE1 3.1Å; R65-E67 HydrophobicContact CB-CG 3.78Å; R65-E67 WeakPolarHBondContact CB-OE1 3.29Å; R65-E67 WeakPolarHBondContact CD-OE1 3.31Å; R65-E67 IonicContact CZ-OE1 3.81Å; R65-E67 IonicContact NE-OE1 3.39Å; R65-E67 IonicContact NH1-OE1 2.83Å; R65-E67 PolarHBondContact NH1-OE1 3.36Å; R65-E67 VanDerWaalsContact NH1-OE1 3.1Å; R65-E67 PolarHBondContact O-N 3.2Å; R65-E67 VanDerWaalsContact O-N 3.13Å; E67-T69 VanDerWaalsContact C-N 3.3Å
68	D	96.6	Very high	90.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-84.2	-3.1	172.9	-61.2	-54.4	0	0	0	113.6	R16 R45 F46 L64 R65 V66 A70 Y72	R16-D68 IonicContact CZ-OD1 3.38Å; R16-D68 IonicContact NH1-OD1 3.79Å; R16-D68 PolarHBondContact NH1-OD1 3.13Å; R45-D68 IonicContact CZ-OD1 2.83Å; R45-D68 IonicContact CZ-OD2 3.21Å; R45-D68 IonicContact NH1-OD1 2.92Å; R45-D68 IonicContact NH1-OD2 3.76Å; R45-D68 PolarHBondContact NH1-OD2 2.83Å; R45-D68 IonicContact NH2-OD1 3.75Å; R45-D68 PolarHBondContact NH2-OD1 2.87Å; R45-D68 IonicContact NH2-OD2 2.67Å; R45-D68 PolarHBondContact NH2-OD2 2.95Å; F46-D68 HydrophobicContact CZ-CB 4.28Å; L64-D68 HydrophobicContact CD2-CB 3.68Å; R65-D68 PolarHBondContact N-OD2 3Å; R65-D68 WeakPolarHBondContact O-CB 3.45Å; R65-D68 PolarHBondContact O-N 2.63Å; V66-D68 PolarHBondContact O-N 2.81Å; D68-A70 PolarHBondContact O-N 3.36Å; D68-A70 VanDerWaalsContact O-N 3.14Å; D68-Y72 VanDerWaalsContact O-CE2 3.31Å; D68-Y72 WeakPolarHBondContact O-CE2 3.41Å; D68-Y72 PolarHBondContact O-OH 2.96Å
69	T	97.4	Very high	89.6	Confident	35 Å²	35	55.3 Å²	55.3	22%	0.215	27%	0.272	C	S	.	.			trans	-64.1	112	177.3	-64.2	0	0	0	0	110.6	V66 E67 V96 T97 V98	V66-T69 VanDerWaalsContact O-CB 3.27Å; V66-T69 WeakPolarHBondContact O-CB 3.45Å; V66-T69 PolarHBondContact O-N 3.29Å; V66-T69 VanDerWaalsContact O-N 3.08Å; V66-T69 PolarHBondContact O-OG1 2.93Å; E67-T69 VanDerWaalsContact C-N 3.3Å; T69-V96 WeakPolarHBondContact CA-O 3.16Å; T69-T97 HydrophobicContact CG2-CG2 4.35Å; T69-V98 PolarHBondContact OG1-N 2.96Å; T69-V98 PolarHBondContact OG1-O 2.91Å
70	A	97.1	Very high	87.9	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.033	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	168.7	-174.7	0	0	0	0	0	111.2	R16 Q17 A18 D68 Y72 V96	R16-A70 HydrophobicContact CB-CB 3.89Å; R16-A70 HydrophobicContact CG-CB 4.26Å; Q17-A70 WeakPolarHBondContact O-CA 3.4Å; Q17-A70 WeakPolarHBondContact O-CB 3.08Å; A18-A70 HydrophobicContact CB-CB 4.38Å; D68-A70 PolarHBondContact O-N 3.36Å; D68-A70 VanDerWaalsContact O-N 3.14Å; A70-Y72 HydrophobicContact CB-CD2 4.31Å; A70-Y72 HydrophobicContact CB-CE2 3.81Å; A70-Y72 WeakPolarHBondContact O-CD2 3.5Å; A70-V96 PolarHBondContact N-O 2.97Å; A70-V96 VanDerWaalsContact N-O 3.08Å; A70-V96 PolarHBondContact O-N 3.34Å
71	V	96.4	Very high	85.8	Confident	37 Å²	37	60.5 Å²	60.5	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.5	162	-170.4	0	0	0	0	108.5	R16 Q17 Y73	R16-V71 CarbonylContact C-O 3.58Å; R16-V71 VanDerWaalsContact CA-O 3.23Å; R16-V71 WeakPolarHBondContact CA-O 2.97Å; Q17-V71 PolarHBondContact N-O 3.1Å; Q17-V71 PolarHBondContact O-N 2.89Å; V71-Y73 HydrophobicContact CB-CE2 3.82Å; V71-Y73 HydrophobicContact CG1-CD2 4.45Å; V71-Y73 HydrophobicContact CG1-CE1 3.86Å; V71-Y73 HydrophobicContact CG1-CE2 3.71Å; V71-Y73 WeakPolarHBondContact CG1-OH 3.2Å; V71-Y73 WeakPolarHBondContact O-CE2 3.49Å
72	Y	94.6	Very high	83.6	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.016	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.4	-179.6	-72.8	-101	0	0	0	110.3	V15 R16 V26 F46 L59 M61 D68 A70 G93 T94 V96	V15-Y72 CarbonylContact O-C 3.49Å; V15-Y72 WeakPolarHBondContact O-CA 3.2Å; R16-Y72 HydrophobicContact CB-CD1 3.8Å; R16-Y72 HydrophobicContact CB-CD2 4.48Å; R16-Y72 HydrophobicContact CB-CE1 3.72Å; R16-Y72 HydrophobicContact CB-CE2 4.39Å; R16-Y72 HydrophobicContact CB-CG 4.19Å; R16-Y72 WeakPolarHBondContact CD-OH 2.78Å; R16-Y72 HydrophobicContact CG-CE1 4.38Å; R16-Y72 PolarHBondContact NH1-OH 3.32Å; V26-Y72 HydrophobicContact CG1-CE1 4.42Å; V26-Y72 HydrophobicContact CG2-CD1 4.33Å; V26-Y72 HydrophobicContact CG2-CE1 4.01Å; F46-Y72 HydrophobicContact CE2-CE1 4.22Å; L59-Y72 HydrophobicContact CD2-CD1 4.19Å; L59-Y72 HydrophobicContact CD2-CE1 4.49Å; M61-Y72 HydrophobicContact CE-CD1 3.46Å; M61-Y72 VanDerWaalsContact CE-CD1 3.46Å; M61-Y72 HydrophobicContact CE-CD2 4.13Å; M61-Y72 HydrophobicContact CE-CE1 3.51Å; M61-Y72 HydrophobicContact CE-CE2 4.18Å; M61-Y72 HydrophobicContact CE-CG 3.79Å; D68-Y72 VanDerWaalsContact O-CE2 3.31Å; D68-Y72 WeakPolarHBondContact O-CE2 3.41Å; D68-Y72 PolarHBondContact O-OH 2.96Å; A70-Y72 HydrophobicContact CB-CD2 4.31Å; A70-Y72 HydrophobicContact CB-CE2 3.81Å; A70-Y72 WeakPolarHBondContact O-CD2 3.5Å; Y72-G93 CarbonylContact O-C 3.52Å; Y72-G93 WeakPolarHBondContact O-CA 3.35Å; Y72-T94 PolarHBondContact N-O 2.91Å; Y72-T94 PolarHBondContact O-N 3Å; Y72-V96 HydrophobicContact CD2-CB 3.89Å; Y72-V96 HydrophobicContact CD2-CG2 3.66Å; Y72-V96 HydrophobicContact CE2-CB 3.79Å; Y72-V96 HydrophobicContact CE2-CG2 3.99Å
73	Y	91.3	Very high	81.4	Confident	45 Å²	45	65.3 Å²	65.3	18%	0.176	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.2	-180	-51.2	-94.4	0	0	0	110.3	W14 V15 Q17 L23 V71 V89	W14-Y73 WeakPolarHBondContact CA-O 3.27Å; V15-Y73 HydrophobicContact CG2-CD2 4.26Å; V15-Y73 HydrophobicContact CG2-CG 4.43Å; V15-Y73 PolarHBondContact N-O 2.82Å; V15-Y73 PolarHBondContact O-N 3.33Å; Q17-Y73 HydrophobicContact CB-CE2 4Å; L23-Y73 HydrophobicContact CD2-CD2 4.2Å; L23-Y73 HydrophobicContact CD2-CE2 4.23Å; V71-Y73 HydrophobicContact CB-CE2 3.82Å; V71-Y73 HydrophobicContact CG1-CD2 4.45Å; V71-Y73 HydrophobicContact CG1-CE1 3.86Å; V71-Y73 HydrophobicContact CG1-CE2 3.71Å; V71-Y73 WeakPolarHBondContact CG1-OH 3.2Å; V71-Y73 WeakPolarHBondContact O-CE2 3.49Å; Y73-V89 HydrophobicContact CD1-CG1 4.2Å
74	C	87.8	Confident	79.2	Confident	15 Å²	15	66.7 Å²	66.7	10%	0.101	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125	166.1	-176.6	0	0	0	0	108.7	W14 W90 A91	W14-C74 HydrophobicContact CE3-CB 4.3Å; W14-C74 HydrophobicContact CH2-CB 4.01Å; W14-C74 HydrophobicContact CZ2-CB 4.28Å; W14-C74 HydrophobicContact CZ3-CB 4.01Å; C74-W90 PolarHBondContact O-N 3.29Å; C74-A91 HydrophobicContact CB-CB 4.08Å; C74-A91 PolarHBondContact O-N 2.98Å
75	A	84.4	Confident	77.2	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.017	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.7	179.5	0	0	0	0	0	110.6	N13 M87	N13-A75 HydrophobicContact CB-CB 4.31Å; N13-A75 WeakPolarHBondContact CB-O 3.37Å; N13-A75 PolarHBondContact N-O 2.9Å; N13-A75 PolarHBondContact O-N 2.96Å; A75-M87 HydrophobicContact CB-SD 4.17Å
76	R	78.3	Confident	75.3	Confident	63 Å²	63	70.1 Å²	70.1	24%	0.238	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.5	172.5	66.7	179	179.2	-180	-2.5	110.4	Y10 S11 D88	Y10-R76 HydrophobicContact CD1-CB 4.26Å; Y10-R76 HydrophobicContact CD1-CG 4.37Å; S11-R76 CarbonylContact O-C 3.57Å; S11-R76 WeakPolarHBondContact O-CA 3.42Å; R76-D88 HydrophobicContact CG-CB 3.86Å; R76-D88 IonicContact CZ-OD2 2.68Å; R76-D88 PolarHBondContact N-O 2.78Å; R76-D88 IonicContact NE-OD2 3.22Å; R76-D88 PolarHBondContact NE-OD2 3.19Å; R76-D88 IonicContact NH2-OD2 3.7Å; R76-D88 PolarHBondContact NH2-OD2 2.88Å; R76-D88 PolarHBondContact O-N 2.95Å
77	G	73.1	Confident	73.6	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133	168.4	0	0	0	0	0	109.8	Y10 S11 N13	Y10-G77 CarbonylContact C-O 3.47Å; Y10-G77 VanDerWaalsContact CA-O 3.28Å; Y10-G77 WeakPolarHBondContact CA-O 3.43Å; S11-G77 PolarHBondContact N-O 3.3Å; S11-G77 PolarHBondContact O-N 2.84Å; S11-G77 PolarHBondContact OG-O 3.36Å; N13-G77 PolarHBondContact ND2-N 3.2Å
78	R	65.9	Low	72.2	Confident	160 Å²	160	67.6 Å²	67.6	60%	0.604	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.9	169.1	-82.9	-173.8	176	-176.6	4.1	109.4	Y10 T80	Y10-R78 HydrophobicContact CD1-CG 3.92Å; Y10-R78 HydrophobicContact CE1-CB 4.39Å; Y10-R78 HydrophobicContact CE1-CG 3.3Å; Y10-R78 PolarHBondContact OH-NE 2.97Å; R78-T80 PolarHBondContact O-N 3.13Å
79	I	61.1	Low	70.5	Confident	74 Å²	74	71.1 Å²	71.1	38%	0.379	39%	0.386	S	S	.	.			trans	-85.3	86.8	169.6	-52.6	171.8	0	0	0	106.7	N9 S30	N9-I79 PolarHBondContact O-N 2.87Å; N9-I79 VanDerWaalsContact O-N 3.15Å; S30-I79 VanDerWaalsContact OG-CD1 3.29Å; S30-I79 WeakPolarHBondContact OG-CD1 3.47Å
80	T	56.6	Low	69	Low	84 Å²	84	76.6 Å²	76.6	52%	0.515	40%	0.403	S	S	.	.			trans	-102.1	132.6	168.4	43.9	0	0	0	0	109.4	R78 G82	R78-T80 PolarHBondContact O-N 3.13Å; T80-G82 PolarHBondContact O-N 2.84Å
81	T	51.7	Low	67.7	Low	156 Å²	156	78.4 Å²	78.4	96%	0.957	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	95.8	172.4	49.6	0	0	0	0	109.9
82	G	50.5	Low	67	Low	69 Å²	69	86.8 Å²	86.8	71%	0.711	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.4	1.3	159.3	0	0	0	0	0	119.6	T80	T80-G82 PolarHBondContact O-N 2.84Å
83	L	49.1	Very low	66.7	Low	145 Å²	145	87.7 Å²	87.7	76%	0.759	46%	0.461	S	S	*	.	S	Bend	trans	-141.2	148.5	174.4	-72.8	172.4	0	0	0	113
84	T	49	Very low	66.8	Low	124 Å²	124	90.1 Å²	90.1	76%	0.761	48%	0.481	S	S	*	.			trans	-29.9	135.5	-175.4	24.9	0	0	0	0	115.7	Y86	T84-Y86 PolarHBondContact O-N 3.03Å
85	P	53.6	Low	67.2	Low	86 Å²	86	94.1 Å²	94.1	56%	0.558	51%	0.505	S	S	*	.			trans	-68.5	100	-179.6	28.2	-32.3	0	0	0	109.7	M87	P85-M87 PolarHBondContact O-N 3.44Å; P85-M87 VanDerWaalsContact O-N 3.1Å
86	Y	55.8	Low	67.7	Low	191 Å²	191	95.5 Å²	95.5	75%	0.749	51%	0.513	S	S	*	.			trans	-62.7	111.1	163.4	-172.7	-94.5	0	0	0	107.5	T84	T84-Y86 PolarHBondContact O-N 3.03Å
87	M	61.4	Low	68.6	Low	68 Å²	68	97.7 Å²	97.7	34%	0.335	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	119.6	174.6	-78.9	-151.7	-98.6	0	0	109.5	V15 W25 A75 P85	V15-M87 HydrophobicContact CG1-SD 4.24Å; W25-M87 HydrophobicContact CH2-CE 3.4Å; W25-M87 HydrophobicContact CH2-CG 4.02Å; W25-M87 HydrophobicContact CH2-SD 3.2Å; W25-M87 WeakPolarHBondContact CH2-SD 3.32Å; W25-M87 HydrophobicContact CZ2-CE 2.99Å; W25-M87 HydrophobicContact CZ2-CG 4.39Å; W25-M87 HydrophobicContact CZ2-SD 3.55Å; W25-M87 VanDerWaalsContact CZ2-SD 3.55Å; W25-M87 HydrophobicContact CZ3-CE 4.3Å; W25-M87 HydrophobicContact CZ3-SD 3.87Å; A75-M87 HydrophobicContact CB-SD 4.17Å; P85-M87 PolarHBondContact O-N 3.44Å; P85-M87 VanDerWaalsContact O-N 3.1Å
88	D	64.8	Low	69.6	Low	57 Å²	57	99 Å²	99	31%	0.305	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	103.9	169	-173.1	10.6	0	0	0	107.5	R76 W90	R76-D88 HydrophobicContact CG-CB 3.86Å; R76-D88 IonicContact CZ-OD2 2.68Å; R76-D88 PolarHBondContact N-O 2.78Å; R76-D88 IonicContact NE-OD2 3.22Å; R76-D88 PolarHBondContact NE-OD2 3.19Å; R76-D88 IonicContact NH2-OD2 3.7Å; R76-D88 PolarHBondContact NH2-OD2 2.88Å; R76-D88 PolarHBondContact O-N 2.95Å; D88-W90 PolarHBondContact O-N 3.36Å
89	V	61.7	Low	70.8	Confident	75 Å²	75	96.4 Å²	96.4	46%	0.455	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	100.2	177.6	-178.9	0	0	0	0	107.3	Y73	Y73-V89 HydrophobicContact CD1-CG1 4.2Å
90	W	65.3	Low	71.8	Confident	150 Å²	150	101.1 Å²	101.1	57%	0.568	59%	0.588	S	S	*	*			trans	-88.8	-21.7	-169.6	-173.4	41.3	0	0	0	112.9	C74 D88	C74-W90 PolarHBondContact O-N 3.29Å; D88-W90 PolarHBondContact O-N 3.36Å
91	A	69.9	Low	72.5	Confident	41 Å²	41	102 Å²	102	34%	0.339	59%	0.591	S	S	.	*	S	Bend	trans	-110.2	146.8	-177.3	0	0	0	0	0	112.5	C74 G93	C74-A91 HydrophobicContact CB-CB 4.08Å; C74-A91 PolarHBondContact O-N 2.98Å; A91-G93 PolarHBondContact O-N 3.2Å
92	K	80.7	Confident	73.6	Confident	214 Å²	214	99.2 Å²	99.2	93%	0.93	57%	0.572	S	S	*	*			trans	-61.7	-7.7	176	-73.7	-169.3	174	-173.3	0	114.6
93	G	88.2	Confident	74.9	Confident	22 Å²	22	100.8 Å²	100.8	23%	0.227	56%	0.564	C	S	.	*			trans	80.7	155.5	-173.9	0	0	0	0	0	112.6	Y72 A91	Y72-G93 CarbonylContact O-C 3.52Å; Y72-G93 WeakPolarHBondContact O-CA 3.35Å; A91-G93 PolarHBondContact O-N 3.2Å
94	T	93.4	Very high	76.4	Confident	97 Å²	97	98.2 Å²	98.2	60%	0.595	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-129.6	125.8	176.5	-62.7	0	0	0	0	109.2	Y72	Y72-T94 PolarHBondContact N-O 2.91Å; Y72-T94 PolarHBondContact O-N 3Å
95	T	96	Very high	78.1	Confident	98 Å²	98	96.6 Å²	96.6	60%	0.601	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	126.4	174.9	-53.3	0	0	0	0	110.3
96	V	95.9	Very high	79.8	Confident	32 Å²	32	97.3 Å²	97.3	19%	0.194	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.4	169.6	178.2	0	0	0	0	107.6	M61 L64 T69 A70 Y72 V98	M61-V96 HydrophobicContact CE-CG2 4.44Å; M61-V96 HydrophobicContact SD-CG2 4.4Å; L64-V96 HydrophobicContact CD1-CG1 4.5Å; T69-V96 WeakPolarHBondContact CA-O 3.16Å; A70-V96 PolarHBondContact N-O 2.97Å; A70-V96 VanDerWaalsContact N-O 3.08Å; A70-V96 PolarHBondContact O-N 3.34Å; Y72-V96 HydrophobicContact CD2-CB 3.89Å; Y72-V96 HydrophobicContact CD2-CG2 3.66Å; Y72-V96 HydrophobicContact CE2-CB 3.79Å; Y72-V96 HydrophobicContact CE2-CG2 3.99Å; V96-V98 HydrophobicContact CG1-CG2 4.36Å
97	T	96.4	Very high	81.5	Confident	109 Å²	109	90.6 Å²	90.6	67%	0.669	52%	0.524	S	S	*	.			trans	-118	129	178	-55.1	0	0	0	0	109.4	T69	T69-T97 HydrophobicContact CG2-CG2 4.35Å
98	V	94.8	Very high	83	Confident	27 Å²	27	92.4 Å²	92.4	16%	0.164	54%	0.538	C	S	.	.			trans	-120.7	117.3	177.6	-173.7	0	0	0	0	108.1	L64 R65 T69 V96	L64-V98 HydrophobicContact CB-CG1 4.35Å; L64-V98 HydrophobicContact CB-CG2 3.96Å; L64-V98 HydrophobicContact CD1-CG2 4.19Å; L64-V98 HydrophobicContact CD2-CG2 4.21Å; L64-V98 HydrophobicContact CG-CG2 4.36Å; R65-V98 WeakPolarHBondContact O-CB 3.41Å; T69-V98 PolarHBondContact OG1-N 2.96Å; T69-V98 PolarHBondContact OG1-O 2.91Å; V96-V98 HydrophobicContact CG1-CG2 4.36Å
99	S	91.4	Very high	84.5	Confident	105 Å²	105	95.3 Å²	95.3	73%	0.734	56%	0.558	S	S	*	*			trans	-105.3	151.7	173.4	56.2	0	0	0	0	110.6
100	S	80.9	Confident	86.6	Confident	174 Å²	174	97.2 Å²	97.2	100%	1.217	57%	0.567	S	S	*	*			trans	-71.6	0	172	58.8	0	0	0	0	112.7

Retrieved 100 of 100 residues in 111.6 ms (Link to these results)

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