C4Q352_SCHMA Loading...

Pak inhibitor skb15, putative

Negatively regulates the PAK1 kinase. PAK1 is a member of the PAK kinase family, which has been shown to play a positive role in the regulation of signaling pathways involving MAPK8 and RELA. PAK1 exists as an inactive homodimer, which is activated by binding of small GTPases such as CDC42 to an N-terminal regulatory domain. PAK1IP1 also binds to the N-terminus of PAK1, and inhibits the specific activation of PAK1 by CDC42. May be involved in ribosomal large subunit assembly.

AlphaFold DB , UniProt , Accession C4Q352, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 395 aa.

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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	M	76	Confident	94.6	Very high	92 Å²	92	26.8 Å²	26.8	45%	0.453	12%	0.117	S	C	.	.				0	137.3	0	-175.4	-163.6	-145.2	0	0	108.2	P21 H23 T387	M1-P21 HydrophobicContact CE-CB 3.78Å; M1-P21 HydrophobicContact SD-CB 4.18Å; M1-H23 WeakPolarHBondContact CE-CE1 3.32Å; M1-H23 WeakPolarHBondContact CE-NE2 3.34Å; M1-T387 WeakPolarHBondContact CB-OG1 3.15Å; M1-T387 PolarHBondContact N-O 3.45Å; M1-T387 VanDerWaalsContact N-O 3.14Å; M1-T387 PolarHBondContact N-OG1 3.06Å; M1-T387 PolarHBondContact O-N 2.87Å; M1-T387 PolarHBondContact O-OG1 3.14Å
2	F	88.5	Confident	94.8	Very high	51 Å²	51	31.4 Å²	31.4	22%	0.224	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	141.5	177	-75.6	-82.3	0	0	0	110.5	H22 P316 Y318 L319 W384 T385	F2-H22 PolarHBondContact O-N 3.43Å; F2-H22 VanDerWaalsContact O-O 3.11Å; F2-P316 HydrophobicContact CD1-CB 4.19Å; F2-P316 HydrophobicContact CD1-CG 3.93Å; F2-P316 HydrophobicContact CE1-CB 3.85Å; F2-P316 HydrophobicContact CE1-CG 4.07Å; F2-P316 HydrophobicContact CZ-CB 4.23Å; F2-Y318 HydrophobicContact CD2-CD1 4Å; F2-Y318 HydrophobicContact CD2-CE1 4.46Å; F2-Y318 AromaticContact CE2-CD1 3.44Å; F2-Y318 HydrophobicContact CE2-CD1 3.44Å; F2-Y318 VanDerWaalsContact CE2-CD1 3.44Å; F2-Y318 HydrophobicContact CE2-CE1 4.11Å; F2-Y318 AromaticContact CE2-CG 3.95Å; F2-Y318 HydrophobicContact CE2-CG 3.95Å; F2-Y318 HydrophobicContact CZ-CD1 4.42Å; F2-L319 HydrophobicContact CB-CD1 4.14Å; F2-L319 HydrophobicContact CD2-CD1 4.43Å; F2-L319 HydrophobicContact CD2-CG 4.28Å; F2-L319 HydrophobicContact CG-CD1 4.27Å; F2-W384 HydrophobicContact CB-CE3 4.1Å; F2-W384 HydrophobicContact CB-CZ3 4Å; F2-T385 WeakPolarHBondContact CA-O 3.2Å
3	S	93.4	Very high	95.1	Very high	1 Å²	1	29 Å²	29	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	147	175.5	44.5	0	0	0	0	111.5	K19 Y20 T385	S3-K19 WeakPolarHBondContact OG-CE 3.06Å; S3-Y20 CarbonylContact C-O 3.51Å; S3-Y20 WeakPolarHBondContact CA-O 3.44Å; S3-Y20 VanDerWaalsContact CB-O 3.25Å; S3-Y20 WeakPolarHBondContact CB-O 3.26Å; S3-T385 PolarHBondContact N-O 3.36Å; S3-T385 PolarHBondContact O-N 2.89Å; S3-T385 PolarHBondContact O-OG1 3.23Å; S3-T385 PolarHBondContact OG-OG1 2.79Å
4	V	95.9	Very high	95.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	124.1	169.1	-171	0	0	0	0	107.4	V6 K19 Y20 L313 L332 F368 A382 I383 W384	V4-V6 HydrophobicContact CG1-CG2 3.83Å; V4-K19 WeakPolarHBondContact O-CA 3.21Å; V4-Y20 HydrophobicContact CB-CD1 4.47Å; V4-Y20 HydrophobicContact CG2-CD1 4.01Å; V4-Y20 PolarHBondContact N-O 3.39Å; V4-Y20 PolarHBondContact O-N 2.71Å; V4-L313 HydrophobicContact CG1-CD1 4.21Å; V4-L332 HydrophobicContact CB-CD2 4.38Å; V4-L332 HydrophobicContact CG1-CD2 4.06Å; V4-L332 HydrophobicContact CG2-CD2 3.41Å; V4-L332 VanDerWaalsContact CG2-CD2 3.41Å; V4-F368 HydrophobicContact CG1-CZ 4.46Å; V4-F368 HydrophobicContact CG2-CE1 4.43Å; V4-A382 HydrophobicContact CG1-CB 4.44Å; V4-I383 WeakPolarHBondContact CA-O 3.14Å; V4-W384 HydrophobicContact CG2-CD2 4.14Å; V4-W384 HydrophobicContact CG2-CE3 3.92Å; V4-W384 HydrophobicContact CG2-CH2 3.7Å; V4-W384 HydrophobicContact CG2-CZ2 3.92Å; V4-W384 HydrophobicContact CG2-CZ3 3.69Å
5	L	97.1	Very high	95.5	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124	168.7	174.6	64.3	0	0	0	107.3	A17 I36 T52 V71 A382 I383 T385	L5-A17 HydrophobicContact CD1-CB 4.04Å; L5-I36 HydrophobicContact CD1-CD1 3.35Å; L5-T52 HydrophobicContact CD2-CG2 3.4Å; L5-T52 VanDerWaalsContact CD2-CG2 3.4Å; L5-T52 HydrophobicContact CG-CG2 4.07Å; L5-V71 HydrophobicContact CD1-CG1 4.15Å; L5-V71 HydrophobicContact CD1-CG2 4.31Å; L5-V71 HydrophobicContact CD2-CG1 4.34Å; L5-V71 HydrophobicContact CD2-CG2 3.73Å; L5-A382 CarbonylContact O-C 3.29Å; L5-A382 VanDerWaalsContact O-CA 3.25Å; L5-A382 WeakPolarHBondContact O-CA 3.19Å; L5-I383 HydrophobicContact CB-CG1 4.07Å; L5-I383 HydrophobicContact CD2-CD1 4.34Å; L5-I383 HydrophobicContact CD2-CG1 4.33Å; L5-I383 PolarHBondContact N-O 3.15Å; L5-I383 PolarHBondContact O-N 2.96Å; L5-T385 HydrophobicContact CB-CG2 3.74Å; L5-T385 HydrophobicContact CD2-CG2 4.14Å
6	V	98.2	Very high	95.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	119.4	178.1	-172.3	0	0	0	0	108.4	V4 A17 L18 V334 L345 F368 L380 A381 A382	V4-V6 HydrophobicContact CG1-CG2 3.83Å; V6-A17 CarbonylContact O-C 3.6Å; V6-A17 WeakPolarHBondContact O-CA 3.17Å; V6-L18 PolarHBondContact N-O 2.85Å; V6-L18 PolarHBondContact O-N 3.33Å; V6-V334 HydrophobicContact CG1-CG1 4.42Å; V6-L345 HydrophobicContact CB-CD1 4.46Å; V6-L345 HydrophobicContact CG1-CD1 3.52Å; V6-L345 HydrophobicContact CG1-CD2 4.35Å; V6-L345 HydrophobicContact CG1-CG 4.42Å; V6-F368 HydrophobicContact CG2-CE2 4.46Å; V6-F368 HydrophobicContact CG2-CZ 4.41Å; V6-L380 HydrophobicContact CG1-CD1 3.4Å; V6-L380 VanDerWaalsContact CG1-CD1 3.4Å; V6-A381 CarbonylContact C-O 3.52Å; V6-A381 WeakPolarHBondContact CA-O 3.32Å; V6-A382 HydrophobicContact CG1-CB 4.47Å; V6-A382 HydrophobicContact CG2-CB 4.14Å
7	S	98.4	Very high	95.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	145.4	175.2	67.7	0	0	0	0	110.3	F16 I50 T52 A381	S7-F16 WeakPolarHBondContact CA-O 3.42Å; S7-I50 WeakPolarHBondContact OG-CD1 3.01Å; S7-T52 PolarHBondContact OG-OG1 2.85Å; S7-A381 PolarHBondContact N-O 3.44Å; S7-A381 PolarHBondContact O-N 3.37Å
8	C	98.7	Very high	95.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	147.1	-178.9	-68.3	0	0	0	0	110.1	V15 F16 I377 T379 L380	C8-V15 WeakPolarHBondContact O-CA 3.4Å; C8-F16 HydrophobicContact CB-CD1 4.26Å; C8-F16 HydrophobicContact CB-CD2 4.21Å; C8-F16 HydrophobicContact CB-CE1 3.66Å; C8-F16 HydrophobicContact CB-CE2 3.59Å; C8-F16 HydrophobicContact CB-CZ 3.29Å; C8-F16 PolarHBondContact N-O 2.64Å; C8-F16 PolarHBondContact O-N 3.27Å; C8-I377 HydrophobicContact CB-CD1 4.43Å; C8-I377 HydrophobicContact CB-CG1 4.48Å; C8-I377 HydrophobicContact CB-CG2 4.17Å; C8-T379 WeakPolarHBondContact CA-O 3.35Å; C8-L380 VanDerWaalsContact SG-CD1 3.56Å
9	G	98.6	Very high	95.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	153.8	164.6	0	0	0	0	0	109.7	S14 I377 T378 T379	G9-S14 WeakPolarHBondContact CA-O 3.23Å; G9-I377 WeakPolarHBondContact O-CA 3.36Å; G9-T378 PolarHBondContact O-N 2.99Å; G9-T378 PolarHBondContact O-OG1 3.4Å; G9-T378 VanDerWaalsContact O-OG1 3.11Å; G9-T379 PolarHBondContact N-O 2.84Å; G9-T379 VanDerWaalsContact N-O 3.15Å; G9-T379 PolarHBondContact O-N 3.37Å
10	T	98.5	Very high	95.9	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	166.7	-176	58.4	0	0	0	0	112.4	D12 G13 S14 F16 V47 T375 R376 T378	T10-D12 VanDerWaalsContact C-N 3.29Å; T10-D12 WeakPolarHBondContact CB-OD1 3.43Å; T10-D12 PolarHBondContact O-N 3.45Å; T10-D12 PolarHBondContact OG1-OD1 2.78Å; T10-G13 PolarHBondContact O-N 3.49Å; T10-S14 PolarHBondContact N-O 3.34Å; T10-S14 WeakPolarHBondContact OG1-CA 3.25Å; T10-S14 WeakPolarHBondContact OG1-CB 3.29Å; T10-S14 PolarHBondContact OG1-N 2.99Å; T10-S14 PolarHBondContact OG1-O 2.84Å; T10-S14 VanDerWaalsContact OG1-O 3.04Å; T10-F16 HydrophobicContact CG2-CD1 4.3Å; T10-F16 HydrophobicContact CG2-CE1 3.69Å; T10-V47 PolarHBondContact O-N 3.06Å; T10-T375 HydrophobicContact CG2-CG2 3.5Å; T10-R376 CarbonylContact C-O 3.41Å; T10-R376 VanDerWaalsContact CA-O 3.3Å; T10-R376 WeakPolarHBondContact CA-O 3.46Å; T10-T378 WeakPolarHBondContact CA-OG1 3.46Å; T10-T378 PolarHBondContact N-OG1 2.77Å; T10-T378 PolarHBondContact O-OG1 2.82Å
11	Y	97.3	Very high	95.7	Very high	147 Å²	147	24.4 Å²	24.4	58%	0.576	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.3	178.6	-173.5	-97.1	0	0	0	113.4	G13 P46 R376 T378	Y11-G13 PolarHBondContact O-N 3.37Å; Y11-P46 HydrophobicContact CD2-CB 4.06Å; Y11-P46 HydrophobicContact CD2-CG 3.96Å; Y11-P46 HydrophobicContact CE2-CB 4.39Å; Y11-P46 HydrophobicContact CE2-CG 3.88Å; Y11-P46 HydrophobicContact CG-CG 4.44Å; Y11-P46 VanDerWaalsContact O-CA 3.27Å; Y11-P46 WeakPolarHBondContact O-CA 3.28Å; Y11-P46 WeakPolarHBondContact O-CB 3.38Å; Y11-P46 VanDerWaalsContact O-CG 3.25Å; Y11-P46 WeakPolarHBondContact O-CG 3.42Å; Y11-R376 PolarHBondContact N-O 2.79Å; Y11-T378 HydrophobicContact CD2-CG2 4.21Å
12	D	97	Very high	96.4	Very high	82 Å²	82	20.1 Å²	20.1	44%	0.439	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	2.9	176.9	60.3	10.5	0	0	0	113.6	T10 S14	T10-D12 VanDerWaalsContact C-N 3.29Å; T10-D12 WeakPolarHBondContact CB-OD1 3.43Å; T10-D12 PolarHBondContact O-N 3.45Å; T10-D12 PolarHBondContact OG1-OD1 2.78Å; D12-S14 WeakPolarHBondContact OD1-CB 3.49Å; D12-S14 PolarHBondContact OD1-N 2.9Å; D12-S14 PolarHBondContact OD1-OG 2.72Å
13	G	98.3	Very high	96.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	91	1.8	177.3	0	0	0	0	0	115	T10 Y11 A42 H43 A45	T10-G13 PolarHBondContact O-N 3.49Å; Y11-G13 PolarHBondContact O-N 3.37Å; G13-A42 WeakPolarHBondContact O-CB 3.45Å; G13-H43 WeakPolarHBondContact CA-O 3.25Å; G13-H43 PolarHBondContact O-N 2.99Å; G13-A45 WeakPolarHBondContact CA-O 3.38Å
14	S	98.4	Very high	95.8	Very high	14 Å²	14	27.3 Å²	27.3	10%	0.098	13%	0.134	C	C	.	.			trans	-69.1	146	174.7	-46.4	0	0	0	0	112.5	G9 T10 D12 D39 P40	G9-S14 WeakPolarHBondContact CA-O 3.23Å; T10-S14 PolarHBondContact N-O 3.34Å; T10-S14 WeakPolarHBondContact OG1-CA 3.25Å; T10-S14 WeakPolarHBondContact OG1-CB 3.29Å; T10-S14 PolarHBondContact OG1-N 2.99Å; T10-S14 PolarHBondContact OG1-O 2.84Å; T10-S14 VanDerWaalsContact OG1-O 3.04Å; D12-S14 WeakPolarHBondContact OD1-CB 3.49Å; D12-S14 PolarHBondContact OD1-N 2.9Å; D12-S14 PolarHBondContact OD1-OG 2.72Å; S14-D39 VanDerWaalsContact CA-O 3.32Å; S14-D39 WeakPolarHBondContact CA-O 3.35Å; S14-P40 WeakPolarHBondContact OG-CA 3.27Å
15	V	98.7	Very high	95.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.5	171.8	179	0	0	0	0	109.1	C8 F37 D39 A42 V47 I50 V57 S59 F69	C8-V15 WeakPolarHBondContact O-CA 3.4Å; V15-F37 HydrophobicContact CG1-CE2 4.17Å; V15-D39 PolarHBondContact N-O 2.7Å; V15-D39 PolarHBondContact O-N 2.85Å; V15-A42 HydrophobicContact CB-CB 3.79Å; V15-A42 HydrophobicContact CG2-CB 3.56Å; V15-V47 HydrophobicContact CG2-CG1 4.42Å; V15-V47 HydrophobicContact CG2-CG2 3.85Å; V15-I50 HydrophobicContact CG1-CD1 4.03Å; V15-V57 HydrophobicContact CG1-CG1 4.43Å; V15-S59 WeakPolarHBondContact CG2-OG 3.11Å; V15-F69 HydrophobicContact CB-CE1 4.33Å; V15-F69 HydrophobicContact CB-CE2 4.2Å; V15-F69 HydrophobicContact CB-CZ 3.87Å; V15-F69 HydrophobicContact CG1-CD2 4.24Å; V15-F69 HydrophobicContact CG1-CE1 4.45Å; V15-F69 HydrophobicContact CG1-CE2 3.9Å; V15-F69 HydrophobicContact CG1-CZ 4.02Å; V15-F69 HydrophobicContact CG2-CE2 4.25Å; V15-F69 HydrophobicContact CG2-CZ 4.07Å
16	F	98.2	Very high	94.7	Very high	10 Å²	10	30.8 Å²	30.8	4%	0.044	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	156.3	177.4	62.2	-90.7	0	0	0	112.1	S7 C8 T10 L18 F37 I38 V372 I377	S7-F16 WeakPolarHBondContact CA-O 3.42Å; C8-F16 HydrophobicContact CB-CD1 4.26Å; C8-F16 HydrophobicContact CB-CD2 4.21Å; C8-F16 HydrophobicContact CB-CE1 3.66Å; C8-F16 HydrophobicContact CB-CE2 3.59Å; C8-F16 HydrophobicContact CB-CZ 3.29Å; C8-F16 PolarHBondContact N-O 2.64Å; C8-F16 PolarHBondContact O-N 3.27Å; T10-F16 HydrophobicContact CG2-CD1 4.3Å; T10-F16 HydrophobicContact CG2-CE1 3.69Å; F16-L18 HydrophobicContact CD2-CD1 4.25Å; F16-L18 HydrophobicContact CD2-CD2 3.95Å; F16-L18 HydrophobicContact CD2-CG 3.86Å; F16-L18 HydrophobicContact CE2-CD1 3.91Å; F16-L18 HydrophobicContact CE2-CD2 4.39Å; F16-L18 HydrophobicContact CE2-CG 4.03Å; F16-F37 WeakPolarHBondContact CA-O 3.41Å; F16-F37 WeakPolarHBondContact CB-O 3.33Å; F16-I38 HydrophobicContact CB-CB 4.15Å; F16-I38 HydrophobicContact CB-CG1 3.79Å; F16-I38 HydrophobicContact CB-CG2 4.23Å; F16-V372 HydrophobicContact CE2-CG2 4.46Å; F16-V372 HydrophobicContact CZ-CG2 3.84Å; F16-I377 HydrophobicContact CZ-CD1 4.05Å; F16-I377 HydrophobicContact CZ-CG1 4.21Å
17	A	98.2	Very high	93.9	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.8	174.5	0	0	0	0	0	110.7	L5 V6 I36 F37	L5-A17 HydrophobicContact CD1-CB 4.04Å; V6-A17 CarbonylContact O-C 3.6Å; V6-A17 WeakPolarHBondContact O-CA 3.17Å; A17-I36 HydrophobicContact CB-CB 4.48Å; A17-I36 HydrophobicContact CB-CD1 4.46Å; A17-I36 WeakPolarHBondContact O-CB 3.35Å; A17-I36 PolarHBondContact O-N 2.65Å; A17-F37 HydrophobicContact CB-CD1 3.84Å; A17-F37 HydrophobicContact CB-CE1 3.38Å; A17-F37 HydrophobicContact CB-CZ 3.79Å; A17-F37 PolarHBondContact N-O 3.48Å; A17-F37 PolarHBondContact O-N 3.27Å
18	L	97.7	Very high	93.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152.5	-178	-51.4	178.4	0	0	0	109.9	V6 F16 L33 K34 P35 L345 Y370	V6-L18 PolarHBondContact N-O 2.85Å; V6-L18 PolarHBondContact O-N 3.33Å; F16-L18 HydrophobicContact CD2-CD1 4.25Å; F16-L18 HydrophobicContact CD2-CD2 3.95Å; F16-L18 HydrophobicContact CD2-CG 3.86Å; F16-L18 HydrophobicContact CE2-CD1 3.91Å; F16-L18 HydrophobicContact CE2-CD2 4.39Å; F16-L18 HydrophobicContact CE2-CG 4.03Å; L18-L33 HydrophobicContact CB-CB 3.98Å; L18-L33 HydrophobicContact CB-CD1 3.97Å; L18-L33 HydrophobicContact CD1-CB 4.05Å; L18-L33 HydrophobicContact CD1-CD1 3.59Å; L18-L33 HydrophobicContact CD1-CG 4.46Å; L18-L33 HydrophobicContact CG-CD1 4.45Å; L18-K34 CarbonylContact C-O 3.55Å; L18-K34 WeakPolarHBondContact CA-O 3.36Å; L18-P35 HydrophobicContact CD2-CB 3.97Å; L18-P35 HydrophobicContact CD2-CG 4.01Å; L18-L345 HydrophobicContact CD1-CD1 4.25Å; L18-Y370 HydrophobicContact CD1-CD1 3.57Å; L18-Y370 HydrophobicContact CD1-CD2 4.03Å; L18-Y370 HydrophobicContact CD1-CE1 4.08Å; L18-Y370 HydrophobicContact CD1-CE2 4.48Å; L18-Y370 HydrophobicContact CD1-CG 3.53Å; L18-Y370 HydrophobicContact CD2-CD2 4.44Å; L18-Y370 HydrophobicContact CD2-CE1 4.24Å; L18-Y370 HydrophobicContact CD2-CE2 4.15Å
19	K	96.1	Very high	92.3	Very high	64 Å²	64	41.5 Å²	41.5	28%	0.278	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.8	179.9	-164.9	173.4	-175.6	174.5	0	111.7	S3 V4 K34 I36	S3-K19 WeakPolarHBondContact OG-CE 3.06Å; V4-K19 WeakPolarHBondContact O-CA 3.21Å; K19-K34 PolarHBondContact N-O 2.93Å; K19-K34 PolarHBondContact O-N 2.79Å; K19-I36 HydrophobicContact CB-CD1 3.78Å; K19-I36 HydrophobicContact CB-CG1 3.86Å; K19-I36 HydrophobicContact CD-CD1 4.48Å; K19-I36 HydrophobicContact CG-CD1 4.49Å
20	Y	95.2	Very high	92	Very high	5 Å²	5	44.4 Å²	44.4	2%	0.02	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	104.6	164.4	178.6	-120.2	0	0	0	109.8	S3 V4 H22 K31 L33 L367 F368	S3-Y20 CarbonylContact C-O 3.51Å; S3-Y20 WeakPolarHBondContact CA-O 3.44Å; S3-Y20 VanDerWaalsContact CB-O 3.25Å; S3-Y20 WeakPolarHBondContact CB-O 3.26Å; V4-Y20 HydrophobicContact CB-CD1 4.47Å; V4-Y20 HydrophobicContact CG2-CD1 4.01Å; V4-Y20 PolarHBondContact N-O 3.39Å; V4-Y20 PolarHBondContact O-N 2.71Å; Y20-H22 HydrophobicContact CD1-CB 4Å; Y20-H22 HydrophobicContact CE1-CB 3.68Å; Y20-H22 AromaticContact CE1-CG 3.92Å; Y20-H22 AromaticContact CE1-ND1 3.48Å; Y20-H22 WeakPolarHBondContact CE1-ND1 3.12Å; Y20-H22 AromaticContact CZ-ND1 3.93Å; Y20-H22 PolarHBondContact O-N 2.59Å; Y20-K31 HydrophobicContact CE2-CB 4.06Å; Y20-K31 HydrophobicContact CE2-CD 4.25Å; Y20-L33 VanDerWaalsContact CB-CD2 3.47Å; Y20-L33 HydrophobicContact CD2-CD2 4.47Å; Y20-L33 HydrophobicContact CG-CD2 4.32Å; Y20-L367 HydrophobicContact CE1-CB 4.39Å; Y20-L367 HydrophobicContact CE1-CD1 4.49Å; Y20-F368 AromaticContact CD1-CD1 3.47Å; Y20-F368 HydrophobicContact CD1-CD1 3.47Å; Y20-F368 VanDerWaalsContact CD1-CD1 3.47Å; Y20-F368 AromaticContact CD1-CE1 3.86Å; Y20-F368 HydrophobicContact CD1-CE1 3.86Å; Y20-F368 HydrophobicContact CD1-CG 4.47Å; Y20-F368 HydrophobicContact CD2-CB 3.73Å; Y20-F368 AromaticContact CD2-CD1 3.92Å; Y20-F368 HydrophobicContact CD2-CD1 3.92Å; Y20-F368 HydrophobicContact CD2-CG 4.18Å; Y20-F368 AromaticContact CE1-CD1 3.83Å; Y20-F368 HydrophobicContact CE1-CD1 3.83Å; Y20-F368 HydrophobicContact CE1-CE1 4.4Å; Y20-F368 HydrophobicContact CE2-CB 3.99Å; Y20-F368 HydrophobicContact CE2-CD1 4.25Å; Y20-F368 HydrophobicContact CG-CB 4.18Å; Y20-F368 AromaticContact CG-CD1 3.52Å; Y20-F368 HydrophobicContact CG-CD1 3.52Å; Y20-F368 HydrophobicContact CG-CE1 4.14Å; Y20-F368 HydrophobicContact CG-CG 4.1Å
21	P	92.2	Very high	91.8	Very high	42 Å²	42	48.6 Å²	48.6	27%	0.273	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	123	166	-15.1	30	0	0	0	109.4	M1	M1-P21 HydrophobicContact CE-CB 3.78Å; M1-P21 HydrophobicContact SD-CB 4.18Å
22	H	90.5	Very high	91.8	Very high	3 Å²	3	47.4 Å²	47.4	1%	0.014	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.9	178.5	-175.3	72.2	0	0	0	110.3	F2 Y20 T24 W315 W384	F2-H22 PolarHBondContact O-N 3.43Å; F2-H22 VanDerWaalsContact O-O 3.11Å; Y20-H22 HydrophobicContact CD1-CB 4Å; Y20-H22 HydrophobicContact CE1-CB 3.68Å; Y20-H22 AromaticContact CE1-CG 3.92Å; Y20-H22 AromaticContact CE1-ND1 3.48Å; Y20-H22 WeakPolarHBondContact CE1-ND1 3.12Å; Y20-H22 AromaticContact CZ-ND1 3.93Å; Y20-H22 PolarHBondContact O-N 2.59Å; H22-T24 VanDerWaalsContact CE1-C 3.42Å; H22-T24 PolarHBondContact CE1-O 2.91Å; H22-W315 AromaticContact CD2-CZ3 3.96Å; H22-W315 AromaticContact CE1-CZ3 3.95Å; H22-W315 AromaticContact NE2-CZ3 3.58Å; H22-W384 HydrophobicContact CB-CH2 3.9Å; H22-W384 HydrophobicContact CB-CZ3 3.82Å; H22-W384 AromaticContact CD2-CH2 3.89Å; H22-W384 AromaticContact CG-CH2 3.91Å
23	H	84	Confident	91.7	Very high	122 Å²	122	43.5 Å²	43.5	57%	0.565	25%	0.251	S	S	*	.	S	Bend	trans	-125.2	-59.8	179	-68.7	-78.2	0	0	0	110.3	M1	M1-H23 WeakPolarHBondContact CE-CE1 3.32Å; M1-H23 WeakPolarHBondContact CE-NE2 3.34Å
24	T	85.7	Confident	91.6	Very high	80 Å²	80	50.3 Å²	50.3	49%	0.491	28%	0.281	S	S	.	.	S	Bend	trans	-142.5	161.1	177.6	59.1	0	0	0	0	109.1	H22 D26 E323	H22-T24 VanDerWaalsContact CE1-C 3.42Å; H22-T24 PolarHBondContact CE1-O 2.91Å; T24-D26 PolarHBondContact O-N 2.93Å; T24-E323 WeakPolarHBondContact CA-OE1 3.36Å; T24-E323 WeakPolarHBondContact CB-OE1 3.42Å; T24-E323 WeakPolarHBondContact CG2-OE1 3.37Å
25	I	84.7	Confident	91.5	Very high	26 Å²	26	52.9 Å²	52.9	13%	0.133	30%	0.297	C	S	.	.			trans	-72.7	123.8	171.4	-66.6	171.8	0	0	0	109.3	W315 E323 M325 A349 I365 L367	I25-W315 HydrophobicContact CD1-CH2 4.15Å; I25-W315 HydrophobicContact CD1-CZ2 4.15Å; I25-W315 HydrophobicContact CG1-CH2 4.33Å; I25-E323 WeakPolarHBondContact CG1-OE2 3.49Å; I25-E323 PolarHBondContact N-OE1 2.83Å; I25-M325 HydrophobicContact CB-SD 4.02Å; I25-M325 HydrophobicContact CD1-CB 4.27Å; I25-M325 HydrophobicContact CD1-CE 3.69Å; I25-M325 HydrophobicContact CD1-CG 3.53Å; I25-M325 HydrophobicContact CD1-SD 3.25Å; I25-M325 WeakPolarHBondContact CD1-SD 3.36Å; I25-M325 HydrophobicContact CG1-SD 4.19Å; I25-M325 HydrophobicContact CG2-CE 3.98Å; I25-M325 HydrophobicContact CG2-SD 3.7Å; I25-A349 HydrophobicContact CD1-CB 3.91Å; I25-A349 HydrophobicContact CG1-CB 4.44Å; I25-I365 HydrophobicContact CG2-CD1 4.39Å; I25-I365 HydrophobicContact CG2-CG2 4.4Å; I25-L367 HydrophobicContact CB-CD2 4.49Å; I25-L367 HydrophobicContact CG1-CD2 4.31Å; I25-L367 HydrophobicContact CG2-CD2 3.99Å
26	D	84.1	Confident	91.4	Very high	50 Å²	50	54.2 Å²	54.2	27%	0.267	30%	0.304	S	S	.	.			trans	-115	114	-176.2	-174.9	-7.8	0	0	0	108.5	T24 A28 K31	T24-D26 PolarHBondContact O-N 2.93Å; D26-A28 VanDerWaalsContact C-N 3.32Å; D26-A28 VanDerWaalsContact OD1-CB 3.27Å; D26-A28 WeakPolarHBondContact OD1-CB 3.37Å; D26-A28 PolarHBondContact OD1-N 3.02Å; D26-A28 VanDerWaalsContact OD1-N 3.08Å; D26-K31 WeakPolarHBondContact OD2-CE 3.2Å; D26-K31 IonicContact OD2-NZ 2.79Å; D26-K31 PolarHBondContact OD2-NZ 3.18Å
27	T	82	Confident	91.3	Very high	109 Å²	109	54.5 Å²	54.5	67%	0.669	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-8	-177	56.7	0	0	0	0	113.2	G29 I365	T27-G29 PolarHBondContact O-N 3.36Å; T27-I365 HydrophobicContact CG2-CD1 3.95Å; T27-I365 HydrophobicContact CG2-CG2 4.19Å
28	A	83.8	Confident	91.3	Very high	95 Å²	95	59 Å²	59	79%	0.785	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.9	-178.7	0	0	0	0	0	113.1	D26	D26-A28 VanDerWaalsContact C-N 3.32Å; D26-A28 VanDerWaalsContact OD1-CB 3.27Å; D26-A28 WeakPolarHBondContact OD1-CB 3.37Å; D26-A28 PolarHBondContact OD1-N 3.02Å; D26-A28 VanDerWaalsContact OD1-N 3.08Å
29	G	78.7	Confident	91.3	Very high	21 Å²	21	60.3 Å²	60.3	22%	0.216	34%	0.335	C	S	.	.			trans	144.6	173.8	171.7	0	0	0	0	0	113.8	T27	T27-G29 PolarHBondContact O-N 3.36Å
30	P	93.1	Very high	91.3	Very high	61 Å²	61	61.3 Å²	61.3	40%	0.396	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-73	133.1	-176.4	28.5	-32.6	0	0	0	111.6	P366 L367 T369	P30-P366 HydrophobicContact CB-CB 4.19Å; P30-P366 HydrophobicContact CG-CB 4.29Å; P30-L367 WeakPolarHBondContact CA-O 3.45Å; P30-T369 HydrophobicContact CB-CG2 4.03Å; P30-T369 HydrophobicContact CG-CG2 4.18Å
31	K	94.9	Very high	91.4	Very high	90 Å²	90	65.9 Å²	65.9	39%	0.391	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	148.2	173.1	-60.9	177.3	179.7	166.7	0	110.5	Y20 D26 L33 L367 F368 T369	Y20-K31 HydrophobicContact CE2-CB 4.06Å; Y20-K31 HydrophobicContact CE2-CD 4.25Å; D26-K31 WeakPolarHBondContact OD2-CE 3.2Å; D26-K31 IonicContact OD2-NZ 2.79Å; D26-K31 PolarHBondContact OD2-NZ 3.18Å; K31-L33 PolarHBondContact O-N 3.26Å; K31-L367 PolarHBondContact N-O 3.46Å; K31-F368 CarbonylContact O-C 3.58Å; K31-F368 WeakPolarHBondContact O-CA 3.21Å; K31-F368 VanDerWaalsContact O-CB 3.28Å; K31-F368 WeakPolarHBondContact O-CB 3.49Å; K31-T369 PolarHBondContact O-N 3.27Å
32	L	96	Very high	91.7	Very high	121 Å²	121	63.9 Å²	63.9	63%	0.634	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	131.6	175.2	-167.8	70.8	0	0	0	110.3	T369 Y370	L32-T369 WeakPolarHBondContact CA-O 3.17Å; L32-T369 HydrophobicContact CD1-CG2 4.5Å; L32-Y370 HydrophobicContact CD1-CD2 4.2Å; L32-Y370 HydrophobicContact CG-CD2 4.47Å
33	L	95.9	Very high	92.1	Very high	1 Å²	1	64 Å²	64	1%	0.005	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-64.4	143.7	170.2	-65.8	180	0	0	0	110.8	L18 Y20 K31 L345 F368 T369 Y370	L18-L33 HydrophobicContact CB-CB 3.98Å; L18-L33 HydrophobicContact CB-CD1 3.97Å; L18-L33 HydrophobicContact CD1-CB 4.05Å; L18-L33 HydrophobicContact CD1-CD1 3.59Å; L18-L33 HydrophobicContact CD1-CG 4.46Å; L18-L33 HydrophobicContact CG-CD1 4.45Å; Y20-L33 VanDerWaalsContact CB-CD2 3.47Å; Y20-L33 HydrophobicContact CD2-CD2 4.47Å; Y20-L33 HydrophobicContact CG-CD2 4.32Å; K31-L33 PolarHBondContact O-N 3.26Å; L33-L345 HydrophobicContact CD1-CD1 4.36Å; L33-L345 HydrophobicContact CD1-CD2 3.51Å; L33-L345 HydrophobicContact CD1-CG 4.45Å; L33-F368 HydrophobicContact CD1-CD2 3.82Å; L33-F368 HydrophobicContact CD1-CE2 4.06Å; L33-F368 HydrophobicContact CD2-CB 3.87Å; L33-F368 HydrophobicContact CD2-CD1 4.38Å; L33-F368 HydrophobicContact CD2-CD2 3.53Å; L33-F368 HydrophobicContact CD2-CE2 4.08Å; L33-F368 HydrophobicContact CD2-CG 3.69Å; L33-F368 HydrophobicContact CG-CB 4.27Å; L33-F368 HydrophobicContact CG-CD2 3.76Å; L33-F368 HydrophobicContact CG-CE2 4.43Å; L33-F368 HydrophobicContact CG-CG 4.26Å; L33-T369 PolarHBondContact N-O 3.08Å; L33-Y370 HydrophobicContact CB-CD2 3.94Å; L33-Y370 HydrophobicContact CB-CG 4.29Å; L33-Y370 WeakPolarHBondContact O-CD2 3.18Å
34	K	95.3	Very high	92.7	Very high	143 Å²	143	64 Å²	64	62%	0.622	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.9	176.9	-65.5	-173.5	179.3	-175.8	0	110.3	L18 K19 I36	L18-K34 CarbonylContact C-O 3.55Å; L18-K34 WeakPolarHBondContact CA-O 3.36Å; K19-K34 PolarHBondContact N-O 2.93Å; K19-K34 PolarHBondContact O-N 2.79Å; K34-I36 PolarHBondContact O-N 2.99Å
35	P	96.3	Very high	93.3	Very high	68 Å²	68	61.2 Å²	61.2	44%	0.442	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	136.4	172.4	-22.5	33.8	0	0	0	111.9	L18 I38 Y370	L18-P35 HydrophobicContact CD2-CB 3.97Å; L18-P35 HydrophobicContact CD2-CG 4.01Å; P35-I38 HydrophobicContact CB-CD1 4.28Å; P35-Y370 HydrophobicContact CG-CE2 3.87Å
36	I	96.1	Very high	94	Very high	28 Å²	28	61.5 Å²	61.5	14%	0.144	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-53.4	171.3	-58	171.9	0	0	0	109	L5 A17 K19 K34 V71 K74	L5-I36 HydrophobicContact CD1-CD1 3.35Å; A17-I36 HydrophobicContact CB-CB 4.48Å; A17-I36 HydrophobicContact CB-CD1 4.46Å; A17-I36 WeakPolarHBondContact O-CB 3.35Å; A17-I36 PolarHBondContact O-N 2.65Å; K19-I36 HydrophobicContact CB-CD1 3.78Å; K19-I36 HydrophobicContact CB-CG1 3.86Å; K19-I36 HydrophobicContact CD-CD1 4.48Å; K19-I36 HydrophobicContact CG-CD1 4.49Å; K34-I36 PolarHBondContact O-N 2.99Å; I36-V71 HydrophobicContact CD1-CG1 3.73Å; I36-V71 HydrophobicContact CG2-CG1 4.06Å; I36-V71 WeakPolarHBondContact CG2-O 3.36Å; I36-K74 HydrophobicContact CG2-CD 4.38Å; I36-K74 HydrophobicContact CG2-CG 3.86Å; I36-K74 WeakPolarHBondContact O-CD 3.37Å
37	F	97	Very high	94.7	Very high	15 Å²	15	59.1 Å²	59.1	7%	0.066	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	154.7	172.2	71.5	-97.7	0	0	0	110	V15 F16 A17 V57 F69 K74	V15-F37 HydrophobicContact CG1-CE2 4.17Å; F16-F37 WeakPolarHBondContact CA-O 3.41Å; F16-F37 WeakPolarHBondContact CB-O 3.33Å; A17-F37 HydrophobicContact CB-CD1 3.84Å; A17-F37 HydrophobicContact CB-CE1 3.38Å; A17-F37 HydrophobicContact CB-CZ 3.79Å; A17-F37 PolarHBondContact N-O 3.48Å; A17-F37 PolarHBondContact O-N 3.27Å; F37-V57 HydrophobicContact CZ-CB 4.5Å; F37-F69 HydrophobicContact CD2-CD1 4.44Å; F37-F69 HydrophobicContact CE1-CB 4.21Å; F37-F69 HydrophobicContact CE2-CB 4.28Å; F37-F69 AromaticContact CE2-CD1 3.69Å; F37-F69 HydrophobicContact CE2-CD1 3.69Å; F37-F69 HydrophobicContact CE2-CE1 4.29Å; F37-F69 HydrophobicContact CE2-CG 4.07Å; F37-F69 HydrophobicContact CZ-CB 3.7Å; F37-F69 HydrophobicContact CZ-CD1 4Å; F37-F69 AromaticContact CZ-CG 3.91Å; F37-F69 HydrophobicContact CZ-CG 3.91Å; F37-K74 HydrophobicContact CB-CB 4.11Å
38	I	97.2	Very high	95.5	Very high	96 Å²	96	56 Å²	56	49%	0.492	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	115.9	171.1	-59.3	168.5	0	0	0	105.8	F16 P35 P40	F16-I38 HydrophobicContact CB-CB 4.15Å; F16-I38 HydrophobicContact CB-CG1 3.79Å; F16-I38 HydrophobicContact CB-CG2 4.23Å; P35-I38 HydrophobicContact CB-CD1 4.28Å; I38-P40 WeakPolarHBondContact O-CD 3.17Å
39	D	98.1	Very high	96.2	Very high	26 Å²	26	52 Å²	52	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	98.8	174.6	-173.8	-8.7	0	0	0	109.4	S14 V15 T41 A42 F69 R76	S14-D39 VanDerWaalsContact CA-O 3.32Å; S14-D39 WeakPolarHBondContact CA-O 3.35Å; V15-D39 PolarHBondContact N-O 2.7Å; V15-D39 PolarHBondContact O-N 2.85Å; D39-T41 PolarHBondContact O-N 3.25Å; D39-T41 WeakPolarHBondContact OD1-CA 3.43Å; D39-T41 PolarHBondContact OD1-N 2.91Å; D39-T41 PolarHBondContact OD1-OG1 3.02Å; D39-A42 HydrophobicContact CB-CB 4.15Å; D39-A42 WeakPolarHBondContact O-CB 3.25Å; D39-A42 PolarHBondContact OD1-N 3.2Å; D39-A42 VanDerWaalsContact OD1-N 3.15Å; D39-F69 HydrophobicContact CB-CE1 4.05Å; D39-R76 IonicContact OD2-NE 3.98Å
40	P	97.2	Very high	97.1	Very high	85 Å²	85	51.4 Å²	51.4	55%	0.552	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-7.5	179.8	31.4	-34.8	0	0	0	113.6	S14 I38	S14-P40 WeakPolarHBondContact OG-CA 3.27Å; I38-P40 WeakPolarHBondContact O-CD 3.17Å
41	T	96.8	Very high	97.4	Very high	101 Å²	101	48.8 Å²	48.8	62%	0.62	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	20.6	-179.4	59.5	0	0	0	0	111.7	D39 H43 R76	D39-T41 PolarHBondContact O-N 3.25Å; D39-T41 WeakPolarHBondContact OD1-CA 3.43Å; D39-T41 PolarHBondContact OD1-N 2.91Å; D39-T41 PolarHBondContact OD1-OG1 3.02Å; T41-H43 VanDerWaalsContact C-N 3.34Å; T41-H43 PolarHBondContact O-N 2.87Å; T41-R76 PolarHBondContact O-NH1 2.88Å
42	A	98	Very high	97.4	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	26%	0.259	C	S	.	.	S	Bend	trans	-56.7	-48.9	179.7	0	0	0	0	0	111.1	G13 V15 D39 Q67 F69 R76	G13-A42 WeakPolarHBondContact O-CB 3.45Å; V15-A42 HydrophobicContact CB-CB 3.79Å; V15-A42 HydrophobicContact CG2-CB 3.56Å; D39-A42 HydrophobicContact CB-CB 4.15Å; D39-A42 WeakPolarHBondContact O-CB 3.25Å; D39-A42 PolarHBondContact OD1-N 3.2Å; D39-A42 VanDerWaalsContact OD1-N 3.15Å; A42-Q67 PolarHBondContact O-NE2 3.38Å; A42-F69 HydrophobicContact CB-CE1 4.19Å; A42-F69 HydrophobicContact CB-CZ 3.71Å; A42-R76 PolarHBondContact O-NH1 3.3Å; A42-R76 VanDerWaalsContact O-NH1 3.08Å
43	H	98.6	Very high	97.3	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.019	23%	0.233	C	C	.	.			trans	-134.5	145.2	175.9	-63.8	-88	0	0	0	111	G13 T41 A45 S59 S61 D63 I65 Q67	G13-H43 WeakPolarHBondContact CA-O 3.25Å; G13-H43 PolarHBondContact O-N 2.99Å; T41-H43 VanDerWaalsContact C-N 3.34Å; T41-H43 PolarHBondContact O-N 2.87Å; H43-A45 WeakPolarHBondContact CB-O 3.41Å; H43-A45 PolarHBondContact O-N 3.22Å; H43-S59 PolarHBondContact NE2-OG 3.16Å; H43-S61 WeakPolarHBondContact ND1-CB 3.07Å; H43-D63 WeakPolarHBondContact CB-OD2 3.19Å; H43-D63 IonicContact CE1-OD1 3.94Å; H43-D63 IonicContact CE1-OD2 3.88Å; H43-D63 IonicContact CG-OD2 3.43Å; H43-D63 IonicContact ND1-OD1 3.31Å; H43-D63 PolarHBondContact ND1-OD1 3.49Å; H43-D63 IonicContact ND1-OD2 2.73Å; H43-D63 PolarHBondContact ND1-OD2 3.07Å; H43-I65 PolarHBondContact CE1-O 3.4Å; H43-Q67 WeakPolarHBondContact CE1-CG 3.31Å; H43-Q67 WeakPolarHBondContact NE2-CG 3.43Å
44	P	98	Very high	97	Very high	122 Å²	122	42.8 Å²	42.8	79%	0.792	25%	0.246	S	C	*	.	S	Bend	trans	-76.7	-5.5	169.4	31.9	-37.6	0	0	0	113.8	D63	P44-D63 WeakPolarHBondContact CD-OD2 3.39Å; P44-D63 HydrophobicContact CG-CB 4.12Å
45	A	98.4	Very high	96.8	Very high	22 Å²	22	36.7 Å²	36.7	18%	0.182	22%	0.22	C	C	.	.	S	Bend	trans	-133.5	165	-177.4	0	0	0	0	0	111	G13 H43 V47 S61 D63	G13-A45 WeakPolarHBondContact CA-O 3.38Å; H43-A45 WeakPolarHBondContact CB-O 3.41Å; H43-A45 PolarHBondContact O-N 3.22Å; A45-V47 PolarHBondContact O-N 3.06Å; A45-S61 PolarHBondContact O-OG 2.99Å; A45-D63 HydrophobicContact CB-CB 3.94Å
46	P	98.5	Very high	96.7	Very high	33 Å²	33	33.5 Å²	33.5	21%	0.214	20%	0.199	C	C	.	.			trans	-54.6	132	-176.9	-24.6	31	0	0	0	113.4	Y11 T48 S61 S62	Y11-P46 HydrophobicContact CD2-CB 4.06Å; Y11-P46 HydrophobicContact CD2-CG 3.96Å; Y11-P46 HydrophobicContact CE2-CB 4.39Å; Y11-P46 HydrophobicContact CE2-CG 3.88Å; Y11-P46 HydrophobicContact CG-CG 4.44Å; Y11-P46 VanDerWaalsContact O-CA 3.27Å; Y11-P46 WeakPolarHBondContact O-CA 3.28Å; Y11-P46 WeakPolarHBondContact O-CB 3.38Å; Y11-P46 VanDerWaalsContact O-CG 3.25Å; Y11-P46 WeakPolarHBondContact O-CG 3.42Å; P46-T48 PolarHBondContact O-N 3.49Å; P46-S61 WeakPolarHBondContact O-CA 3.23Å; P46-S61 WeakPolarHBondContact O-CB 3.49Å; P46-S61 PolarHBondContact O-OG 3.32Å; P46-S62 PolarHBondContact O-N 2.82Å; P46-S62 VanDerWaalsContact O-N 3.1Å; P46-S62 PolarHBondContact O-OG 2.91Å
47	V	98.8	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	116.3	172.7	-170.2	0	0	0	0	108.9	T10 V15 A45 G60 T378 T379	T10-V47 PolarHBondContact O-N 3.06Å; V15-V47 HydrophobicContact CG2-CG1 4.42Å; V15-V47 HydrophobicContact CG2-CG2 3.85Å; A45-V47 PolarHBondContact O-N 3.06Å; V47-G60 WeakPolarHBondContact CG1-O 3.31Å; V47-T378 WeakPolarHBondContact O-CB 3.43Å; V47-T378 PolarHBondContact O-OG1 3.18Å; V47-T379 HydrophobicContact CB-CG2 4.44Å; V47-T379 HydrophobicContact CG1-CG2 3.86Å
48	T	98.3	Very high	96.8	Very high	44 Å²	44	31.4 Å²	31.4	27%	0.27	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-20.5	-172	41.1	0	0	0	0	113.2	P46 G60 S61 S62 T86 I87	P46-T48 PolarHBondContact O-N 3.49Å; T48-G60 PolarHBondContact N-O 3.33Å; T48-G60 PolarHBondContact OG1-O 2.91Å; T48-S61 WeakPolarHBondContact OG1-CA 3.45Å; T48-S62 WeakPolarHBondContact CG2-OG 3.45Å; T48-T86 HydrophobicContact CG2-CG2 3.71Å; T48-I87 WeakPolarHBondContact CB-O 3.42Å; T48-I87 PolarHBondContact OG1-O 2.98Å
49	T	98.5	Very high	96.9	Very high	9 Å²	9	26.9 Å²	26.9	6%	0.055	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	151.7	176.7	-178.6	0	0	0	0	111.1	S59 G60 I87 Q89 L90 T379	T49-S59 WeakPolarHBondContact O-CA 3.42Å; T49-G60 PolarHBondContact N-O 2.89Å; T49-G60 VanDerWaalsContact N-O 3.08Å; T49-G60 PolarHBondContact O-N 2.88Å; T49-I87 HydrophobicContact CG2-CB 4.41Å; T49-I87 HydrophobicContact CG2-CG2 3.71Å; T49-Q89 WeakPolarHBondContact OG1-CA 3.32Å; T49-L90 HydrophobicContact CG2-CB 4.15Å; T49-L90 HydrophobicContact CG2-CD1 3.88Å; T49-L90 HydrophobicContact CG2-CG 3.64Å; T49-L90 PolarHBondContact OG1-N 3.02Å; T49-T379 WeakPolarHBondContact CA-OG1 3.39Å
50	I	98.6	Very high	96.9	Very high	9 Å²	9	25.6 Å²	25.6	5%	0.046	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.2	174	-157.1	167.8	0	0	0	109.3	S7 V15 V57 I58 T379 A381	S7-I50 WeakPolarHBondContact OG-CD1 3.01Å; V15-I50 HydrophobicContact CG1-CD1 4.03Å; I50-V57 HydrophobicContact CD1-CG1 3.7Å; I50-V57 HydrophobicContact CG1-CG1 3.8Å; I50-I58 CarbonylContact C-O 3.55Å; I50-I58 VanDerWaalsContact CA-O 3.3Å; I50-I58 WeakPolarHBondContact CA-O 3.1Å; I50-I58 VanDerWaalsContact CG1-O 3.26Å; I50-I58 WeakPolarHBondContact CG1-O 3.38Å; I50-T379 HydrophobicContact CB-CG2 3.69Å; I50-T379 HydrophobicContact CG2-CG2 3.76Å; I50-T379 WeakPolarHBondContact CG2-OG1 3.42Å; I50-T379 PolarHBondContact N-OG1 3.07Å; I50-A381 HydrophobicContact CG2-CB 3.78Å
51	A	98	Very high	97	Very high	7 Å²	7	21.6 Å²	21.6	6%	0.058	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.2	171.7	0	0	0	0	0	109.3	I58 L90 F92	A51-I58 HydrophobicContact CB-CD1 4.18Å; A51-I58 HydrophobicContact CB-CG1 3.86Å; A51-I58 PolarHBondContact N-O 3.23Å; A51-I58 WeakPolarHBondContact O-CG1 3.02Å; A51-I58 PolarHBondContact O-N 3.08Å; A51-L90 HydrophobicContact CB-CB 3.88Å; A51-F92 HydrophobicContact CB-CD2 3.76Å; A51-F92 HydrophobicContact CB-CE2 4.03Å
52	T	96.6	Very high	97	Very high	12 Å²	12	18.8 Å²	18.8	7%	0.074	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	138.9	-176.3	-54.1	0	0	0	0	109.7	L5 S7 V56 V57 I383	L5-T52 HydrophobicContact CD2-CG2 3.4Å; L5-T52 VanDerWaalsContact CD2-CG2 3.4Å; L5-T52 HydrophobicContact CG-CG2 4.07Å; S7-T52 PolarHBondContact OG-OG1 2.85Å; T52-V56 WeakPolarHBondContact CA-O 3.34Å; T52-V57 HydrophobicContact CG2-CG2 3.83Å; T52-I383 HydrophobicContact CG2-CD1 3.71Å; T52-I383 HydrophobicContact CG2-CG1 3.9Å
53	K	93.4	Very high	97.1	Very high	23 Å²	23	20 Å²	20	10%	0.1	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	126	173.8	179.8	172.1	180	171.3	0	109.9	D55 V56 F92 I93 E95 C102 L125	K53-D55 PolarHBondContact O-N 2.65Å; K53-D55 VanDerWaalsContact O-N 3.11Å; K53-V56 PolarHBondContact N-O 3.19Å; K53-V56 PolarHBondContact O-N 3.01Å; K53-F92 HydrophobicContact CB-CB 4.28Å; K53-F92 HydrophobicContact CB-CD1 3.98Å; K53-F92 HydrophobicContact CB-CD2 3.57Å; K53-F92 HydrophobicContact CB-CE1 4.21Å; K53-F92 HydrophobicContact CB-CE2 3.79Å; K53-F92 HydrophobicContact CB-CG 3.68Å; K53-F92 HydrophobicContact CB-CZ 4.12Å; K53-F92 HydrophobicContact CD-CB 4.02Å; K53-F92 HydrophobicContact CD-CD1 3.71Å; K53-F92 HydrophobicContact CD-CE1 4.35Å; K53-F92 HydrophobicContact CD-CG 3.87Å; K53-F92 HydrophobicContact CG-CG 4.47Å; K53-I93 PolarHBondContact NZ-O 2.96Å; K53-E95 IonicContact NZ-OE1 3.19Å; K53-E95 PolarHBondContact NZ-OE1 3.21Å; K53-E95 VanDerWaalsContact NZ-OE1 3.13Å; K53-E95 IonicContact NZ-OE2 3.8Å; K53-E95 PolarHBondContact NZ-OE2 2.85Å; K53-C102 PolarHBondContact NZ-SG 2.83Å; K53-L125 HydrophobicContact CD-CD1 4.34Å; K53-L125 HydrophobicContact CG-CD1 4.47Å
54	D	90.1	Very high	97.1	Very high	50 Å²	50	23.6 Å²	23.6	27%	0.267	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	-113.8	-178.8	-54.8	-44.8	0	0	0	112.3	L125	D54-L125 HydrophobicContact CB-CB 4.14Å; D54-L125 VanDerWaalsContact CB-O 3.31Å; D54-L125 WeakPolarHBondContact CB-O 3.17Å; D54-L125 PolarHBondContact OD2-N 3.37Å
55	D	89.8	Confident	97.1	Very high	16 Å²	16	19.9 Å²	19.9	9%	0.086	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-2.3	179.1	-167.2	51.1	0	0	0	114.4	K53 S70 V71 H72 L125 C128	K53-D55 PolarHBondContact O-N 2.65Å; K53-D55 VanDerWaalsContact O-N 3.11Å; D55-S70 WeakPolarHBondContact O-CA 3.44Å; D55-S70 PolarHBondContact OD2-OG 2.85Å; D55-V71 WeakPolarHBondContact O-CG2 3.27Å; D55-V71 PolarHBondContact O-N 3.37Å; D55-V71 WeakPolarHBondContact OD1-CB 3.42Å; D55-V71 PolarHBondContact OD1-N 3.4Å; D55-H72 WeakPolarHBondContact OD1-CA 3.2Å; D55-H72 WeakPolarHBondContact OD1-CB 2.98Å; D55-H72 PolarHBondContact OD1-N 2.78Å; D55-H72 WeakPolarHBondContact OD2-CB 3.37Å; D55-L125 WeakPolarHBondContact CB-O 3.12Å; D55-L125 PolarHBondContact N-O 2.7Å; D55-C128 PolarHBondContact OD2-N 2.89Å
56	V	93.9	Very high	97.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.1	-168.1	-176.9	0	0	0	0	111.2	T52 K53 I58 V68 F69 F92 L125 C128	T52-V56 WeakPolarHBondContact CA-O 3.34Å; K53-V56 PolarHBondContact N-O 3.19Å; K53-V56 PolarHBondContact O-N 3.01Å; V56-I58 HydrophobicContact CG1-CG2 4Å; V56-V68 HydrophobicContact CG1-CG1 4.01Å; V56-F69 WeakPolarHBondContact CA-O 3.21Å; V56-F92 HydrophobicContact CG1-CZ 4.18Å; V56-L125 HydrophobicContact CB-CD1 4Å; V56-L125 HydrophobicContact CG2-CB 3.87Å; V56-L125 HydrophobicContact CG2-CD1 3.78Å; V56-L125 HydrophobicContact CG2-CG 4.33Å; V56-C128 HydrophobicContact CG2-CB 3.87Å
57	V	97.5	Very high	97.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131	166.1	176.3	0	0	0	0	107.5	V15 F37 I50 T52 F69 V71	V15-V57 HydrophobicContact CG1-CG1 4.43Å; F37-V57 HydrophobicContact CZ-CB 4.5Å; I50-V57 HydrophobicContact CD1-CG1 3.7Å; I50-V57 HydrophobicContact CG1-CG1 3.8Å; T52-V57 HydrophobicContact CG2-CG2 3.83Å; V57-F69 HydrophobicContact CB-CB 4.24Å; V57-F69 HydrophobicContact CG1-CD2 4.5Å; V57-F69 PolarHBondContact N-O 2.95Å; V57-F69 PolarHBondContact O-N 3.2Å; V57-V71 HydrophobicContact CG2-CG2 3.92Å
58	I	98	Very high	97	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.7	170.7	58.1	175.9	0	0	0	109.9	I50 A51 V56 I66 Q67 V68 L90 F92 F104	I50-I58 CarbonylContact C-O 3.55Å; I50-I58 VanDerWaalsContact CA-O 3.3Å; I50-I58 WeakPolarHBondContact CA-O 3.1Å; I50-I58 VanDerWaalsContact CG1-O 3.26Å; I50-I58 WeakPolarHBondContact CG1-O 3.38Å; A51-I58 HydrophobicContact CB-CD1 4.18Å; A51-I58 HydrophobicContact CB-CG1 3.86Å; A51-I58 PolarHBondContact N-O 3.23Å; A51-I58 WeakPolarHBondContact O-CG1 3.02Å; A51-I58 PolarHBondContact O-N 3.08Å; V56-I58 HydrophobicContact CG1-CG2 4Å; I58-I66 HydrophobicContact CB-CG2 4.17Å; I58-Q67 CarbonylContact C-O 3.47Å; I58-Q67 VanDerWaalsContact CA-O 3.25Å; I58-Q67 WeakPolarHBondContact CA-O 3.41Å; I58-V68 HydrophobicContact CG2-CB 4.46Å; I58-V68 HydrophobicContact CG2-CG1 4.26Å; I58-V68 HydrophobicContact CG2-CG2 4.1Å; I58-L90 HydrophobicContact CB-CD1 4.23Å; I58-L90 HydrophobicContact CD1-CB 4.14Å; I58-L90 HydrophobicContact CD1-CD1 4.09Å; I58-L90 HydrophobicContact CD1-CD2 4.18Å; I58-L90 HydrophobicContact CD1-CG 4.37Å; I58-L90 HydrophobicContact CG1-CB 4.43Å; I58-L90 HydrophobicContact CG1-CD1 3.91Å; I58-F92 HydrophobicContact CD1-CD2 4.41Å; I58-F92 HydrophobicContact CD1-CE1 4.36Å; I58-F92 HydrophobicContact CD1-CE2 3.72Å; I58-F92 HydrophobicContact CD1-CZ 3.68Å; I58-F92 HydrophobicContact CG1-CE2 3.69Å; I58-F92 HydrophobicContact CG1-CZ 3.92Å; I58-F92 HydrophobicContact CG2-CZ 4.2Å; I58-F104 HydrophobicContact CD1-CB 4.23Å; I58-F104 HydrophobicContact CD1-CD1 3.86Å; I58-F104 HydrophobicContact CD1-CD2 3.52Å; I58-F104 HydrophobicContact CD1-CE1 4.04Å; I58-F104 HydrophobicContact CD1-CE2 3.73Å; I58-F104 HydrophobicContact CD1-CG 3.61Å; I58-F104 HydrophobicContact CD1-CZ 3.99Å
59	S	98.7	Very high	96.9	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.3	175.8	57.3	0	0	0	0	110.2	V15 H43 T49 I66 Q67 F69	V15-S59 WeakPolarHBondContact CG2-OG 3.11Å; H43-S59 PolarHBondContact NE2-OG 3.16Å; T49-S59 WeakPolarHBondContact O-CA 3.42Å; S59-I66 CarbonylContact O-C 3.59Å; S59-I66 WeakPolarHBondContact O-CA 3.41Å; S59-Q67 PolarHBondContact N-O 2.77Å; S59-Q67 PolarHBondContact O-N 2.9Å; S59-F69 WeakPolarHBondContact OG-CE2 3.07Å
60	G	98.7	Very high	96.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.3	172.2	0	0	0	0	0	109	V47 T48 T49 L90	V47-G60 WeakPolarHBondContact CG1-O 3.31Å; T48-G60 PolarHBondContact N-O 3.33Å; T48-G60 PolarHBondContact OG1-O 2.91Å; T49-G60 PolarHBondContact N-O 2.89Å; T49-G60 VanDerWaalsContact N-O 3.08Å; T49-G60 PolarHBondContact O-N 2.88Å; G60-L90 VanDerWaalsContact N-CD1 3.33Å
61	S	98.7	Very high	96.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	173.2	-172.8	165.6	0	0	0	0	112	H43 A45 P46 T48 D63 E64 I65 I87	H43-S61 WeakPolarHBondContact ND1-CB 3.07Å; A45-S61 PolarHBondContact O-OG 2.99Å; P46-S61 WeakPolarHBondContact O-CA 3.23Å; P46-S61 WeakPolarHBondContact O-CB 3.49Å; P46-S61 PolarHBondContact O-OG 3.32Å; T48-S61 WeakPolarHBondContact OG1-CA 3.45Å; S61-D63 WeakPolarHBondContact CB-OD1 3.15Å; S61-D63 PolarHBondContact O-N 2.86Å; S61-D63 PolarHBondContact OG-N 2.84Å; S61-D63 PolarHBondContact OG-OD1 2.81Å; S61-E64 PolarHBondContact O-N 2.86Å; S61-I65 PolarHBondContact N-O 2.74Å; S61-I87 PolarHBondContact O-N 3.48Å
62	S	98.4	Very high	96.1	Very high	42 Å²	42	22.5 Å²	22.5	29%	0.294	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-12.2	169.6	-50.8	0	0	0	0	112.8	P46 T48 E64 T86	P46-S62 PolarHBondContact O-N 2.82Å; P46-S62 VanDerWaalsContact O-N 3.1Å; P46-S62 PolarHBondContact O-OG 2.91Å; T48-S62 WeakPolarHBondContact CG2-OG 3.45Å; S62-E64 PolarHBondContact O-N 3.27Å; S62-T86 WeakPolarHBondContact CA-OG1 3.48Å
63	D	98.4	Very high	95.9	Very high	28 Å²	28	25.1 Å²	25.1	15%	0.15	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	4.9	171.8	71.6	-2.5	0	0	0	114.1	H43 P44 A45 S61 I65	H43-D63 WeakPolarHBondContact CB-OD2 3.19Å; H43-D63 IonicContact CE1-OD1 3.94Å; H43-D63 IonicContact CE1-OD2 3.88Å; H43-D63 IonicContact CG-OD2 3.43Å; H43-D63 IonicContact ND1-OD1 3.31Å; H43-D63 PolarHBondContact ND1-OD1 3.49Å; H43-D63 IonicContact ND1-OD2 2.73Å; H43-D63 PolarHBondContact ND1-OD2 3.07Å; P44-D63 WeakPolarHBondContact CD-OD2 3.39Å; P44-D63 HydrophobicContact CG-CB 4.12Å; A45-D63 HydrophobicContact CB-CB 3.94Å; S61-D63 WeakPolarHBondContact CB-OD1 3.15Å; S61-D63 PolarHBondContact O-N 2.86Å; S61-D63 PolarHBondContact OG-N 2.84Å; S61-D63 PolarHBondContact OG-OD1 2.81Å; D63-I65 PolarHBondContact O-N 2.93Å; D63-I65 PolarHBondContact OD1-N 3.46Å
64	E	98.5	Very high	95.9	Very high	79 Å²	79	30 Å²	30	37%	0.369	15%	0.153	S	C	.	.	S	Bend	trans	72.9	1.4	176.7	-37.6	-176.5	158.2	0	0	114.9	S61 S62 G85	S61-E64 PolarHBondContact O-N 2.86Å; S62-E64 PolarHBondContact O-N 3.27Å; E64-G85 WeakPolarHBondContact OE1-CA 3.42Å; E64-G85 PolarHBondContact OE1-N 2.64Å
65	I	98.4	Very high	96.1	Very high	44 Å²	44	31 Å²	31	23%	0.226	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140	-174.5	-61.9	173.5	0	0	0	111.1	H43 S61 D63 Q67 A79 E81 I87	H43-I65 PolarHBondContact CE1-O 3.4Å; S61-I65 PolarHBondContact N-O 2.74Å; D63-I65 PolarHBondContact O-N 2.93Å; D63-I65 PolarHBondContact OD1-N 3.46Å; I65-Q67 HydrophobicContact CG2-CG 4.27Å; I65-A79 HydrophobicContact CG2-CB 3.69Å; I65-E81 HydrophobicContact CG1-CG 4.46Å; I65-I87 WeakPolarHBondContact O-CD1 3.49Å
66	I	98.5	Very high	96.3	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	116.3	165.9	-57.8	166.8	0	0	0	108.3	I58 S59 A79 L80 I87 L90 F104 W116	I58-I66 HydrophobicContact CB-CG2 4.17Å; S59-I66 CarbonylContact O-C 3.59Å; S59-I66 WeakPolarHBondContact O-CA 3.41Å; I66-A79 CarbonylContact O-C 3.58Å; I66-A79 WeakPolarHBondContact O-CA 3.45Å; I66-L80 HydrophobicContact CB-CB 4.19Å; I66-L80 HydrophobicContact CG2-CD1 4.34Å; I66-L80 PolarHBondContact N-O 2.86Å; I66-L80 VanDerWaalsContact N-O 3.16Å; I66-L80 PolarHBondContact O-N 2.85Å; I66-I87 HydrophobicContact CB-CD1 4.49Å; I66-I87 HydrophobicContact CG1-CD1 3.51Å; I66-I87 HydrophobicContact CG1-CG1 4.39Å; I66-L90 HydrophobicContact CD1-CD2 3.84Å; I66-L90 HydrophobicContact CG1-CD2 4.18Å; I66-L90 HydrophobicContact CG2-CD1 4.16Å; I66-L90 HydrophobicContact CG2-CD2 4.43Å; I66-F104 HydrophobicContact CD1-CE2 4.18Å; I66-W116 HydrophobicContact CD1-CZ2 3.99Å
67	Q	98	Very high	96.3	Very high	17 Å²	17	37.3 Å²	37.3	8%	0.079	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143	173.5	-66.6	-74.5	3.8	0	0	110.4	A42 H43 I58 S59 I65 F69 G78	A42-Q67 PolarHBondContact O-NE2 3.38Å; H43-Q67 WeakPolarHBondContact CE1-CG 3.31Å; H43-Q67 WeakPolarHBondContact NE2-CG 3.43Å; I58-Q67 CarbonylContact C-O 3.47Å; I58-Q67 VanDerWaalsContact CA-O 3.25Å; I58-Q67 WeakPolarHBondContact CA-O 3.41Å; S59-Q67 PolarHBondContact N-O 2.77Å; S59-Q67 PolarHBondContact O-N 2.9Å; I65-Q67 HydrophobicContact CG2-CG 4.27Å; Q67-F69 HydrophobicContact CB-CD2 4.42Å; Q67-F69 HydrophobicContact CB-CE2 3.44Å; Q67-F69 VanDerWaalsContact CB-CE2 3.44Å; Q67-F69 HydrophobicContact CB-CZ 3.74Å; Q67-G78 PolarHBondContact OE1-O 2.84Å; Q67-G78 VanDerWaalsContact OE1-O 3.14Å
68	V	97.3	Very high	96.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129	-179.3	-172.6	0	0	0	0	109.2	V56 I58 V77 G78 L80	V56-V68 HydrophobicContact CG1-CG1 4.01Å; I58-V68 HydrophobicContact CG2-CB 4.46Å; I58-V68 HydrophobicContact CG2-CG1 4.26Å; I58-V68 HydrophobicContact CG2-CG2 4.1Å; V68-V77 PolarHBondContact O-N 3.33Å; V68-G78 PolarHBondContact N-O 2.88Å; V68-G78 PolarHBondContact O-N 3.17Å; V68-L80 HydrophobicContact CG2-CD1 3.95Å; V68-L80 HydrophobicContact CG2-CG 3.97Å
69	F	96.8	Very high	96.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.2	-179	-54.2	-101.9	0	0	0	110.5	V15 F37 D39 A42 V56 V57 S59 Q67 T75 R76	V15-F69 HydrophobicContact CB-CE1 4.33Å; V15-F69 HydrophobicContact CB-CE2 4.2Å; V15-F69 HydrophobicContact CB-CZ 3.87Å; V15-F69 HydrophobicContact CG1-CD2 4.24Å; V15-F69 HydrophobicContact CG1-CE1 4.45Å; V15-F69 HydrophobicContact CG1-CE2 3.9Å; V15-F69 HydrophobicContact CG1-CZ 4.02Å; V15-F69 HydrophobicContact CG2-CE2 4.25Å; V15-F69 HydrophobicContact CG2-CZ 4.07Å; F37-F69 HydrophobicContact CD2-CD1 4.44Å; F37-F69 HydrophobicContact CE1-CB 4.21Å; F37-F69 HydrophobicContact CE2-CB 4.28Å; F37-F69 AromaticContact CE2-CD1 3.69Å; F37-F69 HydrophobicContact CE2-CD1 3.69Å; F37-F69 HydrophobicContact CE2-CE1 4.29Å; F37-F69 HydrophobicContact CE2-CG 4.07Å; F37-F69 HydrophobicContact CZ-CB 3.7Å; F37-F69 HydrophobicContact CZ-CD1 4Å; F37-F69 AromaticContact CZ-CG 3.91Å; F37-F69 HydrophobicContact CZ-CG 3.91Å; D39-F69 HydrophobicContact CB-CE1 4.05Å; A42-F69 HydrophobicContact CB-CE1 4.19Å; A42-F69 HydrophobicContact CB-CZ 3.71Å; V56-F69 WeakPolarHBondContact CA-O 3.21Å; V57-F69 HydrophobicContact CB-CB 4.24Å; V57-F69 HydrophobicContact CG1-CD2 4.5Å; V57-F69 PolarHBondContact N-O 2.95Å; V57-F69 PolarHBondContact O-N 3.2Å; S59-F69 WeakPolarHBondContact OG-CE2 3.07Å; Q67-F69 HydrophobicContact CB-CD2 4.42Å; Q67-F69 HydrophobicContact CB-CE2 3.44Å; Q67-F69 VanDerWaalsContact CB-CE2 3.44Å; Q67-F69 HydrophobicContact CB-CZ 3.74Å; F69-T75 WeakPolarHBondContact CA-O 3.36Å; F69-R76 HydrophobicContact CD1-CB 3.73Å; F69-R76 HydrophobicContact CD1-CG 4.07Å; F69-R76 HydrophobicContact CE1-CB 3.62Å; F69-R76 HydrophobicContact CE1-CG 3.7Å; F69-R76 HydrophobicContact CZ-CB 4.46Å; F69-R76 HydrophobicContact CZ-CG 4.05Å
70	S	94.2	Very high	96	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.014	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.8	169.5	174.5	0	0	0	0	109.9	D55 H72 T73 K74 T75	D55-S70 WeakPolarHBondContact O-CA 3.44Å; D55-S70 PolarHBondContact OD2-OG 2.85Å; S70-H72 PolarHBondContact OG-N 2.83Å; S70-T73 WeakPolarHBondContact CB-OG1 3.45Å; S70-T73 PolarHBondContact OG-N 2.86Å; S70-T73 VanDerWaalsContact OG-N 3.15Å; S70-T73 PolarHBondContact OG-OG1 3.18Å; S70-K74 VanDerWaalsContact O-CA 3.29Å; S70-K74 WeakPolarHBondContact O-CA 3.47Å; S70-K74 PolarHBondContact O-N 2.59Å; S70-T75 PolarHBondContact N-O 3.42Å; S70-T75 PolarHBondContact O-N 3.46Å
71	V	93.5	Very high	95.9	Very high	21 Å²	21	47.8 Å²	47.8	13%	0.127	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-36.3	175.2	176.7	0	0	0	0	110.3	L5 I36 D55 V57 K74	L5-V71 HydrophobicContact CD1-CG1 4.15Å; L5-V71 HydrophobicContact CD1-CG2 4.31Å; L5-V71 HydrophobicContact CD2-CG1 4.34Å; L5-V71 HydrophobicContact CD2-CG2 3.73Å; I36-V71 HydrophobicContact CD1-CG1 3.73Å; I36-V71 HydrophobicContact CG2-CG1 4.06Å; I36-V71 WeakPolarHBondContact CG2-O 3.36Å; D55-V71 WeakPolarHBondContact O-CG2 3.27Å; D55-V71 PolarHBondContact O-N 3.37Å; D55-V71 WeakPolarHBondContact OD1-CB 3.42Å; D55-V71 PolarHBondContact OD1-N 3.4Å; V57-V71 HydrophobicContact CG2-CG2 3.92Å; V71-K74 WeakPolarHBondContact O-CG 3.35Å
72	H	90.1	Very high	95.8	Very high	137 Å²	137	49 Å²	49	63%	0.634	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-50.7	-179.7	178.1	76.9	0	0	0	111.9	D55 S70 K74	D55-H72 WeakPolarHBondContact OD1-CA 3.2Å; D55-H72 WeakPolarHBondContact OD1-CB 2.98Å; D55-H72 PolarHBondContact OD1-N 2.78Å; D55-H72 WeakPolarHBondContact OD2-CB 3.37Å; S70-H72 PolarHBondContact OG-N 2.83Å; H72-K74 VanDerWaalsContact C-N 3.29Å
73	T	91.8	Very high	95.8	Very high	67 Å²	67	47.5 Å²	47.5	41%	0.411	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-11.8	177.6	68.6	0	0	0	0	112.7	S70 T75	S70-T73 WeakPolarHBondContact CB-OG1 3.45Å; S70-T73 PolarHBondContact OG-N 2.86Å; S70-T73 VanDerWaalsContact OG-N 3.15Å; S70-T73 PolarHBondContact OG-OG1 3.18Å; T73-T75 PolarHBondContact O-N 2.88Å; T73-T75 PolarHBondContact OG1-OG1 3.24Å
74	K	94.9	Very high	95.7	Very high	125 Å²	125	51.2 Å²	51.2	54%	0.543	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	32.2	179.4	-52.1	176.7	176.4	-178.8	0	113	I36 F37 S70 V71 H72	I36-K74 HydrophobicContact CG2-CD 4.38Å; I36-K74 HydrophobicContact CG2-CG 3.86Å; I36-K74 WeakPolarHBondContact O-CD 3.37Å; F37-K74 HydrophobicContact CB-CB 4.11Å; S70-K74 VanDerWaalsContact O-CA 3.29Å; S70-K74 WeakPolarHBondContact O-CA 3.47Å; S70-K74 PolarHBondContact O-N 2.59Å; V71-K74 WeakPolarHBondContact O-CG 3.35Å; H72-K74 VanDerWaalsContact C-N 3.29Å
75	T	93.6	Very high	95.7	Very high	72 Å²	72	47.9 Å²	47.9	44%	0.442	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	153.3	-174.8	54.4	0	0	0	0	111.4	F69 S70 T73 V77	F69-T75 WeakPolarHBondContact CA-O 3.36Å; S70-T75 PolarHBondContact N-O 3.42Å; S70-T75 PolarHBondContact O-N 3.46Å; T73-T75 PolarHBondContact O-N 2.88Å; T73-T75 PolarHBondContact OG1-OG1 3.24Å; T75-V77 PolarHBondContact O-N 2.85Å
76	R	95.3	Very high	95.7	Very high	104 Å²	104	47 Å²	47	39%	0.392	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	123.6	161.3	-169.3	172.3	72	-174.5	-12	108.4	D39 T41 A42 F69	D39-R76 IonicContact OD2-NE 3.98Å; T41-R76 PolarHBondContact O-NH1 2.88Å; A42-R76 PolarHBondContact O-NH1 3.3Å; A42-R76 VanDerWaalsContact O-NH1 3.08Å; F69-R76 HydrophobicContact CD1-CB 3.73Å; F69-R76 HydrophobicContact CD1-CG 4.07Å; F69-R76 HydrophobicContact CE1-CB 3.62Å; F69-R76 HydrophobicContact CE1-CG 3.7Å; F69-R76 HydrophobicContact CZ-CB 4.46Å; F69-R76 HydrophobicContact CZ-CG 4.05Å
77	V	93.3	Very high	95.7	Very high	45 Å²	45	47 Å²	47	27%	0.273	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-31.9	-177.1	-157.9	0	0	0	0	110.5	V68 T75 C128 P131	V68-V77 PolarHBondContact O-N 3.33Å; T75-V77 PolarHBondContact O-N 2.85Å; V77-C128 HydrophobicContact CG2-CB 4.5Å; V77-P131 HydrophobicContact CB-CG 4.1Å; V77-P131 HydrophobicContact CG1-CG 4.09Å; V77-P131 WeakPolarHBondContact O-CG 3.25Å
78	G	94.4	Very high	95.7	Very high	18 Å²	18	50.8 Å²	50.8	19%	0.186	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.1	-160	168.4	0	0	0	0	0	112.8	Q67 V68 P131	Q67-G78 PolarHBondContact OE1-O 2.84Å; Q67-G78 VanDerWaalsContact OE1-O 3.14Å; V68-G78 PolarHBondContact N-O 2.88Å; V68-G78 PolarHBondContact O-N 3.17Å; G78-P131 VanDerWaalsContact CA-CG 3.43Å; G78-P131 VanDerWaalsContact N-CG 3.32Å
79	A	96.4	Very high	95.7	Very high	38 Å²	38	52.7 Å²	52.7	31%	0.314	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.9	-165.8	0	0	0	0	0	112.6	I65 I66	I65-A79 HydrophobicContact CG2-CB 3.69Å; I66-A79 CarbonylContact O-C 3.58Å; I66-A79 WeakPolarHBondContact O-CA 3.45Å
80	L	97.6	Very high	95.8	Very high	11 Å²	11	53 Å²	53	6%	0.058	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.5	172.7	-48.2	172.1	0	0	0	108.9	I66 V68 F104 W116 P131 W134	I66-L80 HydrophobicContact CB-CB 4.19Å; I66-L80 HydrophobicContact CG2-CD1 4.34Å; I66-L80 PolarHBondContact N-O 2.86Å; I66-L80 VanDerWaalsContact N-O 3.16Å; I66-L80 PolarHBondContact O-N 2.85Å; V68-L80 HydrophobicContact CG2-CD1 3.95Å; V68-L80 HydrophobicContact CG2-CG 3.97Å; L80-F104 HydrophobicContact CD1-CE1 4.27Å; L80-F104 HydrophobicContact CD1-CZ 3.77Å; L80-W116 HydrophobicContact CB-CH2 3.67Å; L80-W116 HydrophobicContact CB-CZ2 4.36Å; L80-W116 HydrophobicContact CB-CZ3 3.76Å; L80-W116 HydrophobicContact CD1-CD2 4.33Å; L80-W116 HydrophobicContact CD1-CE3 3.9Å; L80-W116 HydrophobicContact CD1-CH2 4.47Å; L80-W116 HydrophobicContact CD1-CZ3 3.97Å; L80-W116 HydrophobicContact CD2-CZ3 4.28Å; L80-W116 HydrophobicContact CG-CZ3 4.22Å; L80-P131 HydrophobicContact CD2-CB 4.31Å; L80-P131 WeakPolarHBondContact CD2-O 3.48Å; L80-W134 HydrophobicContact CD1-CB 3.91Å; L80-W134 HydrophobicContact CD1-CG 4.19Å; L80-W134 HydrophobicContact CD2-CB 3.78Å
81	E	96.1	Very high	95.9	Very high	153 Å²	153	57.4 Å²	57.4	72%	0.715	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	116.6	-172.7	-64.3	176.8	-161.7	0	0	109.5	I65	I65-E81 HydrophobicContact CG1-CG 4.46Å
82	M	96.3	Very high	96	Very high	26 Å²	26	57.4 Å²	57.4	13%	0.128	29%	0.292	C	S	.	.			trans	-159	-43.2	-177.3	-176.3	-148.1	64.3	0	0	112.9	W116 C136 Q139	M82-W116 HydrophobicContact CB-CH2 3.73Å; M82-W116 HydrophobicContact CB-CZ2 3.71Å; M82-W116 HydrophobicContact CE-CZ2 4.14Å; M82-W116 HydrophobicContact CG-CH2 4.46Å; M82-W116 HydrophobicContact CG-CZ2 4.28Å; M82-W116 HydrophobicContact SD-CH2 4.41Å; M82-W116 HydrophobicContact SD-CZ2 3.8Å; M82-C136 HydrophobicContact SD-CB 4.2Å; M82-C136 PolarHBondContact SD-SG 3.43Å; M82-Q139 HydrophobicContact CG-CG 4.31Å; M82-Q139 HydrophobicContact SD-CG 3.66Å
83	H	98.1	Very high	96.1	Very high	9 Å²	9	51.7 Å²	51.7	4%	0.042	27%	0.266	C	S	.	.			trans	-72.7	150.2	179.9	-80.5	-68	0	0	0	110.8	I87 S106 D110 C112	H83-I87 HydrophobicContact CB-CG1 4.28Å; H83-S106 PolarHBondContact CD2-OG 2.51Å; H83-S106 VanDerWaalsContact NE2-CB 3.27Å; H83-S106 WeakPolarHBondContact NE2-CB 3.34Å; H83-S106 PolarHBondContact NE2-OG 2.77Å; H83-D110 WeakPolarHBondContact CA-OD2 3.4Å; H83-D110 IonicContact CE1-OD1 2.78Å; H83-D110 IonicContact CE1-OD2 2.7Å; H83-D110 IonicContact CG-OD2 3.66Å; H83-D110 VanDerWaalsContact ND1-CG 3.29Å; H83-D110 IonicContact ND1-OD1 3.07Å; H83-D110 PolarHBondContact ND1-OD1 3.36Å; H83-D110 IonicContact ND1-OD2 2.84Å; H83-D110 PolarHBondContact ND1-OD2 3Å; H83-C112 PolarHBondContact CE1-O 3.35Å
84	V	97.4	Very high	95.6	Very high	106 Å²	106	54.1 Å²	54.1	64%	0.642	28%	0.28	S	S	*	.	S	Bend	trans	-121.7	70.3	172.6	-174.1	0	0	0	0	108.1	D110	V84-D110 PolarHBondContact N-OD2 2.98Å; V84-D110 WeakPolarHBondContact O-CB 3.47Å
85	G	97.4	Very high	94.7	Very high	10 Å²	10	49.1 Å²	49.1	10%	0.103	26%	0.259	C	S	.	.	S	Bend	trans	151.8	170	-177.8	0	0	0	0	0	111.4	E64 I87	E64-G85 WeakPolarHBondContact OE1-CA 3.42Å; E64-G85 PolarHBondContact OE1-N 2.64Å; G85-I87 PolarHBondContact O-N 3.09Å
86	T	98.4	Very high	93.6	Very high	25 Å²	25	50 Å²	50	15%	0.153	27%	0.266	C	S	.	.			trans	-54.7	131.2	-178.3	-61.9	0	0	0	0	111.9	T48 S62 R88 G108 D109	T48-T86 HydrophobicContact CG2-CG2 3.71Å; S62-T86 WeakPolarHBondContact CA-OG1 3.48Å; T86-R88 PolarHBondContact O-N 3.43Å; T86-G108 CarbonylContact O-C 3.6Å; T86-G108 VanDerWaalsContact O-CA 3.28Å; T86-G108 WeakPolarHBondContact O-CA 3.49Å; T86-D109 WeakPolarHBondContact CB-OD2 3.09Å; T86-D109 PolarHBondContact O-N 3.35Å
87	I	98.7	Very high	92.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	112.6	176.3	-59	152.1	0	0	0	108.3	T48 T49 S61 I65 I66 H83 G85 L90 A107	T48-I87 WeakPolarHBondContact CB-O 3.42Å; T48-I87 PolarHBondContact OG1-O 2.98Å; T49-I87 HydrophobicContact CG2-CB 4.41Å; T49-I87 HydrophobicContact CG2-CG2 3.71Å; S61-I87 PolarHBondContact O-N 3.48Å; I65-I87 WeakPolarHBondContact O-CD1 3.49Å; I66-I87 HydrophobicContact CB-CD1 4.49Å; I66-I87 HydrophobicContact CG1-CD1 3.51Å; I66-I87 HydrophobicContact CG1-CG1 4.39Å; H83-I87 HydrophobicContact CB-CG1 4.28Å; G85-I87 PolarHBondContact O-N 3.09Å; I87-L90 HydrophobicContact CG2-CD2 4.24Å; I87-L90 HydrophobicContact CG2-CG 4.19Å; I87-A107 CarbonylContact C-O 3.57Å
88	R	97.8	Very high	91.1	Very high	98 Å²	98	59 Å²	59	37%	0.37	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-34.8	-173.9	-67.3	-66.9	177.4	170.4	-3.9	113.5	T86 A107 D109 V147	T86-R88 PolarHBondContact O-N 3.43Å; R88-A107 PolarHBondContact N-O 2.93Å; R88-D109 IonicContact CZ-OD1 3.67Å; R88-D109 VanDerWaalsContact CZ-OD1 3.26Å; R88-D109 IonicContact CZ-OD2 3.74Å; R88-D109 IonicContact NE-OD1 3.17Å; R88-D109 PolarHBondContact NE-OD1 2.94Å; R88-D109 IonicContact NE-OD2 3.73Å; R88-D109 PolarHBondContact NE-OD2 3.05Å; R88-D109 VanDerWaalsContact NH2-CG 3.32Å; R88-D109 IonicContact NH2-OD1 3.01Å; R88-D109 PolarHBondContact NH2-OD1 3Å; R88-D109 IonicContact NH2-OD2 3.12Å; R88-D109 PolarHBondContact NH2-OD2 2.95Å; R88-V147 WeakPolarHBondContact CB-O 3.18Å
89	Q	97.9	Very high	90.4	Very high	40 Å²	40	59.2 Å²	59.2	19%	0.187	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	138.1	-178.8	-163.6	168.7	-3.4	0	0	112.4	T49 S106 A107 S149 I150	T49-Q89 WeakPolarHBondContact OG1-CA 3.32Å; Q89-S106 CarbonylContact O-C 3.56Å; Q89-S106 WeakPolarHBondContact O-CA 3.39Å; Q89-A107 HydrophobicContact CB-CB 4.45Å; Q89-A107 PolarHBondContact N-O 3.18Å; Q89-A107 PolarHBondContact O-N 2.73Å; Q89-S149 PolarHBondContact OE1-OG 2.81Å; Q89-I150 HydrophobicContact CB-CG1 4.17Å; Q89-I150 HydrophobicContact CG-CG1 4.05Å; Q89-I150 PolarHBondContact NE2-O 3.19Å; Q89-I150 PolarHBondContact OE1-O 2.75Å
90	L	98.5	Very high	89.8	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.026	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137	167.6	-68.6	170	0	0	0	109.1	T49 A51 I58 G60 I66 I87 F104 F105	T49-L90 HydrophobicContact CG2-CB 4.15Å; T49-L90 HydrophobicContact CG2-CD1 3.88Å; T49-L90 HydrophobicContact CG2-CG 3.64Å; T49-L90 PolarHBondContact OG1-N 3.02Å; A51-L90 HydrophobicContact CB-CB 3.88Å; I58-L90 HydrophobicContact CB-CD1 4.23Å; I58-L90 HydrophobicContact CD1-CB 4.14Å; I58-L90 HydrophobicContact CD1-CD1 4.09Å; I58-L90 HydrophobicContact CD1-CD2 4.18Å; I58-L90 HydrophobicContact CD1-CG 4.37Å; I58-L90 HydrophobicContact CG1-CB 4.43Å; I58-L90 HydrophobicContact CG1-CD1 3.91Å; G60-L90 VanDerWaalsContact N-CD1 3.33Å; I66-L90 HydrophobicContact CD1-CD2 3.84Å; I66-L90 HydrophobicContact CG1-CD2 4.18Å; I66-L90 HydrophobicContact CG2-CD1 4.16Å; I66-L90 HydrophobicContact CG2-CD2 4.43Å; I87-L90 HydrophobicContact CG2-CD2 4.24Å; I87-L90 HydrophobicContact CG2-CG 4.19Å; L90-F104 HydrophobicContact CD2-CD2 4.04Å; L90-F104 HydrophobicContact CD2-CE2 3.83Å; L90-F105 WeakPolarHBondContact CA-O 3.28Å
91	K	97.3	Very high	89.3	Confident	96 Å²	96	63.3 Å²	63.3	42%	0.417	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	113	178.7	-167.5	68.3	174.5	-175.4	0	111.1	F104 F105 I150 V152	K91-F104 CarbonylContact O-C 3.44Å; K91-F104 VanDerWaalsContact O-CA 3.27Å; K91-F104 WeakPolarHBondContact O-CA 3.35Å; K91-F104 WeakPolarHBondContact O-CB 3.35Å; K91-F105 PolarHBondContact N-O 3.23Å; K91-F105 PolarHBondContact O-N 3.33Å; K91-I150 HydrophobicContact CB-CD1 4.29Å; K91-V152 HydrophobicContact CG-CG2 4.09Å
92	F	95.6	Very high	89.1	Confident	21 Å²	21	56 Å²	56	9%	0.092	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	149.4	164.5	-76.5	-73.5	0	0	0	110.7	A51 K53 V56 I58 F104 L125 W134	A51-F92 HydrophobicContact CB-CD2 3.76Å; A51-F92 HydrophobicContact CB-CE2 4.03Å; K53-F92 HydrophobicContact CB-CB 4.28Å; K53-F92 HydrophobicContact CB-CD1 3.98Å; K53-F92 HydrophobicContact CB-CD2 3.57Å; K53-F92 HydrophobicContact CB-CE1 4.21Å; K53-F92 HydrophobicContact CB-CE2 3.79Å; K53-F92 HydrophobicContact CB-CG 3.68Å; K53-F92 HydrophobicContact CB-CZ 4.12Å; K53-F92 HydrophobicContact CD-CB 4.02Å; K53-F92 HydrophobicContact CD-CD1 3.71Å; K53-F92 HydrophobicContact CD-CE1 4.35Å; K53-F92 HydrophobicContact CD-CG 3.87Å; K53-F92 HydrophobicContact CG-CG 4.47Å; V56-F92 HydrophobicContact CG1-CZ 4.18Å; I58-F92 HydrophobicContact CD1-CD2 4.41Å; I58-F92 HydrophobicContact CD1-CE1 4.36Å; I58-F92 HydrophobicContact CD1-CE2 3.72Å; I58-F92 HydrophobicContact CD1-CZ 3.68Å; I58-F92 HydrophobicContact CG1-CE2 3.69Å; I58-F92 HydrophobicContact CG1-CZ 3.92Å; I58-F92 HydrophobicContact CG2-CZ 4.2Å; F92-F104 HydrophobicContact CD1-CB 3.61Å; F92-F104 HydrophobicContact CD1-CD1 4.43Å; F92-F104 HydrophobicContact CD1-CG 4.43Å; F92-F104 HydrophobicContact CE1-CB 3.91Å; F92-F104 AromaticContact CE1-CD1 3.87Å; F92-F104 HydrophobicContact CE1-CD1 3.87Å; F92-F104 HydrophobicContact CE1-CG 4.24Å; F92-F104 HydrophobicContact CG-CB 4.09Å; F92-F104 HydrophobicContact CZ-CD1 4.41Å; F92-L125 HydrophobicContact CE1-CD1 4.18Å; F92-W134 AromaticContact CE1-CH2 3.92Å; F92-W134 HydrophobicContact CE1-CH2 3.92Å; F92-W134 HydrophobicContact CE1-CZ2 4.23Å
93	I	91.4	Very high	88.9	Confident	16 Å²	16	56.2 Å²	56.2	8%	0.082	30%	0.297	C	S	.	.			trans	-93.8	160.9	165.8	71.9	175.4	0	0	0	110.7	K53 E95 H103 F105 V152 N156	K53-I93 PolarHBondContact NZ-O 2.96Å; I93-E95 HydrophobicContact CD1-CG 3.68Å; I93-E95 VanDerWaalsContact CG1-CD 3.47Å; I93-E95 HydrophobicContact CG1-CG 3.68Å; I93-E95 WeakPolarHBondContact CG1-OE1 3.42Å; I93-H103 HydrophobicContact CD1-CB 3.67Å; I93-H103 HydrophobicContact CG1-CB 3.96Å; I93-H103 PolarHBondContact N-O 3.12Å; I93-H103 VanDerWaalsContact N-O 3.16Å; I93-F105 HydrophobicContact CG2-CD2 3.87Å; I93-F105 HydrophobicContact CG2-CE2 3.35Å; I93-F105 HydrophobicContact CG2-CZ 4.37Å; I93-V152 HydrophobicContact CG2-CG1 3.89Å; I93-V152 HydrophobicContact CG2-CG2 4.21Å; I93-N156 HydrophobicContact CD1-CB 4.42Å
94	T	81.3	Confident	88.8	Confident	118 Å²	118	55.8 Å²	55.8	72%	0.724	30%	0.295	S	S	*	.			trans	-100.8	91	171.4	-53.5	0	0	0	0	107.6	N156	T94-N156 PolarHBondContact O-ND2 3.48Å
95	E	75.3	Confident	88.9	Confident	21 Å²	21	51 Å²	51	10%	0.098	27%	0.265	C	S	.	.			trans	-71.9	153.7	178	-49.5	80.4	-178.8	0	0	110.6	K53 I93 C102 H103	K53-E95 IonicContact NZ-OE1 3.19Å; K53-E95 PolarHBondContact NZ-OE1 3.21Å; K53-E95 VanDerWaalsContact NZ-OE1 3.13Å; K53-E95 IonicContact NZ-OE2 3.8Å; K53-E95 PolarHBondContact NZ-OE2 2.85Å; I93-E95 HydrophobicContact CD1-CG 3.68Å; I93-E95 VanDerWaalsContact CG1-CD 3.47Å; I93-E95 HydrophobicContact CG1-CG 3.68Å; I93-E95 WeakPolarHBondContact CG1-OE1 3.42Å; E95-C102 VanDerWaalsContact OE1-CA 3.27Å; E95-C102 WeakPolarHBondContact OE1-CA 3.43Å; E95-C102 PolarHBondContact OE1-SG 3.3Å; E95-H103 PolarHBondContact OE1-N 2.77Å
96	P	71.6	Confident	88.9	Confident	91 Å²	91	50.5 Å²	50.5	59%	0.591	26%	0.261	S	S	*	.			trans	-59.8	153.4	168	25.4	-34.5	0	0	0	111.3	D98 S99	P96-D98 PolarHBondContact O-N 3.36Å; P96-S99 WeakPolarHBondContact O-CB 3.49Å; P96-S99 PolarHBondContact O-N 3.35Å
97	H	66.6	Low	88.9	Confident	181 Å²	181	49.3 Å²	49.3	84%	0.838	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-17.8	-179	-74.9	-62.9	0	0	0	115.3	G122	H97-G122 CarbonylContact O-C 3.29Å; H97-G122 VanDerWaalsContact O-CA 3.27Å; H97-G122 WeakPolarHBondContact O-CA 3.29Å
98	D	68.4	Low	88.9	Confident	157 Å²	157	49.3 Å²	49.3	84%	0.84	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	11.4	179.8	-162.3	25.7	0	0	0	113.2	P96 A100	P96-D98 PolarHBondContact O-N 3.36Å; D98-A100 PolarHBondContact O-N 3.24Å
99	S	81.1	Confident	88.9	Confident	22 Å²	22	47 Å²	47	15%	0.154	25%	0.248	C	C	.	.			trans	-70.4	131.9	177	-172.4	0	0	0	0	110.8	P96 Y101 G122 G123	P96-S99 WeakPolarHBondContact O-CB 3.49Å; P96-S99 PolarHBondContact O-N 3.35Å; S99-Y101 WeakPolarHBondContact CB-O 3.38Å; S99-Y101 PolarHBondContact O-N 2.86Å; S99-Y101 PolarHBondContact OG-N 3.14Å; S99-Y101 PolarHBondContact OG-O 2.91Å; S99-G122 CarbonylContact O-C 3.26Å; S99-G122 VanDerWaalsContact O-C 3.29Å; S99-G122 VanDerWaalsContact O-CA 3.26Å; S99-G122 WeakPolarHBondContact O-CA 3.49Å; S99-G122 PolarHBondContact O-N 3.11Å; S99-G123 PolarHBondContact O-N 3.28Å
100	A	83.3	Confident	88.9	Confident	48 Å²	48	47.1 Å²	47.1	40%	0.397	25%	0.25	S	S	.	.	S	Bend	trans	-75.6	-9	170.8	0	0	0	0	0	113	D98 S120	D98-A100 PolarHBondContact O-N 3.24Å; A100-S120 CarbonylContact C-O 3.59Å; A100-S120 VanDerWaalsContact C-O 3.29Å; A100-S120 CarbonylContact O-C 3.52Å; A100-S120 VanDerWaalsContact O-C 3.26Å; A100-S120 PolarHBondContact O-N 2.9Å
101	Y	87.5	Confident	88.8	Confident	86 Å²	86	47 Å²	47	34%	0.337	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	151.8	-170.9	-60.2	-76.3	0	0	0	111.7	S99 R117 C118 E119	S99-Y101 WeakPolarHBondContact CB-O 3.38Å; S99-Y101 PolarHBondContact O-N 2.86Å; S99-Y101 PolarHBondContact OG-N 3.14Å; S99-Y101 PolarHBondContact OG-O 2.91Å; Y101-R117 VanDerWaalsContact CD1-CD 3.47Å; Y101-R117 HydrophobicContact CD1-CG 3.55Å; Y101-R117 HydrophobicContact CE1-CG 4.33Å; Y101-R117 HydrophobicContact CG-CG 3.89Å; Y101-C118 CarbonylContact C-O 3.53Å; Y101-C118 VanDerWaalsContact CA-O 3.28Å; Y101-C118 WeakPolarHBondContact CA-O 3.49Å; Y101-E119 HydrophobicContact CD1-CB 4.15Å; Y101-E119 HydrophobicContact CD1-CG 4.45Å; Y101-E119 HydrophobicContact CE1-CB 4.01Å; Y101-E119 HydrophobicContact CE1-CG 4.11Å
102	C	90.3	Very high	88.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	142.7	161.4	-173.9	0	0	0	0	109.5	K53 E95 R117 C118 L125 W134	K53-C102 PolarHBondContact NZ-SG 2.83Å; E95-C102 VanDerWaalsContact OE1-CA 3.27Å; E95-C102 WeakPolarHBondContact OE1-CA 3.43Å; E95-C102 PolarHBondContact OE1-SG 3.3Å; C102-R117 WeakPolarHBondContact O-CA 3.46Å; C102-C118 PolarHBondContact N-O 2.79Å; C102-C118 PolarHBondContact O-N 3.28Å; C102-L125 HydrophobicContact CB-CD1 4.21Å; C102-L125 HydrophobicContact CB-CD2 3.99Å; C102-L125 HydrophobicContact CB-CG 4.07Å; C102-W134 HydrophobicContact CB-CH2 4.07Å
103	H	93.4	Very high	88.9	Confident	30 Å²	30	41.4 Å²	41.4	14%	0.139	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.5	173.7	-49.3	90.4	0	0	0	112.8	I93 E95 W116 R117	I93-H103 HydrophobicContact CD1-CB 3.67Å; I93-H103 HydrophobicContact CG1-CB 3.96Å; I93-H103 PolarHBondContact N-O 3.12Å; I93-H103 VanDerWaalsContact N-O 3.16Å; E95-H103 PolarHBondContact OE1-N 2.77Å; H103-W116 WeakPolarHBondContact CA-O 2.92Å; H103-W116 WeakPolarHBondContact CB-O 3.43Å; H103-R117 PolarHBondContact NE2-NE 3.01Å
104	F	96.5	Very high	89.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	160.8	161.3	73	-94.7	0	0	0	110.8	I58 I66 L80 L90 K91 F92 W116 W134	I58-F104 HydrophobicContact CD1-CB 4.23Å; I58-F104 HydrophobicContact CD1-CD1 3.86Å; I58-F104 HydrophobicContact CD1-CD2 3.52Å; I58-F104 HydrophobicContact CD1-CE1 4.04Å; I58-F104 HydrophobicContact CD1-CE2 3.73Å; I58-F104 HydrophobicContact CD1-CG 3.61Å; I58-F104 HydrophobicContact CD1-CZ 3.99Å; I66-F104 HydrophobicContact CD1-CE2 4.18Å; L80-F104 HydrophobicContact CD1-CE1 4.27Å; L80-F104 HydrophobicContact CD1-CZ 3.77Å; L90-F104 HydrophobicContact CD2-CD2 4.04Å; L90-F104 HydrophobicContact CD2-CE2 3.83Å; K91-F104 CarbonylContact O-C 3.44Å; K91-F104 VanDerWaalsContact O-CA 3.27Å; K91-F104 WeakPolarHBondContact O-CA 3.35Å; K91-F104 WeakPolarHBondContact O-CB 3.35Å; F92-F104 HydrophobicContact CD1-CB 3.61Å; F92-F104 HydrophobicContact CD1-CD1 4.43Å; F92-F104 HydrophobicContact CD1-CG 4.43Å; F92-F104 HydrophobicContact CE1-CB 3.91Å; F92-F104 AromaticContact CE1-CD1 3.87Å; F92-F104 HydrophobicContact CE1-CD1 3.87Å; F92-F104 HydrophobicContact CE1-CG 4.24Å; F92-F104 HydrophobicContact CG-CB 4.09Å; F92-F104 HydrophobicContact CZ-CD1 4.41Å; F104-W116 HydrophobicContact CD1-CB 3.71Å; F104-W116 HydrophobicContact CD1-CG 4.37Å; F104-W116 HydrophobicContact CD2-CB 4.11Å; F104-W116 AromaticContact CD2-CD1 3.63Å; F104-W116 HydrophobicContact CD2-CG 4.06Å; F104-W116 HydrophobicContact CE1-CB 3.38Å; F104-W116 AromaticContact CE1-CG 3.79Å; F104-W116 HydrophobicContact CE1-CG 3.79Å; F104-W116 HydrophobicContact CE2-CB 3.82Å; F104-W116 AromaticContact CE2-CD1 3.1Å; F104-W116 HydrophobicContact CE2-CD2 4.15Å; F104-W116 AromaticContact CE2-CG 3.42Å; F104-W116 HydrophobicContact CE2-CG 3.42Å; F104-W116 VanDerWaalsContact CE2-CG 3.42Å; F104-W116 AromaticContact CE2-NE1 3.66Å; F104-W116 HydrophobicContact CG-CB 4.05Å; F104-W116 HydrophobicContact CG-CG 4.48Å; F104-W116 HydrophobicContact CZ-CB 3.43Å; F104-W116 VanDerWaalsContact CZ-CB 3.43Å; F104-W116 AromaticContact CZ-CD1 3.49Å; F104-W116 VanDerWaalsContact CZ-CD1 3.49Å; F104-W116 AromaticContact CZ-CD2 3.78Å; F104-W116 HydrophobicContact CZ-CD2 3.78Å; F104-W116 HydrophobicContact CZ-CE3 4.49Å; F104-W116 AromaticContact CZ-CG 3.25Å; F104-W116 HydrophobicContact CZ-CG 3.25Å; F104-W116 PolarHBondContact N-O 2.83Å; F104-W116 PolarHBondContact O-N 2.78Å; F104-W134 HydrophobicContact CD1-CD2 4.39Å; F104-W134 AromaticContact CD1-CE3 3.77Å; F104-W134 HydrophobicContact CD1-CE3 3.77Å; F104-W134 AromaticContact CD1-CH2 3.71Å; F104-W134 HydrophobicContact CD1-CH2 3.71Å; F104-W134 HydrophobicContact CD1-CZ2 4.31Å; F104-W134 AromaticContact CD1-CZ3 3.4Å; F104-W134 HydrophobicContact CD1-CZ3 3.4Å; F104-W134 VanDerWaalsContact CD1-CZ3 3.4Å; F104-W134 AromaticContact CE1-CD2 3.78Å; F104-W134 HydrophobicContact CE1-CD2 3.78Å; F104-W134 AromaticContact CE1-CE3 3.45Å; F104-W134 HydrophobicContact CE1-CE3 3.45Å; F104-W134 VanDerWaalsContact CE1-CE3 3.45Å; F104-W134 HydrophobicContact CE1-CH2 4.07Å; F104-W134 HydrophobicContact CE1-CZ2 4.34Å; F104-W134 AromaticContact CE1-CZ3 3.62Å; F104-W134 HydrophobicContact CE1-CZ3 3.62Å
105	F	98	Very high	89.9	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.026	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	142.2	174.3	-61.4	-80.4	0	0	0	110.6	L90 K91 I93 I113 G114 I115 I150 V152 L159 L173	L90-F105 WeakPolarHBondContact CA-O 3.28Å; K91-F105 PolarHBondContact N-O 3.23Å; K91-F105 PolarHBondContact O-N 3.33Å; I93-F105 HydrophobicContact CG2-CD2 3.87Å; I93-F105 HydrophobicContact CG2-CE2 3.35Å; I93-F105 HydrophobicContact CG2-CZ 4.37Å; F105-I113 HydrophobicContact CD1-CG2 4.3Å; F105-G114 VanDerWaalsContact CA-O 3.29Å; F105-G114 WeakPolarHBondContact CA-O 3.26Å; F105-I115 HydrophobicContact CD1-CB 4.37Å; F105-I115 HydrophobicContact CD1-CG1 3.86Å; F105-I115 HydrophobicContact CD1-CG2 4.32Å; F105-I115 HydrophobicContact CE1-CB 4.23Å; F105-I115 HydrophobicContact CE1-CD1 3.84Å; F105-I115 HydrophobicContact CE1-CG1 3.65Å; F105-I115 HydrophobicContact CE1-CG2 3.88Å; F105-I150 HydrophobicContact CB-CD1 3.51Å; F105-V152 HydrophobicContact CD2-CG2 3.52Å; F105-V152 HydrophobicContact CE2-CG1 4.2Å; F105-V152 HydrophobicContact CE2-CG2 3.63Å; F105-L159 HydrophobicContact CD1-CD2 4.14Å; F105-L159 HydrophobicContact CD2-CD1 4.18Å; F105-L159 HydrophobicContact CE1-CD2 4.27Å; F105-L159 HydrophobicContact CE2-CD1 4.36Å; F105-L159 HydrophobicContact CG-CD1 4.3Å; F105-L173 HydrophobicContact CE1-CD2 3.73Å; F105-L173 HydrophobicContact CE2-CD1 4.22Å; F105-L173 HydrophobicContact CZ-CD1 3.65Å; F105-L173 HydrophobicContact CZ-CD2 3.61Å; F105-L173 HydrophobicContact CZ-CG 4.28Å
106	S	98.6	Very high	90.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141.8	167.8	64	0	0	0	0	109.7	H83 Q89 I113 G114 W116	H83-S106 PolarHBondContact CD2-OG 2.51Å; H83-S106 VanDerWaalsContact NE2-CB 3.27Å; H83-S106 WeakPolarHBondContact NE2-CB 3.34Å; H83-S106 PolarHBondContact NE2-OG 2.77Å; Q89-S106 CarbonylContact O-C 3.56Å; Q89-S106 WeakPolarHBondContact O-CA 3.39Å; S106-I113 CarbonylContact O-C 3.57Å; S106-I113 WeakPolarHBondContact O-CA 2.96Å; S106-I113 WeakPolarHBondContact O-CG2 3.04Å; S106-G114 PolarHBondContact N-O 3.14Å; S106-G114 PolarHBondContact O-N 3.49Å; S106-W116 PolarHBondContact OG-NE1 3.36Å
107	A	98.2	Very high	92	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.5	176.2	0	0	0	0	0	109.1	I87 R88 Q89 V147 I150	I87-A107 CarbonylContact C-O 3.57Å; R88-A107 PolarHBondContact N-O 2.93Å; Q89-A107 HydrophobicContact CB-CB 4.45Å; Q89-A107 PolarHBondContact N-O 3.18Å; Q89-A107 PolarHBondContact O-N 2.73Å; A107-V147 HydrophobicContact CB-CB 3.99Å; A107-V147 HydrophobicContact CB-CG1 3.78Å; A107-I150 HydrophobicContact CB-CD1 4.25Å; A107-I150 HydrophobicContact CB-CG1 4.41Å; A107-I150 HydrophobicContact CB-CG2 3.75Å
108	G	97.8	Very high	93.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	172.8	-172.6	0	0	0	0	0	115.2	T86 D110 G111 C112 V147	T86-G108 CarbonylContact O-C 3.6Å; T86-G108 VanDerWaalsContact O-CA 3.28Å; T86-G108 WeakPolarHBondContact O-CA 3.49Å; G108-D110 PolarHBondContact O-N 3.38Å; G108-G111 PolarHBondContact O-N 2.82Å; G108-C112 PolarHBondContact N-O 3.02Å; G108-V147 PolarHBondContact O-N 2.83Å
109	D	97.8	Very high	94.2	Very high	48 Å²	48	25 Å²	25	26%	0.257	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.9	173.5	-84.5	-9.6	0	0	0	113.9	T86 R88 G111 S146	T86-D109 WeakPolarHBondContact CB-OD2 3.09Å; T86-D109 PolarHBondContact O-N 3.35Å; R88-D109 IonicContact CZ-OD1 3.67Å; R88-D109 VanDerWaalsContact CZ-OD1 3.26Å; R88-D109 IonicContact CZ-OD2 3.74Å; R88-D109 IonicContact NE-OD1 3.17Å; R88-D109 PolarHBondContact NE-OD1 2.94Å; R88-D109 IonicContact NE-OD2 3.73Å; R88-D109 PolarHBondContact NE-OD2 3.05Å; R88-D109 VanDerWaalsContact NH2-CG 3.32Å; R88-D109 IonicContact NH2-OD1 3.01Å; R88-D109 PolarHBondContact NH2-OD1 3Å; R88-D109 IonicContact NH2-OD2 3.12Å; R88-D109 PolarHBondContact NH2-OD2 2.95Å; D109-G111 PolarHBondContact O-N 3.24Å; D109-G111 VanDerWaalsContact O-N 3.12Å; D109-S146 WeakPolarHBondContact O-CA 3.19Å; D109-S146 WeakPolarHBondContact OD1-CB 3.38Å; D109-S146 PolarHBondContact OD1-OG 2.92Å
110	D	98	Very high	94.3	Very high	44 Å²	44	24.4 Å²	24.4	24%	0.235	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-0.8	174	63.9	-7.2	0	0	0	114.3	H83 V84 G108 C112	H83-D110 WeakPolarHBondContact CA-OD2 3.4Å; H83-D110 IonicContact CE1-OD1 2.78Å; H83-D110 IonicContact CE1-OD2 2.7Å; H83-D110 IonicContact CG-OD2 3.66Å; H83-D110 VanDerWaalsContact ND1-CG 3.29Å; H83-D110 IonicContact ND1-OD1 3.07Å; H83-D110 PolarHBondContact ND1-OD1 3.36Å; H83-D110 IonicContact ND1-OD2 2.84Å; H83-D110 PolarHBondContact ND1-OD2 3Å; V84-D110 PolarHBondContact N-OD2 2.98Å; V84-D110 WeakPolarHBondContact O-CB 3.47Å; G108-D110 PolarHBondContact O-N 3.38Å; D110-C112 PolarHBondContact O-N 2.86Å; D110-C112 WeakPolarHBondContact OD1-CB 3.21Å; D110-C112 PolarHBondContact OD1-N 2.83Å; D110-C112 VanDerWaalsContact OD2-CB 3.23Å; D110-C112 WeakPolarHBondContact OD2-CB 3.42Å
111	G	96.9	Very high	93.8	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.01	14%	0.135	C	C	.	.	S	Bend	trans	71.6	10.7	-176	0	0	0	0	0	113.3	G108 D109 G145	G108-G111 PolarHBondContact O-N 2.82Å; D109-G111 PolarHBondContact O-N 3.24Å; D109-G111 VanDerWaalsContact O-N 3.12Å; G111-G145 VanDerWaalsContact CA-O 3.27Å; G111-G145 WeakPolarHBondContact CA-O 3.34Å
112	C	97.7	Very high	93.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	145.4	-179.5	-165.7	0	0	0	0	110.8	H83 G108 D110 I140 R141	H83-C112 PolarHBondContact CE1-O 3.35Å; G108-C112 PolarHBondContact N-O 3.02Å; D110-C112 PolarHBondContact O-N 2.86Å; D110-C112 WeakPolarHBondContact OD1-CB 3.21Å; D110-C112 PolarHBondContact OD1-N 2.83Å; D110-C112 VanDerWaalsContact OD2-CB 3.23Å; D110-C112 WeakPolarHBondContact OD2-CB 3.42Å; C112-I140 WeakPolarHBondContact CA-O 3.48Å; C112-R141 HydrophobicContact CB-CG 4.12Å
113	I	98.1	Very high	92.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.8	160.8	-55.2	169.3	0	0	0	107.7	F105 S106 I140 V147 I150 L159 W171	F105-I113 HydrophobicContact CD1-CG2 4.3Å; S106-I113 CarbonylContact O-C 3.57Å; S106-I113 WeakPolarHBondContact O-CA 2.96Å; S106-I113 WeakPolarHBondContact O-CG2 3.04Å; I113-I140 HydrophobicContact CB-CB 4.17Å; I113-I140 PolarHBondContact N-O 2.93Å; I113-I140 PolarHBondContact O-N 2.77Å; I113-V147 HydrophobicContact CD1-CG1 4.17Å; I113-V147 HydrophobicContact CG1-CG1 4.07Å; I113-V147 HydrophobicContact CG1-CG2 4.11Å; I113-I150 HydrophobicContact CD1-CG2 4.06Å; I113-I150 HydrophobicContact CG1-CG2 4.39Å; I113-L159 HydrophobicContact CD1-CD2 4.18Å; I113-L159 HydrophobicContact CG2-CD2 3.96Å; I113-W171 HydrophobicContact CD1-CZ2 4.38Å
114	G	97.4	Very high	91.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	137.9	173.1	0	0	0	0	0	111	F105 S106	F105-G114 VanDerWaalsContact CA-O 3.29Å; F105-G114 WeakPolarHBondContact CA-O 3.26Å; S106-G114 PolarHBondContact N-O 3.14Å; S106-G114 PolarHBondContact O-N 3.49Å
115	I	96.3	Very high	90.6	Very high	17 Å²	17	28.7 Å²	28.7	9%	0.087	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.7	167.3	-46.7	-172.5	0	0	0	107.5	F105 C136 I137 R138 I140 L173	F105-I115 HydrophobicContact CD1-CB 4.37Å; F105-I115 HydrophobicContact CD1-CG1 3.86Å; F105-I115 HydrophobicContact CD1-CG2 4.32Å; F105-I115 HydrophobicContact CE1-CB 4.23Å; F105-I115 HydrophobicContact CE1-CD1 3.84Å; F105-I115 HydrophobicContact CE1-CG1 3.65Å; F105-I115 HydrophobicContact CE1-CG2 3.88Å; I115-C136 CarbonylContact O-C 3.43Å; I115-C136 WeakPolarHBondContact O-CA 3.04Å; I115-I137 HydrophobicContact CB-CD1 4.43Å; I115-I137 HydrophobicContact CB-CG1 3.95Å; I115-I137 HydrophobicContact CG2-CD1 3.82Å; I115-I137 HydrophobicContact CG2-CG1 3.84Å; I115-I137 WeakPolarHBondContact O-CG1 2.96Å; I115-I137 PolarHBondContact O-N 3.38Å; I115-R138 HydrophobicContact CB-CB 4.06Å; I115-R138 HydrophobicContact CD1-CB 3.84Å; I115-R138 HydrophobicContact CD1-CG 4.2Å; I115-R138 HydrophobicContact CG1-CB 3.92Å; I115-R138 PolarHBondContact N-O 3.17Å; I115-I140 HydrophobicContact CD1-CD1 4.07Å; I115-I140 HydrophobicContact CG1-CD1 4.36Å; I115-L173 HydrophobicContact CD1-CD2 4.49Å
116	W	96.6	Very high	89.4	Confident	9 Å²	9	33.6 Å²	33.6	3%	0.034	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.7	-178.3	-59.5	87.3	0	0	0	109.6	I66 L80 M82 H103 F104 S106 W134 E135 C136	I66-W116 HydrophobicContact CD1-CZ2 3.99Å; L80-W116 HydrophobicContact CB-CH2 3.67Å; L80-W116 HydrophobicContact CB-CZ2 4.36Å; L80-W116 HydrophobicContact CB-CZ3 3.76Å; L80-W116 HydrophobicContact CD1-CD2 4.33Å; L80-W116 HydrophobicContact CD1-CE3 3.9Å; L80-W116 HydrophobicContact CD1-CH2 4.47Å; L80-W116 HydrophobicContact CD1-CZ3 3.97Å; L80-W116 HydrophobicContact CD2-CZ3 4.28Å; L80-W116 HydrophobicContact CG-CZ3 4.22Å; M82-W116 HydrophobicContact CB-CH2 3.73Å; M82-W116 HydrophobicContact CB-CZ2 3.71Å; M82-W116 HydrophobicContact CE-CZ2 4.14Å; M82-W116 HydrophobicContact CG-CH2 4.46Å; M82-W116 HydrophobicContact CG-CZ2 4.28Å; M82-W116 HydrophobicContact SD-CH2 4.41Å; M82-W116 HydrophobicContact SD-CZ2 3.8Å; H103-W116 WeakPolarHBondContact CA-O 2.92Å; H103-W116 WeakPolarHBondContact CB-O 3.43Å; F104-W116 HydrophobicContact CD1-CB 3.71Å; F104-W116 HydrophobicContact CD1-CG 4.37Å; F104-W116 HydrophobicContact CD2-CB 4.11Å; F104-W116 AromaticContact CD2-CD1 3.63Å; F104-W116 HydrophobicContact CD2-CG 4.06Å; F104-W116 HydrophobicContact CE1-CB 3.38Å; F104-W116 AromaticContact CE1-CG 3.79Å; F104-W116 HydrophobicContact CE1-CG 3.79Å; F104-W116 HydrophobicContact CE2-CB 3.82Å; F104-W116 AromaticContact CE2-CD1 3.1Å; F104-W116 HydrophobicContact CE2-CD2 4.15Å; F104-W116 AromaticContact CE2-CG 3.42Å; F104-W116 HydrophobicContact CE2-CG 3.42Å; F104-W116 VanDerWaalsContact CE2-CG 3.42Å; F104-W116 AromaticContact CE2-NE1 3.66Å; F104-W116 HydrophobicContact CG-CB 4.05Å; F104-W116 HydrophobicContact CG-CG 4.48Å; F104-W116 HydrophobicContact CZ-CB 3.43Å; F104-W116 VanDerWaalsContact CZ-CB 3.43Å; F104-W116 AromaticContact CZ-CD1 3.49Å; F104-W116 VanDerWaalsContact CZ-CD1 3.49Å; F104-W116 AromaticContact CZ-CD2 3.78Å; F104-W116 HydrophobicContact CZ-CD2 3.78Å; F104-W116 HydrophobicContact CZ-CE3 4.49Å; F104-W116 AromaticContact CZ-CG 3.25Å; F104-W116 HydrophobicContact CZ-CG 3.25Å; F104-W116 PolarHBondContact N-O 2.83Å; F104-W116 PolarHBondContact O-N 2.78Å; S106-W116 PolarHBondContact OG-NE1 3.36Å; W116-W134 HydrophobicContact CB-CE3 4Å; W116-W134 HydrophobicContact CB-CZ3 4.4Å; W116-E135 WeakPolarHBondContact CA-O 3.01Å; W116-C136 HydrophobicContact CD2-CB 4.17Å; W116-C136 HydrophobicContact CE3-CB 3.8Å; W116-C136 HydrophobicContact CH2-CB 3.92Å; W116-C136 HydrophobicContact CZ2-CB 4.26Å; W116-C136 HydrophobicContact CZ3-CB 3.67Å
117	R	93.8	Very high	88.3	Confident	75 Å²	75	40.9 Å²	40.9	28%	0.283	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.9	178.1	-179.7	-175.5	-64.1	169.9	-9	109	Y101 C102 H103 W134 E135 I137	Y101-R117 VanDerWaalsContact CD1-CD 3.47Å; Y101-R117 HydrophobicContact CD1-CG 3.55Å; Y101-R117 HydrophobicContact CE1-CG 4.33Å; Y101-R117 HydrophobicContact CG-CG 3.89Å; C102-R117 WeakPolarHBondContact O-CA 3.46Å; H103-R117 PolarHBondContact NE2-NE 3.01Å; R117-W134 VanDerWaalsContact C-CE3 3.49Å; R117-W134 WeakPolarHBondContact O-CA 3.29Å; R117-E135 HydrophobicContact CB-CG 4.1Å; R117-E135 WeakPolarHBondContact CD-OE1 3.29Å; R117-E135 PolarHBondContact N-O 3.37Å; R117-E135 IonicContact NH1-OE1 3.67Å; R117-E135 WeakPolarHBondContact O-CG 3.46Å; R117-E135 PolarHBondContact O-N 2.79Å; R117-I137 HydrophobicContact CB-CD1 4.23Å; R117-I137 HydrophobicContact CB-CG1 4.46Å; R117-I137 HydrophobicContact CB-CG2 3.7Å
118	C	93	Very high	87.3	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.1	163.6	-176.7	0	0	0	0	109	Y101 C102 S120 P129 W134	Y101-C118 CarbonylContact C-O 3.53Å; Y101-C118 VanDerWaalsContact CA-O 3.28Å; Y101-C118 WeakPolarHBondContact CA-O 3.49Å; C102-C118 PolarHBondContact N-O 2.79Å; C102-C118 PolarHBondContact O-N 3.28Å; C118-S120 PolarHBondContact O-N 3.06Å; C118-P129 HydrophobicContact CB-CG 4.43Å; C118-P129 VanDerWaalsContact SG-CB 3.54Å; C118-P129 WeakPolarHBondContact SG-CG 3.41Å; C118-W134 HydrophobicContact CB-CD2 3.55Å; C118-W134 HydrophobicContact CB-CE3 3.51Å; C118-W134 HydrophobicContact CB-CG 4.23Å; C118-W134 HydrophobicContact CB-CH2 3.71Å; C118-W134 HydrophobicContact CB-CZ2 3.76Å; C118-W134 HydrophobicContact CB-CZ3 3.59Å
119	E	87.8	Confident	86.4	Confident	137 Å²	137	42.8 Å²	42.8	64%	0.64	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	125.8	168	-167.9	170.5	-169.9	0	0	109.7	Y101	Y101-E119 HydrophobicContact CD1-CB 4.15Å; Y101-E119 HydrophobicContact CD1-CG 4.45Å; Y101-E119 HydrophobicContact CE1-CB 4.01Å; Y101-E119 HydrophobicContact CE1-CG 4.11Å
120	S	82.8	Confident	85.6	Confident	10 Å²	10	46.2 Å²	46.2	7%	0.07	24%	0.238	C	C	.	.			trans	-160.8	90.8	-175.8	178.2	0	0	0	0	106.9	A100 C118 G122 G123 K124	A100-S120 CarbonylContact C-O 3.59Å; A100-S120 VanDerWaalsContact C-O 3.29Å; A100-S120 CarbonylContact O-C 3.52Å; A100-S120 VanDerWaalsContact O-C 3.26Å; A100-S120 PolarHBondContact O-N 2.9Å; C118-S120 PolarHBondContact O-N 3.06Å; S120-G122 PolarHBondContact O-N 2.86Å; S120-G123 PolarHBondContact O-N 3.13Å; S120-K124 PolarHBondContact OG-N 2.68Å; S120-K124 PolarHBondContact OG-O 3.49Å
121	P	73.6	Confident	84.7	Confident	109 Å²	109	44.5 Å²	44.5	71%	0.708	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-53.8	125.5	-179.9	-25.9	34.2	0	0	0	111.1
122	G	72.4	Confident	84	Confident	33 Å²	33	49.2 Å²	49.2	34%	0.34	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	83.5	10	-176.2	0	0	0	0	0	115.4	H97 S99 S120 K124	H97-G122 CarbonylContact O-C 3.29Å; H97-G122 VanDerWaalsContact O-CA 3.27Å; H97-G122 WeakPolarHBondContact O-CA 3.29Å; S99-G122 CarbonylContact O-C 3.26Å; S99-G122 VanDerWaalsContact O-C 3.29Å; S99-G122 VanDerWaalsContact O-CA 3.26Å; S99-G122 WeakPolarHBondContact O-CA 3.49Å; S99-G122 PolarHBondContact O-N 3.11Å; S120-G122 PolarHBondContact O-N 2.86Å; G122-K124 PolarHBondContact O-N 3.32Å; G122-K124 VanDerWaalsContact O-N 3.1Å
123	G	71.4	Confident	83.6	Confident	7 Å²	7	51.2 Å²	51.2	7%	0.072	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	65.6	13	177.4	0	0	0	0	0	114.1	S99 S120	S99-G123 PolarHBondContact O-N 3.28Å; S120-G123 PolarHBondContact O-N 3.13Å
124	K	77.2	Confident	83.4	Confident	104 Å²	104	51.7 Å²	51.7	45%	0.452	28%	0.28	S	S	.	.			trans	-114.9	117.7	-169.5	-154.4	175.5	-169.3	176.2	0	110.3	S120 G122 I126	S120-K124 PolarHBondContact OG-N 2.68Å; S120-K124 PolarHBondContact OG-O 3.49Å; G122-K124 PolarHBondContact O-N 3.32Å; G122-K124 VanDerWaalsContact O-N 3.1Å; K124-I126 HydrophobicContact CB-CG1 4.16Å; K124-I126 HydrophobicContact CD-CD1 4.42Å; K124-I126 HydrophobicContact CD-CG1 4.09Å; K124-I126 HydrophobicContact CG-CG1 3.98Å; K124-I126 PolarHBondContact O-N 2.88Å
125	L	79.8	Confident	83.3	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	30%	0.302	C	S	.	.			trans	-84.6	66.4	-179.5	-63.7	169.9	0	0	0	109.6	K53 D54 D55 V56 F92 C102 K127 P129 W134	K53-L125 HydrophobicContact CD-CD1 4.34Å; K53-L125 HydrophobicContact CG-CD1 4.47Å; D54-L125 HydrophobicContact CB-CB 4.14Å; D54-L125 VanDerWaalsContact CB-O 3.31Å; D54-L125 WeakPolarHBondContact CB-O 3.17Å; D54-L125 PolarHBondContact OD2-N 3.37Å; D55-L125 WeakPolarHBondContact CB-O 3.12Å; D55-L125 PolarHBondContact N-O 2.7Å; V56-L125 HydrophobicContact CB-CD1 4Å; V56-L125 HydrophobicContact CG2-CB 3.87Å; V56-L125 HydrophobicContact CG2-CD1 3.78Å; V56-L125 HydrophobicContact CG2-CG 4.33Å; F92-L125 HydrophobicContact CE1-CD1 4.18Å; C102-L125 HydrophobicContact CB-CD1 4.21Å; C102-L125 HydrophobicContact CB-CD2 3.99Å; C102-L125 HydrophobicContact CB-CG 4.07Å; L125-K127 VanDerWaalsContact C-N 3.27Å; L125-K127 PolarHBondContact O-N 3.23Å; L125-P129 HydrophobicContact CD2-CG 4.18Å; L125-W134 HydrophobicContact CD1-CH2 4.27Å; L125-W134 HydrophobicContact CD1-CZ2 3.95Å; L125-W134 HydrophobicContact CD2-CZ2 4.35Å
126	I	71.7	Confident	83.3	Confident	109 Å²	109	57.4 Å²	57.4	56%	0.559	31%	0.31	S	S	*	.	S	Bend	trans	-62.1	-37.8	-177.5	-60.4	172.9	0	0	0	111	K124	K124-I126 HydrophobicContact CB-CG1 4.16Å; K124-I126 HydrophobicContact CD-CD1 4.42Å; K124-I126 HydrophobicContact CD-CG1 4.09Å; K124-I126 HydrophobicContact CG-CG1 3.98Å; K124-I126 PolarHBondContact O-N 2.88Å
127	K	76.6	Confident	83.2	Confident	152 Å²	152	59.9 Å²	59.9	66%	0.661	32%	0.323	S	S	*	.	S	Bend	trans	-125.5	132.8	170.9	-175	175.6	-178.2	177.9	0	107.5	L125 P129	L125-K127 VanDerWaalsContact C-N 3.27Å; L125-K127 PolarHBondContact O-N 3.23Å; K127-P129 WeakPolarHBondContact O-CD 3.27Å; K127-P129 VanDerWaalsContact O-N 3.15Å
128	C	77.4	Confident	83.2	Confident	14 Å²	14	62.5 Å²	62.5	10%	0.095	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-56.6	122.2	174.6	-172.6	0	0	0	0	110.1	D55 V56 V77	D55-C128 PolarHBondContact OD2-N 2.89Å; V56-C128 HydrophobicContact CG2-CB 3.87Å; V77-C128 HydrophobicContact CG2-CB 4.5Å
129	P	78.8	Confident	83.4	Confident	26 Å²	26	66.3 Å²	66.3	17%	0.169	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-70.5	157.5	174.5	31.8	-35.1	0	0	0	109.5	C118 L125 K127 A133	C118-P129 HydrophobicContact CB-CG 4.43Å; C118-P129 VanDerWaalsContact SG-CB 3.54Å; C118-P129 WeakPolarHBondContact SG-CG 3.41Å; L125-P129 HydrophobicContact CD2-CG 4.18Å; K127-P129 WeakPolarHBondContact O-CD 3.27Å; K127-P129 VanDerWaalsContact O-N 3.15Å; P129-A133 HydrophobicContact CB-CB 3.9Å
130	H	81.3	Confident	83.7	Confident	120 Å²	120	60.4 Å²	60.4	56%	0.556	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-58.7	146.3	172.1	-171.6	-95.1	0	0	0	109.5	S132 A133	H130-S132 WeakPolarHBondContact ND1-CB 3.35Å; H130-S132 PolarHBondContact ND1-N 2.9Å; H130-S132 PolarHBondContact ND1-OG 2.74Å; H130-S132 PolarHBondContact O-N 3.13Å; H130-S132 VanDerWaalsContact O-N 3.13Å; H130-A133 WeakPolarHBondContact O-CB 3.25Å; H130-A133 PolarHBondContact O-N 3.47Å
131	P	77.9	Confident	84.3	Confident	9 Å²	9	66.4 Å²	66.4	6%	0.058	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-57.3	-33.4	-177.1	-22.5	29.8	0	0	0	112.5	V77 G78 L80 A133 W134	V77-P131 HydrophobicContact CB-CG 4.1Å; V77-P131 HydrophobicContact CG1-CG 4.09Å; V77-P131 WeakPolarHBondContact O-CG 3.25Å; G78-P131 VanDerWaalsContact CA-CG 3.43Å; G78-P131 VanDerWaalsContact N-CG 3.32Å; L80-P131 HydrophobicContact CD2-CB 4.31Å; L80-P131 WeakPolarHBondContact CD2-O 3.48Å; P131-A133 PolarHBondContact O-N 2.93Å; P131-A133 VanDerWaalsContact O-N 3.13Å; P131-W134 WeakPolarHBondContact O-CB 3.45Å; P131-W134 PolarHBondContact O-N 3.18Å
132	S	82.8	Confident	85.4	Confident	99 Å²	99	69.2 Å²	69.2	69%	0.692	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-65.1	-11.8	175.5	71.8	0	0	0	0	114.4	H130 W134	H130-S132 WeakPolarHBondContact ND1-CB 3.35Å; H130-S132 PolarHBondContact ND1-N 2.9Å; H130-S132 PolarHBondContact ND1-OG 2.74Å; H130-S132 PolarHBondContact O-N 3.13Å; H130-S132 VanDerWaalsContact O-N 3.13Å; S132-W134 VanDerWaalsContact C-N 3.33Å
133	A	88.4	Confident	86.5	Confident	42 Å²	42	68.2 Å²	68.2	35%	0.347	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-79.5	-18.6	172.5	0	0	0	0	0	112.3	P129 H130 P131 E135	P129-A133 HydrophobicContact CB-CB 3.9Å; H130-A133 WeakPolarHBondContact O-CB 3.25Å; H130-A133 PolarHBondContact O-N 3.47Å; P131-A133 PolarHBondContact O-N 2.93Å; P131-A133 VanDerWaalsContact O-N 3.13Å; A133-E135 PolarHBondContact O-N 2.85Å
134	W	94.3	Very high	87.6	Confident	10 Å²	10	77.3 Å²	77.3	4%	0.038	37%	0.365	C	S	.	.			trans	-81.3	113.1	171.7	-72.4	99.6	0	0	0	109.7	L80 F92 C102 F104 W116 R117 C118 L125 P131 S132	L80-W134 HydrophobicContact CD1-CB 3.91Å; L80-W134 HydrophobicContact CD1-CG 4.19Å; L80-W134 HydrophobicContact CD2-CB 3.78Å; F92-W134 AromaticContact CE1-CH2 3.92Å; F92-W134 HydrophobicContact CE1-CH2 3.92Å; F92-W134 HydrophobicContact CE1-CZ2 4.23Å; C102-W134 HydrophobicContact CB-CH2 4.07Å; F104-W134 HydrophobicContact CD1-CD2 4.39Å; F104-W134 AromaticContact CD1-CE3 3.77Å; F104-W134 HydrophobicContact CD1-CE3 3.77Å; F104-W134 AromaticContact CD1-CH2 3.71Å; F104-W134 HydrophobicContact CD1-CH2 3.71Å; F104-W134 HydrophobicContact CD1-CZ2 4.31Å; F104-W134 AromaticContact CD1-CZ3 3.4Å; F104-W134 HydrophobicContact CD1-CZ3 3.4Å; F104-W134 VanDerWaalsContact CD1-CZ3 3.4Å; F104-W134 AromaticContact CE1-CD2 3.78Å; F104-W134 HydrophobicContact CE1-CD2 3.78Å; F104-W134 AromaticContact CE1-CE3 3.45Å; F104-W134 HydrophobicContact CE1-CE3 3.45Å; F104-W134 VanDerWaalsContact CE1-CE3 3.45Å; F104-W134 HydrophobicContact CE1-CH2 4.07Å; F104-W134 HydrophobicContact CE1-CZ2 4.34Å; F104-W134 AromaticContact CE1-CZ3 3.62Å; F104-W134 HydrophobicContact CE1-CZ3 3.62Å; W116-W134 HydrophobicContact CB-CE3 4Å; W116-W134 HydrophobicContact CB-CZ3 4.4Å; R117-W134 VanDerWaalsContact C-CE3 3.49Å; R117-W134 WeakPolarHBondContact O-CA 3.29Å; C118-W134 HydrophobicContact CB-CD2 3.55Å; C118-W134 HydrophobicContact CB-CE3 3.51Å; C118-W134 HydrophobicContact CB-CG 4.23Å; C118-W134 HydrophobicContact CB-CH2 3.71Å; C118-W134 HydrophobicContact CB-CZ2 3.76Å; C118-W134 HydrophobicContact CB-CZ3 3.59Å; L125-W134 HydrophobicContact CD1-CH2 4.27Å; L125-W134 HydrophobicContact CD1-CZ2 3.95Å; L125-W134 HydrophobicContact CD2-CZ2 4.35Å; P131-W134 WeakPolarHBondContact O-CB 3.45Å; P131-W134 PolarHBondContact O-N 3.18Å; S132-W134 VanDerWaalsContact C-N 3.33Å
135	E	94.9	Very high	88.4	Confident	100 Å²	100	73.3 Å²	73.3	47%	0.467	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.6	172.8	52.9	166.2	-158.6	0	0	111	W116 R117 A133 I137	W116-E135 WeakPolarHBondContact CA-O 3.01Å; R117-E135 HydrophobicContact CB-CG 4.1Å; R117-E135 WeakPolarHBondContact CD-OE1 3.29Å; R117-E135 PolarHBondContact N-O 3.37Å; R117-E135 IonicContact NH1-OE1 3.67Å; R117-E135 WeakPolarHBondContact O-CG 3.46Å; R117-E135 PolarHBondContact O-N 2.79Å; A133-E135 PolarHBondContact O-N 2.85Å; E135-I137 HydrophobicContact CB-CG2 4.48Å; E135-I137 HydrophobicContact CG-CG2 3.7Å; E135-I137 PolarHBondContact O-N 3.28Å; E135-I137 VanDerWaalsContact O-N 3.15Å; E135-I137 WeakPolarHBondContact OE1-CG2 3.11Å
136	C	96.2	Very high	89.2	Confident	38 Å²	38	73.9 Å²	73.9	26%	0.257	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	94.9	166.3	171.5	0	0	0	0	109.2	M82 I115 W116 R138 Q139	M82-C136 HydrophobicContact SD-CB 4.2Å; M82-C136 PolarHBondContact SD-SG 3.43Å; I115-C136 CarbonylContact O-C 3.43Å; I115-C136 WeakPolarHBondContact O-CA 3.04Å; W116-C136 HydrophobicContact CD2-CB 4.17Å; W116-C136 HydrophobicContact CE3-CB 3.8Å; W116-C136 HydrophobicContact CH2-CB 3.92Å; W116-C136 HydrophobicContact CZ2-CB 4.26Å; W116-C136 HydrophobicContact CZ3-CB 3.67Å; C136-R138 VanDerWaalsContact C-N 3.31Å; C136-R138 PolarHBondContact O-N 2.78Å; C136-Q139 WeakPolarHBondContact SG-CG 3.46Å
137	I	94.8	Very high	90.4	Very high	60 Å²	60	68.7 Å²	68.7	31%	0.308	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-19.6	-177.9	61.7	168.9	0	0	0	113.4	I115 R117 E135	I115-I137 HydrophobicContact CB-CD1 4.43Å; I115-I137 HydrophobicContact CB-CG1 3.95Å; I115-I137 HydrophobicContact CG2-CD1 3.82Å; I115-I137 HydrophobicContact CG2-CG1 3.84Å; I115-I137 WeakPolarHBondContact O-CG1 2.96Å; I115-I137 PolarHBondContact O-N 3.38Å; R117-I137 HydrophobicContact CB-CD1 4.23Å; R117-I137 HydrophobicContact CB-CG1 4.46Å; R117-I137 HydrophobicContact CB-CG2 3.7Å; E135-I137 HydrophobicContact CB-CG2 4.48Å; E135-I137 HydrophobicContact CG-CG2 3.7Å; E135-I137 PolarHBondContact O-N 3.28Å; E135-I137 VanDerWaalsContact O-N 3.15Å; E135-I137 WeakPolarHBondContact OE1-CG2 3.11Å
138	R	95	Very high	91.2	Very high	131 Å²	131	63.9 Å²	63.9	49%	0.494	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	137.4	-179.2	-167.8	67.9	177	-159	0.4	112.5	I115 C136 I140	I115-R138 HydrophobicContact CB-CB 4.06Å; I115-R138 HydrophobicContact CD1-CB 3.84Å; I115-R138 HydrophobicContact CD1-CG 4.2Å; I115-R138 HydrophobicContact CG1-CB 3.92Å; I115-R138 PolarHBondContact N-O 3.17Å; C136-R138 VanDerWaalsContact C-N 3.31Å; C136-R138 PolarHBondContact O-N 2.78Å; R138-I140 HydrophobicContact CG-CG1 4.04Å
139	Q	95.7	Very high	92.2	Very high	81 Å²	81	63.3 Å²	63.3	38%	0.379	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.9	171.4	-61.1	177.1	11.9	0	0	108.6	M82 C136	M82-Q139 HydrophobicContact CG-CG 4.31Å; M82-Q139 HydrophobicContact SD-CG 3.66Å; C136-Q139 WeakPolarHBondContact SG-CG 3.46Å
140	I	95.6	Very high	93	Very high	13 Å²	13	62.1 Å²	62.1	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	96	-177.8	-55.8	177.2	0	0	0	108.9	C112 I113 I115 R138 W171	C112-I140 WeakPolarHBondContact CA-O 3.48Å; I113-I140 HydrophobicContact CB-CB 4.17Å; I113-I140 PolarHBondContact N-O 2.93Å; I113-I140 PolarHBondContact O-N 2.77Å; I115-I140 HydrophobicContact CD1-CD1 4.07Å; I115-I140 HydrophobicContact CG1-CD1 4.36Å; R138-I140 HydrophobicContact CG-CG1 4.04Å; I140-W171 HydrophobicContact CD1-CE3 4.37Å; I140-W171 HydrophobicContact CG2-CD2 4.2Å; I140-W171 HydrophobicContact CG2-CE3 3.71Å; I140-W171 HydrophobicContact CG2-CH2 3.12Å; I140-W171 HydrophobicContact CG2-CZ2 3.71Å; I140-W171 HydrophobicContact CG2-CZ3 3.14Å
141	R	95.1	Very high	93.8	Very high	135 Å²	135	56.7 Å²	56.7	51%	0.509	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	78.3	178.1	-64.8	-167.8	177.5	83.4	5.7	112	C112	C112-R141 HydrophobicContact CB-CG 4.12Å
142	R	95.2	Very high	94.7	Very high	168 Å²	168	57 Å²	57	63%	0.634	28%	0.277	S	S	*	.			trans	-120.3	-23	170.5	-55.2	-68.4	-165.9	171.9	0.8	113.9	R169 W171	R142-R169 PolarHBondContact O-NH1 3.37Å; R142-R169 PolarHBondContact O-NH2 2.93Å; R142-W171 HydrophobicContact CB-CH2 3.72Å; R142-W171 HydrophobicContact CG-CH2 3.65Å; R142-W171 HydrophobicContact CG-CZ3 3.98Å
143	H	95.3	Very high	95.2	Very high	13 Å²	13	54.4 Å²	54.4	6%	0.06	25%	0.254	C	S	.	.			trans	-67.9	136.6	172.9	-76.6	-76	0	0	0	109.3	G145 V147 S161 S163 D165 T167 R169	H143-G145 VanDerWaalsContact C-N 3.3Å; H143-V147 HydrophobicContact CB-CG2 3.93Å; H143-S161 PolarHBondContact NE2-OG 3.29Å; H143-S163 VanDerWaalsContact CE1-CB 3.47Å; H143-S163 WeakPolarHBondContact CE1-CB 3.5Å; H143-S163 WeakPolarHBondContact ND1-CB 3.37Å; H143-S163 PolarHBondContact ND1-OG 2.81Å; H143-D165 VanDerWaalsContact CA-OD2 3.29Å; H143-D165 WeakPolarHBondContact CA-OD2 3.49Å; H143-D165 IonicContact CE1-OD1 3.92Å; H143-D165 IonicContact CG-OD2 3.67Å; H143-D165 IonicContact ND1-OD1 2.84Å; H143-D165 PolarHBondContact ND1-OD1 3.36Å; H143-D165 IonicContact ND1-OD2 3.87Å; H143-D165 PolarHBondContact ND1-OD2 3.16Å; H143-T167 PolarHBondContact CE1-OG1 2.74Å; H143-T167 VanDerWaalsContact CE1-OG1 3.3Å; H143-T167 PolarHBondContact ND1-OG1 2.85Å; H143-R169 PolarHBondContact CE1-NH1 2.94Å; H143-R169 VanDerWaalsContact CG-NH1 3.25Å; H143-R169 PolarHBondContact ND1-NH1 2.87Å
144	K	95.4	Very high	95.4	Very high	197 Å²	197	55 Å²	55	86%	0.857	26%	0.255	S	S	*	.	S	Bend	trans	-94.1	11.8	179.2	-65.1	-172	176.8	-173.9	0	112.6	D165	K144-D165 HydrophobicContact CB-CB 4.11Å; K144-D165 PolarHBondContact N-OD2 3.22Å
145	G	94.3	Very high	95.3	Very high	21 Å²	21	57.2 Å²	57.2	22%	0.216	27%	0.271	C	S	.	.	S	Bend	trans	-164	176.6	178.1	0	0	0	0	0	109.5	G111 H143 V147 S163	G111-G145 VanDerWaalsContact CA-O 3.27Å; G111-G145 WeakPolarHBondContact CA-O 3.34Å; H143-G145 VanDerWaalsContact C-N 3.3Å; G145-V147 PolarHBondContact O-N 2.91Å; G145-S163 PolarHBondContact O-OG 3.45Å
146	S	95.4	Very high	95.1	Very high	13 Å²	13	54 Å²	54	9%	0.091	26%	0.257	C	S	.	.			trans	-45.9	130.3	-177.2	172.4	0	0	0	0	113.2	D109 Q148 S163 A164	D109-S146 WeakPolarHBondContact O-CA 3.19Å; D109-S146 WeakPolarHBondContact OD1-CB 3.38Å; D109-S146 PolarHBondContact OD1-OG 2.92Å; S146-Q148 PolarHBondContact O-N 2.84Å; S146-Q148 PolarHBondContact OG-NE2 3.03Å; S146-S163 CarbonylContact O-C 3.57Å; S146-S163 WeakPolarHBondContact O-CA 3.43Å; S146-S163 WeakPolarHBondContact O-CB 3.33Å; S146-S163 PolarHBondContact O-OG 2.83Å; S146-A164 PolarHBondContact O-N 2.98Å
147	V	97.2	Very high	94.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	98.9	170.7	-173.5	0	0	0	0	107.6	R88 A107 G108 I113 H143 G145 I150 I162	R88-V147 WeakPolarHBondContact CB-O 3.18Å; A107-V147 HydrophobicContact CB-CB 3.99Å; A107-V147 HydrophobicContact CB-CG1 3.78Å; G108-V147 PolarHBondContact O-N 2.83Å; I113-V147 HydrophobicContact CD1-CG1 4.17Å; I113-V147 HydrophobicContact CG1-CG1 4.07Å; I113-V147 HydrophobicContact CG1-CG2 4.11Å; H143-V147 HydrophobicContact CB-CG2 3.93Å; G145-V147 PolarHBondContact O-N 2.91Å; V147-I150 HydrophobicContact CG1-CG2 3.81Å; V147-I162 CarbonylContact C-O 3.27Å
148	Q	95.2	Very high	94.9	Very high	52 Å²	52	58.1 Å²	58.1	24%	0.243	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-34.9	-172.4	-65.4	-63.1	-23.7	0	0	112.4	S146 I162 N192	S146-Q148 PolarHBondContact O-N 2.84Å; S146-Q148 PolarHBondContact OG-NE2 3.03Å; Q148-I162 HydrophobicContact CB-CG2 4.26Å; Q148-I162 PolarHBondContact N-O 3.23Å; Q148-N192 WeakPolarHBondContact CB-O 3.43Å
149	S	96.5	Very high	94.9	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.014	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	150.3	-179.5	-175	0	0	0	0	112.6	Q89 S161 I162 I194	Q89-S149 PolarHBondContact OE1-OG 2.81Å; S149-S161 WeakPolarHBondContact O-CA 3.39Å; S149-I162 PolarHBondContact N-O 2.94Å; S149-I162 PolarHBondContact O-N 3.01Å; S149-I194 PolarHBondContact OG-N 2.93Å; S149-I194 VanDerWaalsContact OG-N 3.17Å; S149-I194 PolarHBondContact OG-O 2.75Å
150	I	97.4	Very high	95	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149.2	174.5	62.1	171.3	0	0	0	110.8	Q89 K91 F105 A107 I113 V147 L159 F160	Q89-I150 HydrophobicContact CB-CG1 4.17Å; Q89-I150 HydrophobicContact CG-CG1 4.05Å; Q89-I150 PolarHBondContact NE2-O 3.19Å; Q89-I150 PolarHBondContact OE1-O 2.75Å; K91-I150 HydrophobicContact CB-CD1 4.29Å; F105-I150 HydrophobicContact CB-CD1 3.51Å; A107-I150 HydrophobicContact CB-CD1 4.25Å; A107-I150 HydrophobicContact CB-CG1 4.41Å; A107-I150 HydrophobicContact CB-CG2 3.75Å; I113-I150 HydrophobicContact CD1-CG2 4.06Å; I113-I150 HydrophobicContact CG1-CG2 4.39Å; V147-I150 HydrophobicContact CG1-CG2 3.81Å; I150-L159 HydrophobicContact CB-CD1 4.13Å; I150-L159 HydrophobicContact CD1-CD1 4.47Å; I150-F160 CarbonylContact C-O 3.58Å; I150-F160 WeakPolarHBondContact CA-O 3.22Å
151	A	96.9	Very high	95.1	Very high	5 Å²	5	48.2 Å²	48.2	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	130.2	171.9	0	0	0	0	0	109.7	F160 I194 M196 L203	A151-F160 HydrophobicContact CB-CB 4.44Å; A151-F160 PolarHBondContact N-O 2.8Å; A151-F160 WeakPolarHBondContact O-CD2 3.28Å; A151-F160 PolarHBondContact O-N 3.49Å; A151-I194 HydrophobicContact CB-CD1 3.96Å; A151-I194 HydrophobicContact CB-CG1 4.06Å; A151-M196 HydrophobicContact CB-CB 4.02Å; A151-L203 HydrophobicContact CB-CD1 4.21Å
152	V	96.2	Very high	95	Very high	17 Å²	17	41.8 Å²	41.8	10%	0.103	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.6	178.5	-172	0	0	0	0	108.2	K91 I93 F105 L159 L173	K91-V152 HydrophobicContact CG-CG2 4.09Å; I93-V152 HydrophobicContact CG2-CG1 3.89Å; I93-V152 HydrophobicContact CG2-CG2 4.21Å; F105-V152 HydrophobicContact CD2-CG2 3.52Å; F105-V152 HydrophobicContact CE2-CG1 4.2Å; F105-V152 HydrophobicContact CE2-CG2 3.63Å; V152-L159 HydrophobicContact CB-CD1 4.39Å; V152-L159 HydrophobicContact CG2-CD1 3.56Å; V152-L173 HydrophobicContact CG1-CD1 4.48Å
153	H	95.1	Very high	95	Very high	43 Å²	43	34.1 Å²	34.1	20%	0.199	17%	0.174	C	C	.	.			trans	-70.5	138.5	171.6	-173.3	-89.1	0	0	0	110.1	S155 N156 C158 F160 M196 G200	H153-S155 PolarHBondContact CE1-OG 2.86Å; H153-S155 VanDerWaalsContact ND1-CB 3.27Å; H153-S155 WeakPolarHBondContact ND1-CB 3.42Å; H153-S155 PolarHBondContact ND1-N 2.73Å; H153-S155 PolarHBondContact ND1-OG 2.58Å; H153-S155 PolarHBondContact O-N 3.13Å; H153-N156 WeakPolarHBondContact O-CA 3.24Å; H153-N156 PolarHBondContact O-N 2.95Å; H153-C158 HydrophobicContact CB-CB 3.97Å; H153-C158 WeakPolarHBondContact CB-O 3.33Å; H153-C158 PolarHBondContact N-O 3.4Å; H153-F160 HydrophobicContact CB-CE2 4.12Å; H153-M196 HydrophobicContact CB-CE 4.36Å; H153-G200 PolarHBondContact CD2-O 2.76Å; H153-G200 PolarHBondContact NE2-O 2.83Å; H153-G200 VanDerWaalsContact NE2-O 3.16Å
154	P	92.2	Very high	94.9	Very high	56 Å²	56	36.3 Å²	36.3	36%	0.364	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-23.7	-177.6	-27.5	35.9	0	0	0	115.2	N156 P198	P154-N156 PolarHBondContact O-N 3.03Å; P154-P198 VanDerWaalsContact CG-O 3.26Å; P154-P198 WeakPolarHBondContact CG-O 3Å
155	S	90.7	Very high	94.7	Very high	55 Å²	55	28.6 Å²	28.6	39%	0.385	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-9.1	171.3	75.6	0	0	0	0	114.5	H153 R157	H153-S155 PolarHBondContact CE1-OG 2.86Å; H153-S155 VanDerWaalsContact ND1-CB 3.27Å; H153-S155 WeakPolarHBondContact ND1-CB 3.42Å; H153-S155 PolarHBondContact ND1-N 2.73Å; H153-S155 PolarHBondContact ND1-OG 2.58Å; H153-S155 PolarHBondContact O-N 3.13Å; S155-R157 WeakPolarHBondContact O-CG 3.23Å; S155-R157 PolarHBondContact O-N 3.16Å; S155-R157 VanDerWaalsContact O-N 3.08Å; S155-R157 PolarHBondContact OG-N 3.27Å
156	N	91.2	Very high	94.5	Very high	34 Å²	34	31.7 Å²	31.7	18%	0.182	17%	0.17	C	C	.	.	S	Bend	trans	58	14.2	-174.8	-54.1	-47.9	0	0	0	115.3	I93 T94 H153 P154 L173	I93-N156 HydrophobicContact CD1-CB 4.42Å; T94-N156 PolarHBondContact O-ND2 3.48Å; H153-N156 WeakPolarHBondContact O-CA 3.24Å; H153-N156 PolarHBondContact O-N 2.95Å; P154-N156 PolarHBondContact O-N 3.03Å; N156-L173 WeakPolarHBondContact O-CD1 3.48Å
157	R	92.3	Very high	94.4	Very high	159 Å²	159	32 Å²	32	60%	0.6	17%	0.171	S	C	*	.	S	Bend	trans	-94.3	-16.2	179.8	-63.3	175.8	-173.1	-171.6	0.3	113	S155 L173 L174	S155-R157 WeakPolarHBondContact O-CG 3.23Å; S155-R157 PolarHBondContact O-N 3.16Å; S155-R157 VanDerWaalsContact O-N 3.08Å; S155-R157 PolarHBondContact OG-N 3.27Å; R157-L173 PolarHBondContact O-N 3.25Å; R157-L174 HydrophobicContact CB-CD1 4.36Å; R157-L174 HydrophobicContact CB-CG 4.39Å; R157-L174 HydrophobicContact CG-CD1 3.97Å; R157-L174 HydrophobicContact CG-CD2 4.41Å; R157-L174 HydrophobicContact CG-CG 4.17Å
158	C	94	Very high	94.2	Very high	25 Å²	25	33.2 Å²	33.2	17%	0.169	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	137.8	-172	-169.9	0	0	0	0	111.3	H153 F160 V170 W171	H153-C158 HydrophobicContact CB-CB 3.97Å; H153-C158 WeakPolarHBondContact CB-O 3.33Å; H153-C158 PolarHBondContact N-O 3.4Å; C158-F160 VanDerWaalsContact SG-CZ 3.58Å; C158-V170 WeakPolarHBondContact SG-CG1 3.46Å; C158-W171 VanDerWaalsContact CA-O 3.31Å; C158-W171 WeakPolarHBondContact CA-O 3.09Å
159	L	96.9	Very high	94.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	141.2	169.7	174.9	82.6	0	0	0	108.4	F105 I113 I150 V152 W171 L173	F105-L159 HydrophobicContact CD1-CD2 4.14Å; F105-L159 HydrophobicContact CD2-CD1 4.18Å; F105-L159 HydrophobicContact CE1-CD2 4.27Å; F105-L159 HydrophobicContact CE2-CD1 4.36Å; F105-L159 HydrophobicContact CG-CD1 4.3Å; I113-L159 HydrophobicContact CD1-CD2 4.18Å; I113-L159 HydrophobicContact CG2-CD2 3.96Å; I150-L159 HydrophobicContact CB-CD1 4.13Å; I150-L159 HydrophobicContact CD1-CD1 4.47Å; V152-L159 HydrophobicContact CB-CD1 4.39Å; V152-L159 HydrophobicContact CG2-CD1 3.56Å; L159-W171 HydrophobicContact CB-CB 4.09Å; L159-W171 HydrophobicContact CB-CG 4.49Å; L159-W171 HydrophobicContact CD2-CG 4.37Å; L159-W171 PolarHBondContact N-O 2.99Å; L159-W171 VanDerWaalsContact O-CD1 3.29Å; L159-W171 PolarHBondContact O-N 2.95Å; L159-L173 HydrophobicContact CB-CD1 4.11Å; L159-L173 HydrophobicContact CB-CD2 3.88Å; L159-L173 HydrophobicContact CB-CG 4.11Å
160	F	96.7	Very high	94.2	Very high	16 Å²	16	33 Å²	33	7%	0.07	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	143.7	173.2	-57.9	-77.8	0	0	0	108.8	I150 A151 H153 C158 F168 R169 V170 I194 M196 L216	I150-F160 CarbonylContact C-O 3.58Å; I150-F160 WeakPolarHBondContact CA-O 3.22Å; A151-F160 HydrophobicContact CB-CB 4.44Å; A151-F160 PolarHBondContact N-O 2.8Å; A151-F160 WeakPolarHBondContact O-CD2 3.28Å; A151-F160 PolarHBondContact O-N 3.49Å; H153-F160 HydrophobicContact CB-CE2 4.12Å; C158-F160 VanDerWaalsContact SG-CZ 3.58Å; F160-F168 HydrophobicContact CB-CE2 3.87Å; F160-F168 HydrophobicContact CB-CZ 4.18Å; F160-F168 HydrophobicContact CD1-CE1 4.25Å; F160-F168 AromaticContact CD1-CE2 3.97Å; F160-F168 HydrophobicContact CD1-CE2 3.97Å; F160-F168 AromaticContact CD1-CZ 3.38Å; F160-F168 HydrophobicContact CD1-CZ 3.38Å; F160-F168 HydrophobicContact CE1-CZ 4.12Å; F160-F168 HydrophobicContact CG-CE2 4.31Å; F160-F168 HydrophobicContact CG-CZ 4.13Å; F160-R169 WeakPolarHBondContact CA-O 3.25Å; F160-V170 HydrophobicContact CD1-CB 4.42Å; F160-V170 HydrophobicContact CD1-CG1 4.14Å; F160-V170 HydrophobicContact CD1-CG2 3.92Å; F160-V170 HydrophobicContact CE1-CB 4.42Å; F160-V170 HydrophobicContact CE1-CG1 3.79Å; F160-V170 HydrophobicContact CE1-CG2 3.94Å; F160-I194 HydrophobicContact CB-CD1 3.62Å; F160-I194 WeakPolarHBondContact O-CD1 3.24Å; F160-M196 HydrophobicContact CD2-CE 3.45Å; F160-M196 VanDerWaalsContact CD2-CE 3.45Å; F160-M196 HydrophobicContact CE2-CE 3.11Å; F160-M196 HydrophobicContact CZ-CE 4.06Å; F160-L216 HydrophobicContact CZ-CD1 4.32Å
161	S	96.9	Very high	94.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	148.1	174	63.1	0	0	0	0	111.8	H143 S149 F168 R169 W171	H143-S161 PolarHBondContact NE2-OG 3.29Å; S149-S161 WeakPolarHBondContact O-CA 3.39Å; S161-F168 CarbonylContact O-C 3.43Å; S161-F168 WeakPolarHBondContact O-CA 3.46Å; S161-R169 PolarHBondContact N-O 2.83Å; S161-R169 PolarHBondContact O-N 2.88Å; S161-W171 PolarHBondContact OG-NE1 3.36Å
162	I	94.6	Very high	94	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.3	174	-145.4	162	0	0	0	109.5	V147 Q148 S149 L184 A191 I194 F205	V147-I162 CarbonylContact C-O 3.27Å; Q148-I162 HydrophobicContact CB-CG2 4.26Å; Q148-I162 PolarHBondContact N-O 3.23Å; S149-I162 PolarHBondContact N-O 2.94Å; S149-I162 PolarHBondContact O-N 3.01Å; I162-L184 HydrophobicContact CD1-CD1 3.63Å; I162-L184 HydrophobicContact CG1-CD1 3.79Å; I162-A191 HydrophobicContact CD1-CB 3.32Å; I162-A191 HydrophobicContact CG1-CB 4.22Å; I162-I194 HydrophobicContact CB-CG2 4.26Å; I162-I194 HydrophobicContact CD1-CG2 3.92Å; I162-I194 HydrophobicContact CG2-CG2 4.45Å; I162-F205 HydrophobicContact CD1-CD1 3.74Å; I162-F205 HydrophobicContact CD1-CE1 3.69Å
163	S	94.6	Very high	93.8	Very high	7 Å²	7	36.1 Å²	36.1	5%	0.049	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.7	-171.9	168.3	0	0	0	0	112.6	H143 G145 S146 D165 K166 T167	H143-S163 VanDerWaalsContact CE1-CB 3.47Å; H143-S163 WeakPolarHBondContact CE1-CB 3.5Å; H143-S163 WeakPolarHBondContact ND1-CB 3.37Å; H143-S163 PolarHBondContact ND1-OG 2.81Å; G145-S163 PolarHBondContact O-OG 3.45Å; S146-S163 CarbonylContact O-C 3.57Å; S146-S163 WeakPolarHBondContact O-CA 3.43Å; S146-S163 WeakPolarHBondContact O-CB 3.33Å; S146-S163 PolarHBondContact O-OG 2.83Å; S163-D165 VanDerWaalsContact CB-OD1 3.26Å; S163-D165 WeakPolarHBondContact CB-OD1 3.48Å; S163-D165 PolarHBondContact O-N 2.82Å; S163-D165 VanDerWaalsContact O-N 3.11Å; S163-D165 PolarHBondContact OG-N 2.81Å; S163-D165 PolarHBondContact OG-OD1 3Å; S163-K166 PolarHBondContact O-N 3.33Å; S163-T167 PolarHBondContact N-O 2.81Å
164	A	92.2	Very high	93.6	Very high	59 Å²	59	40.2 Å²	40.2	49%	0.488	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-16	168.9	0	0	0	0	0	113.2	S146 K166	S146-A164 PolarHBondContact O-N 2.98Å; A164-K166 PolarHBondContact O-N 2.81Å; A164-K166 VanDerWaalsContact O-N 3.13Å
165	D	92.1	Very high	93.3	Very high	34 Å²	34	47.1 Å²	47.1	18%	0.182	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	3.9	169.5	78.6	-2	0	0	0	114	H143 K144 S163 T167 R169	H143-D165 VanDerWaalsContact CA-OD2 3.29Å; H143-D165 WeakPolarHBondContact CA-OD2 3.49Å; H143-D165 IonicContact CE1-OD1 3.92Å; H143-D165 IonicContact CG-OD2 3.67Å; H143-D165 IonicContact ND1-OD1 2.84Å; H143-D165 PolarHBondContact ND1-OD1 3.36Å; H143-D165 IonicContact ND1-OD2 3.87Å; H143-D165 PolarHBondContact ND1-OD2 3.16Å; K144-D165 HydrophobicContact CB-CB 4.11Å; K144-D165 PolarHBondContact N-OD2 3.22Å; S163-D165 VanDerWaalsContact CB-OD1 3.26Å; S163-D165 WeakPolarHBondContact CB-OD1 3.48Å; S163-D165 PolarHBondContact O-N 2.82Å; S163-D165 VanDerWaalsContact O-N 3.11Å; S163-D165 PolarHBondContact OG-N 2.81Å; S163-D165 PolarHBondContact OG-OD1 3Å; D165-T167 VanDerWaalsContact CG-OG1 3.25Å; D165-T167 PolarHBondContact O-N 2.93Å; D165-T167 VanDerWaalsContact OD1-CB 3.31Å; D165-T167 WeakPolarHBondContact OD1-CB 3.45Å; D165-T167 PolarHBondContact OD1-N 2.9Å; D165-T167 PolarHBondContact OD1-OG1 2.81Å; D165-T167 PolarHBondContact OD2-OG1 2.81Å; D165-R169 IonicContact OD1-NH1 3.85Å; D165-R169 IonicContact OD2-CZ 2.68Å; D165-R169 IonicContact OD2-NH1 3.32Å; D165-R169 PolarHBondContact OD2-NH1 2.86Å; D165-R169 IonicContact OD2-NH2 3.14Å
166	K	90.5	Very high	93	Very high	87 Å²	87	45.6 Å²	45.6	38%	0.378	23%	0.225	S	C	.	.	S	Bend	trans	64.6	26.4	179.6	-47.1	-174.2	-175.9	-167.8	0	113.2	S163 A164 R183 L184 N189	S163-K166 PolarHBondContact O-N 3.33Å; A164-K166 PolarHBondContact O-N 2.81Å; A164-K166 VanDerWaalsContact O-N 3.13Å; K166-R183 WeakPolarHBondContact O-CA 3.49Å; K166-L184 PolarHBondContact O-N 3.48Å; K166-N189 PolarHBondContact NZ-OD1 2.72Å
167	T	92.4	Very high	92.9	Very high	20 Å²	20	52.9 Å²	52.9	12%	0.123	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.1	174.7	71.7	0	0	0	0	111.9	H143 S163 D165 R169 V182	H143-T167 PolarHBondContact CE1-OG1 2.74Å; H143-T167 VanDerWaalsContact CE1-OG1 3.3Å; H143-T167 PolarHBondContact ND1-OG1 2.85Å; S163-T167 PolarHBondContact N-O 2.81Å; D165-T167 VanDerWaalsContact CG-OG1 3.25Å; D165-T167 PolarHBondContact O-N 2.93Å; D165-T167 VanDerWaalsContact OD1-CB 3.31Å; D165-T167 WeakPolarHBondContact OD1-CB 3.45Å; D165-T167 PolarHBondContact OD1-N 2.9Å; D165-T167 PolarHBondContact OD1-OG1 2.81Å; D165-T167 PolarHBondContact OD2-OG1 2.81Å; T167-R169 PolarHBondContact OG1-NH1 2.82Å; T167-V182 VanDerWaalsContact CA-O 3.3Å; T167-V182 WeakPolarHBondContact CA-O 3.26Å
168	F	93.1	Very high	93	Very high	24 Å²	24	49 Å²	49	11%	0.105	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130	161.6	170.5	-103.8	0	0	0	107.9	F160 S161 V170 A181 V182 L184 I194 L203 F205	F160-F168 HydrophobicContact CB-CE2 3.87Å; F160-F168 HydrophobicContact CB-CZ 4.18Å; F160-F168 HydrophobicContact CD1-CE1 4.25Å; F160-F168 AromaticContact CD1-CE2 3.97Å; F160-F168 HydrophobicContact CD1-CE2 3.97Å; F160-F168 AromaticContact CD1-CZ 3.38Å; F160-F168 HydrophobicContact CD1-CZ 3.38Å; F160-F168 HydrophobicContact CE1-CZ 4.12Å; F160-F168 HydrophobicContact CG-CE2 4.31Å; F160-F168 HydrophobicContact CG-CZ 4.13Å; S161-F168 CarbonylContact O-C 3.43Å; S161-F168 WeakPolarHBondContact O-CA 3.46Å; F168-V170 HydrophobicContact CD1-CG2 4.41Å; F168-V170 HydrophobicContact CE1-CG2 3.68Å; F168-V170 HydrophobicContact CZ-CG2 4.2Å; F168-A181 WeakPolarHBondContact O-CA 3.14Å; F168-V182 PolarHBondContact N-O 3.47Å; F168-V182 PolarHBondContact O-N 3.16Å; F168-L184 HydrophobicContact CB-CD1 4.24Å; F168-L184 HydrophobicContact CB-CD2 3.97Å; F168-L184 HydrophobicContact CB-CG 4.27Å; F168-I194 HydrophobicContact CE2-CD1 4.41Å; F168-L203 HydrophobicContact CE2-CD2 3.98Å; F168-L203 HydrophobicContact CZ-CD2 3.92Å; F168-F205 HydrophobicContact CB-CE1 4.37Å; F168-F205 HydrophobicContact CD1-CZ 4.24Å; F168-F205 AromaticContact CD2-CE1 3.72Å; F168-F205 HydrophobicContact CD2-CE1 3.72Å; F168-F205 AromaticContact CD2-CZ 3.52Å; F168-F205 HydrophobicContact CD2-CZ 3.52Å; F168-F205 HydrophobicContact CE1-CZ 4.24Å; F168-F205 HydrophobicContact CE2-CE1 4.11Å; F168-F205 HydrophobicContact CE2-CE2 4.33Å; F168-F205 AromaticContact CE2-CZ 3.5Å; F168-F205 HydrophobicContact CE2-CZ 3.5Å; F168-F205 HydrophobicContact CG-CE1 4.09Å; F168-F205 AromaticContact CG-CZ 3.87Å; F168-F205 HydrophobicContact CG-CZ 3.87Å; F168-F205 HydrophobicContact CZ-CE2 4.49Å; F168-F205 AromaticContact CZ-CZ 3.86Å; F168-F205 HydrophobicContact CZ-CZ 3.86Å
169	R	95.5	Very high	93.1	Very high	29 Å²	29	50.9 Å²	50.9	11%	0.109	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.6	179.9	-68.3	-170.9	164.7	92.7	3.5	111.1	R142 H143 F160 S161 D165 T167 W171 Q178 Y180 A181	R142-R169 PolarHBondContact O-NH1 3.37Å; R142-R169 PolarHBondContact O-NH2 2.93Å; H143-R169 PolarHBondContact CE1-NH1 2.94Å; H143-R169 VanDerWaalsContact CG-NH1 3.25Å; H143-R169 PolarHBondContact ND1-NH1 2.87Å; F160-R169 WeakPolarHBondContact CA-O 3.25Å; S161-R169 PolarHBondContact N-O 2.83Å; S161-R169 PolarHBondContact O-N 2.88Å; D165-R169 IonicContact OD1-NH1 3.85Å; D165-R169 IonicContact OD2-CZ 2.68Å; D165-R169 IonicContact OD2-NH1 3.32Å; D165-R169 PolarHBondContact OD2-NH1 2.86Å; D165-R169 IonicContact OD2-NH2 3.14Å; T167-R169 PolarHBondContact OG1-NH1 2.82Å; R169-W171 HydrophobicContact CB-CZ2 3.88Å; R169-W171 VanDerWaalsContact CD-CZ2 3.47Å; R169-W171 HydrophobicContact CG-CZ2 4.32Å; R169-Q178 VanDerWaalsContact CD-OE1 3.27Å; R169-Y180 WeakPolarHBondContact CA-O 3.03Å; R169-A181 HydrophobicContact CG-CB 3.91Å
170	V	96.1	Very high	92.9	Very high	22 Å²	22	57.4 Å²	57.4	13%	0.133	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.6	172.8	-170.8	0	0	0	0	107.5	C158 F160 F168 A179 Y180	C158-V170 WeakPolarHBondContact SG-CG1 3.46Å; F160-V170 HydrophobicContact CD1-CB 4.42Å; F160-V170 HydrophobicContact CD1-CG1 4.14Å; F160-V170 HydrophobicContact CD1-CG2 3.92Å; F160-V170 HydrophobicContact CE1-CB 4.42Å; F160-V170 HydrophobicContact CE1-CG1 3.79Å; F160-V170 HydrophobicContact CE1-CG2 3.94Å; F168-V170 HydrophobicContact CD1-CG2 4.41Å; F168-V170 HydrophobicContact CE1-CG2 3.68Å; F168-V170 HydrophobicContact CZ-CG2 4.2Å; V170-A179 HydrophobicContact CG1-CB 4.46Å; V170-A179 PolarHBondContact O-N 2.88Å; V170-Y180 HydrophobicContact CG2-CD1 4.17Å; V170-Y180 PolarHBondContact N-O 3.37Å; V170-Y180 PolarHBondContact O-N 2.99Å
171	W	96.9	Very high	92.7	Very high	5 Å²	5	58.5 Å²	58.5	2%	0.019	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.4	-176.8	-53.1	96.4	0	0	0	109.8	I113 I140 R142 C158 L159 S161 R169 L173 Q178	I113-W171 HydrophobicContact CD1-CZ2 4.38Å; I140-W171 HydrophobicContact CD1-CE3 4.37Å; I140-W171 HydrophobicContact CG2-CD2 4.2Å; I140-W171 HydrophobicContact CG2-CE3 3.71Å; I140-W171 HydrophobicContact CG2-CH2 3.12Å; I140-W171 HydrophobicContact CG2-CZ2 3.71Å; I140-W171 HydrophobicContact CG2-CZ3 3.14Å; R142-W171 HydrophobicContact CB-CH2 3.72Å; R142-W171 HydrophobicContact CG-CH2 3.65Å; R142-W171 HydrophobicContact CG-CZ3 3.98Å; C158-W171 VanDerWaalsContact CA-O 3.31Å; C158-W171 WeakPolarHBondContact CA-O 3.09Å; L159-W171 HydrophobicContact CB-CB 4.09Å; L159-W171 HydrophobicContact CB-CG 4.49Å; L159-W171 HydrophobicContact CD2-CG 4.37Å; L159-W171 PolarHBondContact N-O 2.99Å; L159-W171 VanDerWaalsContact O-CD1 3.29Å; L159-W171 PolarHBondContact O-N 2.95Å; S161-W171 PolarHBondContact OG-NE1 3.36Å; R169-W171 HydrophobicContact CB-CZ2 3.88Å; R169-W171 VanDerWaalsContact CD-CZ2 3.47Å; R169-W171 HydrophobicContact CG-CZ2 4.32Å; W171-L173 PolarHBondContact O-N 3.21Å; W171-Q178 HydrophobicContact CE3-CB 3.82Å; W171-Q178 HydrophobicContact CE3-CG 4.28Å; W171-Q178 HydrophobicContact CH2-CB 4.4Å; W171-Q178 HydrophobicContact CZ3-CB 3.6Å; W171-Q178 HydrophobicContact CZ3-CG 4.1Å
172	N	94.7	Very high	92.4	Very high	46 Å²	46	60.9 Å²	60.9	25%	0.246	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	109.9	168.5	-176.5	-41.6	0	0	0	108.3	L174 R175 G176 R177 A179	N172-L174 WeakPolarHBondContact OD1-CB 3.43Å; N172-L174 PolarHBondContact OD1-N 2.59Å; N172-R175 HydrophobicContact CB-CB 4.41Å; N172-R175 PolarHBondContact OD1-N 3.26Å; N172-G176 WeakPolarHBondContact O-CA 3.49Å; N172-G176 PolarHBondContact O-N 2.94Å; N172-R177 PolarHBondContact N-O 3.14Å; N172-R177 PolarHBondContact O-N 2.96Å; N172-A179 HydrophobicContact CB-CB 4.18Å
173	L	92.1	Very high	92.1	Very high	36 Å²	36	68.7 Å²	68.7	19%	0.188	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-29.1	-177.3	-65.6	176.9	0	0	0	112.4	F105 I115 V152 N156 R157 L159 W171 R175	F105-L173 HydrophobicContact CE1-CD2 3.73Å; F105-L173 HydrophobicContact CE2-CD1 4.22Å; F105-L173 HydrophobicContact CZ-CD1 3.65Å; F105-L173 HydrophobicContact CZ-CD2 3.61Å; F105-L173 HydrophobicContact CZ-CG 4.28Å; I115-L173 HydrophobicContact CD1-CD2 4.49Å; V152-L173 HydrophobicContact CG1-CD1 4.48Å; N156-L173 WeakPolarHBondContact O-CD1 3.48Å; R157-L173 PolarHBondContact O-N 3.25Å; L159-L173 HydrophobicContact CB-CD1 4.11Å; L159-L173 HydrophobicContact CB-CD2 3.88Å; L159-L173 HydrophobicContact CB-CG 4.11Å; W171-L173 PolarHBondContact O-N 3.21Å; L173-R175 VanDerWaalsContact C-N 3.35Å
174	L	89.2	Confident	91.5	Very high	130 Å²	130	69.4 Å²	69.4	68%	0.681	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-37.2	176	-61.3	175.7	0	0	0	112	R157 N172	R157-L174 HydrophobicContact CB-CD1 4.36Å; R157-L174 HydrophobicContact CB-CG 4.39Å; R157-L174 HydrophobicContact CG-CD1 3.97Å; R157-L174 HydrophobicContact CG-CD2 4.41Å; R157-L174 HydrophobicContact CG-CG 4.17Å; N172-L174 WeakPolarHBondContact OD1-CB 3.43Å; N172-L174 PolarHBondContact OD1-N 2.59Å
175	R	87.3	Confident	90.2	Very high	200 Å²	200	74.5 Å²	74.5	76%	0.755	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.9	-179.8	-65.1	-174.8	174.5	179.7	-1	113.4	N172 L173 R177	N172-R175 HydrophobicContact CB-CB 4.41Å; N172-R175 PolarHBondContact OD1-N 3.26Å; L173-R175 VanDerWaalsContact C-N 3.35Å; R175-R177 PolarHBondContact O-N 3.21Å
176	G	84	Confident	88.4	Confident	24 Å²	24	80.5 Å²	80.5	25%	0.247	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	31.3	-176.6	0	0	0	0	0	114	N172	N172-G176 WeakPolarHBondContact O-CA 3.49Å; N172-G176 PolarHBondContact O-N 2.94Å
177	R	89.8	Confident	86.5	Confident	187 Å²	187	79.4 Å²	79.4	71%	0.706	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	154.4	-175.1	-70.1	-178.8	-175.6	-174.5	1.4	111.6	N172 R175 A179	N172-R177 PolarHBondContact N-O 3.14Å; N172-R177 PolarHBondContact O-N 2.96Å; R175-R177 PolarHBondContact O-N 3.21Å; R177-A179 PolarHBondContact O-N 3.17Å
178	Q	94.3	Very high	84.5	Confident	76 Å²	76	82 Å²	82	36%	0.355	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	123.9	169.8	-167.6	-170.6	-75	0	0	108.7	R169 W171 Y180 A181	R169-Q178 VanDerWaalsContact CD-OE1 3.27Å; W171-Q178 HydrophobicContact CE3-CB 3.82Å; W171-Q178 HydrophobicContact CE3-CG 4.28Å; W171-Q178 HydrophobicContact CH2-CB 4.4Å; W171-Q178 HydrophobicContact CZ3-CB 3.6Å; W171-Q178 HydrophobicContact CZ3-CG 4.1Å; Q178-Y180 WeakPolarHBondContact CG-O 3.19Å; Q178-A181 VanDerWaalsContact NE2-CB 3.29Å
179	A	94.4	Very high	82.6	Confident	66 Å²	66	86.9 Å²	86.9	55%	0.545	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-40.8	173.5	0	0	0	0	0	110.8	V170 N172 R177	V170-A179 HydrophobicContact CG1-CB 4.46Å; V170-A179 PolarHBondContact O-N 2.88Å; N172-A179 HydrophobicContact CB-CB 4.18Å; R177-A179 PolarHBondContact O-N 3.17Å
180	Y	93	Very high	81	Confident	136 Å²	136	90.5 Å²	90.5	53%	0.533	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	152.4	-173.7	-170.6	-110.1	0	0	0	111.1	R169 V170 Q178 V182	R169-Y180 WeakPolarHBondContact CA-O 3.03Å; V170-Y180 HydrophobicContact CG2-CD1 4.17Å; V170-Y180 PolarHBondContact N-O 3.37Å; V170-Y180 PolarHBondContact O-N 2.99Å; Q178-Y180 WeakPolarHBondContact CG-O 3.19Å; Y180-V182 HydrophobicContact CD1-CG2 4.16Å; Y180-V182 HydrophobicContact CE1-CB 4.12Å; Y180-V182 HydrophobicContact CE1-CG2 3.17Å; Y180-V182 HydrophobicContact CE2-CG2 4.4Å; Y180-V182 WeakPolarHBondContact OH-CG2 3.41Å
181	A	93.4	Very high	79.4	Confident	39 Å²	39	90.1 Å²	90.1	32%	0.322	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	135.4	172.5	0	0	0	0	0	110	F168 R169 Q178	F168-A181 WeakPolarHBondContact O-CA 3.14Å; R169-A181 HydrophobicContact CG-CB 3.91Å; Q178-A181 VanDerWaalsContact NE2-CB 3.29Å
182	V	90.4	Very high	78.9	Confident	51 Å²	51	92.9 Å²	92.9	31%	0.309	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139.1	174.2	160.2	0	0	0	0	109.7	T167 F168 Y180	T167-V182 VanDerWaalsContact CA-O 3.3Å; T167-V182 WeakPolarHBondContact CA-O 3.26Å; F168-V182 PolarHBondContact N-O 3.47Å; F168-V182 PolarHBondContact O-N 3.16Å; Y180-V182 HydrophobicContact CD1-CG2 4.16Å; Y180-V182 HydrophobicContact CE1-CB 4.12Å; Y180-V182 HydrophobicContact CE1-CG2 3.17Å; Y180-V182 HydrophobicContact CE2-CG2 4.4Å; Y180-V182 WeakPolarHBondContact OH-CG2 3.41Å
183	R	88.6	Confident	78.8	Confident	164 Å²	164	94.4 Å²	94.4	62%	0.619	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	126.6	168.6	-172.7	175.4	-179.8	179.4	-0.7	109.1	K166 K185	K166-R183 WeakPolarHBondContact O-CA 3.49Å; R183-K185 VanDerWaalsContact C-N 3.31Å; R183-K185 HydrophobicContact CB-CG 4.39Å; R183-K185 HydrophobicContact CG-CG 4.09Å; R183-K185 PolarHBondContact O-N 2.64Å
184	L	82.3	Confident	78.9	Confident	23 Å²	23	93 Å²	93	12%	0.12	46%	0.463	C	S	.	.			trans	-80.1	82.5	176.4	-54.4	173	0	0	0	107.6	I162 K166 F168 L187 A191	I162-L184 HydrophobicContact CD1-CD1 3.63Å; I162-L184 HydrophobicContact CG1-CD1 3.79Å; K166-L184 PolarHBondContact O-N 3.48Å; F168-L184 HydrophobicContact CB-CD1 4.24Å; F168-L184 HydrophobicContact CB-CD2 3.97Å; F168-L184 HydrophobicContact CB-CG 4.27Å; L184-L187 HydrophobicContact CB-CB 4.47Å; L184-L187 HydrophobicContact CB-CD1 4.34Å; L184-L187 HydrophobicContact CD2-CD1 3.99Å; L184-A191 HydrophobicContact CD1-CB 4.05Å
185	K	65.1	Low	79.2	Confident	166 Å²	166	88.4 Å²	88.4	72%	0.722	44%	0.441	S	S	*	.	S	Bend	trans	-77	-37.8	-176	-70.8	-176.2	-179.5	178.8	0	113.2	R183	R183-K185 VanDerWaalsContact C-N 3.31Å; R183-K185 HydrophobicContact CB-CG 4.39Å; R183-K185 HydrophobicContact CG-CG 4.09Å; R183-K185 PolarHBondContact O-N 2.64Å
186	N	53.3	Low	79.7	Confident	160 Å²	160	80.1 Å²	80.1	86%	0.856	41%	0.412	S	S	*	.	S	Bend	trans	-109.5	-4.4	-172.4	-70.4	-0.5	0	0	0	113.8
187	L	51.7	Low	80.2	Confident	63 Å²	63	79 Å²	79	33%	0.33	40%	0.4	S	S	.	.	S	Bend	trans	-89.9	122.8	173.8	-63.6	113.4	0	0	0	106	L184 W207	L184-L187 HydrophobicContact CB-CB 4.47Å; L184-L187 HydrophobicContact CB-CD1 4.34Å; L184-L187 HydrophobicContact CD2-CD1 3.99Å; L187-W207 HydrophobicContact CB-CZ2 4.23Å; L187-W207 HydrophobicContact CD2-CH2 3.51Å; L187-W207 HydrophobicContact CD2-CZ2 3.08Å; L187-W207 HydrophobicContact CG-CZ2 4.21Å
188	A	49.1	Very low	80.2	Confident	76 Å²	76	72.9 Å²	72.9	63%	0.628	39%	0.385	S	S	*	.			trans	-37.8	142.5	179.9	0	0	0	0	0	110.2	E190	A188-E190 PolarHBondContact O-N 2.94Å
189	N	53.5	Low	79.9	Confident	125 Å²	125	71 Å²	71	67%	0.668	38%	0.378	S	S	*	.	S	Bend	trans	-47.7	8.2	-166.8	-84.1	-34.8	0	0	0	118.4	K166	K166-N189 PolarHBondContact NZ-OD1 2.72Å
190	E	62.1	Low	79.8	Confident	106 Å²	106	67.9 Å²	67.9	50%	0.495	35%	0.352	S	S	.	.			trans	-146.3	49.8	-161.3	-57.4	-178.2	-174.9	0	0	110.6	A188 N192 W207 P208	A188-E190 PolarHBondContact O-N 2.94Å; E190-N192 VanDerWaalsContact C-N 3.27Å; E190-N192 PolarHBondContact O-N 2.88Å; E190-N192 PolarHBondContact O-OD1 2.82Å; E190-W207 VanDerWaalsContact O-CD1 3.31Å; E190-P208 HydrophobicContact CB-CG 3.94Å; E190-P208 WeakPolarHBondContact O-CD 3.28Å; E190-P208 WeakPolarHBondContact OE2-CG 3.43Å
191	A	63.3	Low	79.7	Confident	14 Å²	14	62.7 Å²	62.7	12%	0.116	33%	0.334	C	S	.	.			trans	-69	95.9	162.7	0	0	0	0	0	107.2	I162 L184	I162-A191 HydrophobicContact CD1-CB 3.32Å; I162-A191 HydrophobicContact CG1-CB 4.22Å; L184-A191 HydrophobicContact CD1-CB 4.05Å
192	N	85.4	Confident	79.7	Confident	62 Å²	62	61.4 Å²	61.4	33%	0.332	32%	0.321	S	S	.	.			trans	-86.1	-35.6	-166.6	-70.6	-20.3	0	0	0	111	Q148 E190 I206	Q148-N192 WeakPolarHBondContact CB-O 3.43Å; E190-N192 VanDerWaalsContact C-N 3.27Å; E190-N192 PolarHBondContact O-N 2.88Å; E190-N192 PolarHBondContact O-OD1 2.82Å; N192-I206 PolarHBondContact N-O 2.88Å
193	K	92.9	Very high	79.9	Confident	79 Å²	79	59.1 Å²	59.1	34%	0.343	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.4	-177.3	-60.1	-164.3	-166.6	-178.1	0	114.1	I206 D246	K193-I206 HydrophobicContact CB-CB 4.2Å; K193-I206 HydrophobicContact CB-CD1 4.24Å; K193-I206 PolarHBondContact N-O 2.94Å; K193-I206 PolarHBondContact O-N 3.47Å; K193-D246 VanDerWaalsContact CD-CG 3.47Å; K193-D246 WeakPolarHBondContact CD-OD1 3.48Å; K193-D246 VanDerWaalsContact CD-OD2 3.24Å; K193-D246 WeakPolarHBondContact CD-OD2 3.32Å; K193-D246 VanDerWaalsContact CE-OD2 3.28Å; K193-D246 WeakPolarHBondContact CE-OD2 3.36Å; K193-D246 IonicContact NZ-OD1 2.49Å; K193-D246 IonicContact NZ-OD2 3.13Å; K193-D246 PolarHBondContact NZ-OD2 2.71Å
194	I	95	Very high	80.2	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.8	171.1	52.3	169.2	0	0	0	109.5	S149 A151 F160 I162 F168 L203 L204 F205	S149-I194 PolarHBondContact OG-N 2.93Å; S149-I194 VanDerWaalsContact OG-N 3.17Å; S149-I194 PolarHBondContact OG-O 2.75Å; A151-I194 HydrophobicContact CB-CD1 3.96Å; A151-I194 HydrophobicContact CB-CG1 4.06Å; F160-I194 HydrophobicContact CB-CD1 3.62Å; F160-I194 WeakPolarHBondContact O-CD1 3.24Å; I162-I194 HydrophobicContact CB-CG2 4.26Å; I162-I194 HydrophobicContact CD1-CG2 3.92Å; I162-I194 HydrophobicContact CG2-CG2 4.45Å; F168-I194 HydrophobicContact CE2-CD1 4.41Å; I194-L203 HydrophobicContact CB-CD1 4.5Å; I194-L204 VanDerWaalsContact CA-O 3.26Å; I194-L204 WeakPolarHBondContact CA-O 3.41Å; I194-F205 HydrophobicContact CG2-CD1 3.94Å; I194-F205 HydrophobicContact CG2-CE1 4.03Å; I194-F205 HydrophobicContact CG2-CG 4.31Å; I194-F205 HydrophobicContact CG2-CZ 4.47Å
195	S	95.6	Very high	80.8	Confident	34 Å²	34	50.9 Å²	50.9	24%	0.238	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	131.1	179.5	-170.9	0	0	0	0	110.5	L203 L204	S195-L203 CarbonylContact O-C 3.52Å; S195-L203 WeakPolarHBondContact O-CA 3.4Å; S195-L203 WeakPolarHBondContact O-CD1 3.26Å; S195-L204 PolarHBondContact N-O 2.86Å; S195-L204 PolarHBondContact O-N 2.77Å
196	M	95.9	Very high	82.1	Confident	26 Å²	26	43.2 Å²	43.2	13%	0.128	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138	179.9	-178.4	58	74	0	0	109.9	A151 H153 F160 L203 L216	A151-M196 HydrophobicContact CB-CB 4.02Å; H153-M196 HydrophobicContact CB-CE 4.36Å; F160-M196 HydrophobicContact CD2-CE 3.45Å; F160-M196 VanDerWaalsContact CD2-CE 3.45Å; F160-M196 HydrophobicContact CE2-CE 3.11Å; F160-M196 HydrophobicContact CZ-CE 4.06Å; M196-L203 HydrophobicContact CB-CD1 4.37Å; M196-L203 HydrophobicContact CE-CD1 3.8Å; M196-L203 HydrophobicContact SD-CD1 4.41Å; M196-L216 HydrophobicContact CE-CD1 3.76Å; M196-L216 HydrophobicContact SD-CD1 4.03Å
197	S	94.4	Very high	83.9	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.007	20%	0.203	C	C	.	.			trans	-62.8	148.6	168.9	52.3	0	0	0	0	112	T199 G200 N201 R202 F249 E252	S197-T199 PolarHBondContact O-N 2.85Å; S197-T199 PolarHBondContact OG-OG1 3.45Å; S197-G200 PolarHBondContact O-N 2.89Å; S197-G200 PolarHBondContact OG-N 2.77Å; S197-N201 PolarHBondContact OG-N 3.03Å; S197-N201 VanDerWaalsContact OG-N 3.16Å; S197-R202 WeakPolarHBondContact CB-O 3.49Å; S197-R202 PolarHBondContact N-O 3.5Å; S197-R202 PolarHBondContact OG-N 2.79Å; S197-R202 PolarHBondContact OG-O 3.31Å; S197-F249 VanDerWaalsContact N-CE2 3.33Å; S197-E252 VanDerWaalsContact CB-OE1 3.31Å; S197-E252 WeakPolarHBondContact CB-OE1 3.4Å; S197-E252 WeakPolarHBondContact CB-OE2 3.49Å
198	P	90	Very high	85.6	Confident	58 Å²	58	34.7 Å²	34.7	38%	0.377	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-27.2	178	-15.1	27.7	0	0	0	113.3	P154 G200 E255	P154-P198 VanDerWaalsContact CG-O 3.26Å; P154-P198 WeakPolarHBondContact CG-O 3Å; P198-G200 VanDerWaalsContact C-N 3.32Å; P198-E255 WeakPolarHBondContact CB-OE1 3.44Å
199	T	89.7	Confident	87.6	Confident	35 Å²	35	33.7 Å²	33.7	22%	0.215	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-26.4	172.2	61.2	0	0	0	0	113.4	S197 N201 E252 D254 E255	S197-T199 PolarHBondContact O-N 2.85Å; S197-T199 PolarHBondContact OG-OG1 3.45Å; T199-N201 VanDerWaalsContact C-N 3.29Å; T199-N201 WeakPolarHBondContact OG1-CB 3.35Å; T199-N201 PolarHBondContact OG1-N 3.14Å; T199-N201 VanDerWaalsContact OG1-N 3.13Å; T199-E252 WeakPolarHBondContact CB-OE2 3.4Å; T199-E252 HydrophobicContact CG2-CB 4.3Å; T199-E252 WeakPolarHBondContact CG2-OE2 3.42Å; T199-E252 PolarHBondContact OG1-OE2 3.39Å; T199-D254 HydrophobicContact CG2-CB 4.04Å; T199-E255 HydrophobicContact CG2-CB 4.39Å; T199-E255 HydrophobicContact CG2-CG 3.17Å
200	G	91.4	Very high	89.3	Confident	1 Å²	1	30 Å²	30	1%	0.01	16%	0.159	C	C	.	.	S	Bend	trans	84.5	0.8	-171.3	0	0	0	0	0	113.9	H153 S197 P198	H153-G200 PolarHBondContact CD2-O 2.76Å; H153-G200 PolarHBondContact NE2-O 2.83Å; H153-G200 VanDerWaalsContact NE2-O 3.16Å; S197-G200 PolarHBondContact O-N 2.89Å; S197-G200 PolarHBondContact OG-N 2.77Å; P198-G200 VanDerWaalsContact C-N 3.32Å
201	N	91.3	Very high	90.8	Very high	28 Å²	28	24.9 Å²	24.9	15%	0.15	14%	0.135	C	C	.	.	S	Bend	trans	-84.3	-20.8	-173.3	-58	-18.1	0	0	0	112.7	S197 T199 L216 L217 D254	S197-N201 PolarHBondContact OG-N 3.03Å; S197-N201 VanDerWaalsContact OG-N 3.16Å; T199-N201 VanDerWaalsContact C-N 3.29Å; T199-N201 WeakPolarHBondContact OG1-CB 3.35Å; T199-N201 PolarHBondContact OG1-N 3.14Å; T199-N201 VanDerWaalsContact OG1-N 3.13Å; N201-L216 WeakPolarHBondContact O-CB 3.49Å; N201-L216 PolarHBondContact O-N 2.72Å; N201-L217 HydrophobicContact CB-CD1 3.72Å; N201-L217 HydrophobicContact CB-CG 4Å; N201-L217 VanDerWaalsContact OD1-CD1 3.29Å; N201-L217 WeakPolarHBondContact OD1-CD1 3.46Å; N201-D254 PolarHBondContact ND2-OD2 3.3Å
202	R	93.5	Very high	92.2	Very high	12 Å²	12	24.4 Å²	24.4	5%	0.045	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	150.2	-177.6	-60.6	-58.9	173.6	-64.1	-0.2	113.4	S197 M213 I214 D215 F249 E252	S197-R202 WeakPolarHBondContact CB-O 3.49Å; S197-R202 PolarHBondContact N-O 3.5Å; S197-R202 PolarHBondContact OG-N 2.79Å; S197-R202 PolarHBondContact OG-O 3.31Å; R202-M213 HydrophobicContact CB-CG 4.27Å; R202-M213 HydrophobicContact CG-CG 4.37Å; R202-M213 HydrophobicContact CG-SD 4.31Å; R202-I214 VanDerWaalsContact CA-O 3.29Å; R202-I214 WeakPolarHBondContact CA-O 3.21Å; R202-I214 VanDerWaalsContact CD-O 3.25Å; R202-I214 WeakPolarHBondContact CD-O 3.37Å; R202-D215 VanDerWaalsContact CD-CA 3.5Å; R202-D215 IonicContact CZ-OD1 3.65Å; R202-D215 IonicContact CZ-OD2 2.74Å; R202-D215 IonicContact NE-OD1 3.76Å; R202-D215 PolarHBondContact NE-OD1 3.36Å; R202-D215 IonicContact NE-OD2 3.62Å; R202-D215 PolarHBondContact NE-OD2 3.03Å; R202-D215 IonicContact NH1-OD1 3.49Å; R202-D215 PolarHBondContact NH1-OD1 3.25Å; R202-D215 IonicContact NH1-OD2 3.85Å; R202-D215 IonicContact NH2-OD1 2.77Å; R202-D215 PolarHBondContact NH2-OD1 2.98Å; R202-D215 IonicContact NH2-OD2 3.51Å; R202-D215 PolarHBondContact NH2-OD2 2.8Å; R202-F249 HydrophobicContact CB-CE1 4.17Å; R202-F249 HydrophobicContact CB-CZ 3.84Å; R202-E252 WeakPolarHBondContact CG-OE1 3.44Å
203	L	94.8	Very high	92.6	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.6	173.5	-171	73.1	0	0	0	109.8	A151 F168 I194 S195 M196 F205 I214 L216	A151-L203 HydrophobicContact CB-CD1 4.21Å; F168-L203 HydrophobicContact CE2-CD2 3.98Å; F168-L203 HydrophobicContact CZ-CD2 3.92Å; I194-L203 HydrophobicContact CB-CD1 4.5Å; S195-L203 CarbonylContact O-C 3.52Å; S195-L203 WeakPolarHBondContact O-CA 3.4Å; S195-L203 WeakPolarHBondContact O-CD1 3.26Å; M196-L203 HydrophobicContact CB-CD1 4.37Å; M196-L203 HydrophobicContact CE-CD1 3.8Å; M196-L203 HydrophobicContact SD-CD1 4.41Å; L203-F205 HydrophobicContact CD2-CD2 4.17Å; L203-F205 HydrophobicContact CD2-CE2 3.51Å; L203-F205 HydrophobicContact CD2-CZ 4.11Å; L203-F205 HydrophobicContact CG-CD2 4.47Å; L203-F205 HydrophobicContact CG-CE2 4.27Å; L203-I214 PolarHBondContact N-O 2.94Å; L203-I214 PolarHBondContact O-N 3.03Å; L203-L216 HydrophobicContact CB-CD1 4.27Å; L203-L216 HydrophobicContact CB-CD2 4.4Å; L203-L216 HydrophobicContact CB-CG 4.44Å
204	L	95	Very high	92.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.6	166.9	-65.4	-179.2	0	0	0	109.7	I194 S195 I206 F211 D212 M213 P247 F249 V269	I194-L204 VanDerWaalsContact CA-O 3.26Å; I194-L204 WeakPolarHBondContact CA-O 3.41Å; S195-L204 PolarHBondContact N-O 2.86Å; S195-L204 PolarHBondContact O-N 2.77Å; L204-I206 HydrophobicContact CB-CD1 4.44Å; L204-I206 HydrophobicContact CB-CG1 4.19Å; L204-F211 HydrophobicContact CD2-CD2 3.82Å; L204-F211 HydrophobicContact CD2-CE2 4.19Å; L204-D212 WeakPolarHBondContact CA-O 3.25Å; L204-M213 HydrophobicContact CD2-CB 3.69Å; L204-M213 HydrophobicContact CD2-CE 3.97Å; L204-M213 HydrophobicContact CD2-CG 4.01Å; L204-P247 HydrophobicContact CD1-CB 4.14Å; L204-F249 HydrophobicContact CB-CE2 4.34Å; L204-F249 HydrophobicContact CD1-CD2 4.1Å; L204-F249 HydrophobicContact CD1-CE2 3.87Å; L204-F249 HydrophobicContact CD1-CZ 4.17Å; L204-F249 HydrophobicContact CD2-CE2 4.43Å; L204-F249 HydrophobicContact CD2-CZ 4.03Å; L204-F249 HydrophobicContact CG-CD2 4.25Å; L204-F249 HydrophobicContact CG-CE1 4.41Å; L204-F249 HydrophobicContact CG-CE2 3.51Å; L204-F249 HydrophobicContact CG-CZ 3.6Å; L204-V269 HydrophobicContact CD1-CG1 4.13Å; L204-V269 HydrophobicContact CD1-CG2 4.2Å
205	F	93.5	Very high	92.2	Very high	14 Å²	14	19.3 Å²	19.3	6%	0.061	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.7	158.8	-79.6	-103.3	0	0	0	108.7	I162 F168 I194 L203 W207 F211 D212 I214	I162-F205 HydrophobicContact CD1-CD1 3.74Å; I162-F205 HydrophobicContact CD1-CE1 3.69Å; F168-F205 HydrophobicContact CB-CE1 4.37Å; F168-F205 HydrophobicContact CD1-CZ 4.24Å; F168-F205 AromaticContact CD2-CE1 3.72Å; F168-F205 HydrophobicContact CD2-CE1 3.72Å; F168-F205 AromaticContact CD2-CZ 3.52Å; F168-F205 HydrophobicContact CD2-CZ 3.52Å; F168-F205 HydrophobicContact CE1-CZ 4.24Å; F168-F205 HydrophobicContact CE2-CE1 4.11Å; F168-F205 HydrophobicContact CE2-CE2 4.33Å; F168-F205 AromaticContact CE2-CZ 3.5Å; F168-F205 HydrophobicContact CE2-CZ 3.5Å; F168-F205 HydrophobicContact CG-CE1 4.09Å; F168-F205 AromaticContact CG-CZ 3.87Å; F168-F205 HydrophobicContact CG-CZ 3.87Å; F168-F205 HydrophobicContact CZ-CE2 4.49Å; F168-F205 AromaticContact CZ-CZ 3.86Å; F168-F205 HydrophobicContact CZ-CZ 3.86Å; I194-F205 HydrophobicContact CG2-CD1 3.94Å; I194-F205 HydrophobicContact CG2-CE1 4.03Å; I194-F205 HydrophobicContact CG2-CG 4.31Å; I194-F205 HydrophobicContact CG2-CZ 4.47Å; L203-F205 HydrophobicContact CD2-CD2 4.17Å; L203-F205 HydrophobicContact CD2-CE2 3.51Å; L203-F205 HydrophobicContact CD2-CZ 4.11Å; L203-F205 HydrophobicContact CG-CD2 4.47Å; L203-F205 HydrophobicContact CG-CE2 4.27Å; F205-W207 HydrophobicContact CB-CH2 3.26Å; F205-W207 HydrophobicContact CB-CZ2 3.52Å; F205-W207 HydrophobicContact CB-CZ3 4.01Å; F205-W207 HydrophobicContact CD1-CZ2 4.35Å; F205-W207 HydrophobicContact CG-CH2 4.28Å; F205-W207 HydrophobicContact CG-CZ2 4.3Å; F205-W207 VanDerWaalsContact O-CZ3 3.27Å; F205-W207 WeakPolarHBondContact O-CZ3 3.36Å; F205-F211 CarbonylContact O-C 3.59Å; F205-F211 WeakPolarHBondContact O-CA 3.36Å; F205-F211 VanDerWaalsContact O-CB 3.25Å; F205-F211 WeakPolarHBondContact O-CB 3.25Å; F205-D212 PolarHBondContact N-O 3.48Å; F205-D212 PolarHBondContact O-N 3.06Å; F205-I214 HydrophobicContact CD2-CD1 3.43Å; F205-I214 VanDerWaalsContact CD2-CD1 3.43Å; F205-I214 HydrophobicContact CD2-CG1 4.1Å; F205-I214 HydrophobicContact CE2-CD1 3.45Å; F205-I214 VanDerWaalsContact CE2-CD1 3.45Å; F205-I214 HydrophobicContact CE2-CG1 4.42Å; F205-I214 HydrophobicContact CG-CD1 4.47Å
206	I	93.5	Very high	91.8	Very high	6 Å²	6	20.3 Å²	20.3	3%	0.031	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.1	-171.9	-58.4	161.5	0	0	0	109.1	N192 K193 L204 F211 D246 P247	N192-I206 PolarHBondContact N-O 2.88Å; K193-I206 HydrophobicContact CB-CB 4.2Å; K193-I206 HydrophobicContact CB-CD1 4.24Å; K193-I206 PolarHBondContact N-O 2.94Å; K193-I206 PolarHBondContact O-N 3.47Å; L204-I206 HydrophobicContact CB-CD1 4.44Å; L204-I206 HydrophobicContact CB-CG1 4.19Å; I206-F211 HydrophobicContact CG1-CB 4.2Å; I206-D246 HydrophobicContact CD1-CB 4.28Å; I206-P247 HydrophobicContact CG1-CG 4.27Å; I206-P247 HydrophobicContact CG2-CG 4.26Å
207	W	89.9	Confident	90.9	Very high	12 Å²	12	23.7 Å²	23.7	5%	0.045	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	168.9	171.3	-62.4	-81	0	0	0	109.8	L187 E190 F205 N209 K210 D212	L187-W207 HydrophobicContact CB-CZ2 4.23Å; L187-W207 HydrophobicContact CD2-CH2 3.51Å; L187-W207 HydrophobicContact CD2-CZ2 3.08Å; L187-W207 HydrophobicContact CG-CZ2 4.21Å; E190-W207 VanDerWaalsContact O-CD1 3.31Å; F205-W207 HydrophobicContact CB-CH2 3.26Å; F205-W207 HydrophobicContact CB-CZ2 3.52Å; F205-W207 HydrophobicContact CB-CZ3 4.01Å; F205-W207 HydrophobicContact CD1-CZ2 4.35Å; F205-W207 HydrophobicContact CG-CH2 4.28Å; F205-W207 HydrophobicContact CG-CZ2 4.3Å; F205-W207 VanDerWaalsContact O-CZ3 3.27Å; F205-W207 WeakPolarHBondContact O-CZ3 3.36Å; W207-N209 VanDerWaalsContact C-N 3.28Å; W207-N209 PolarHBondContact O-N 2.79Å; W207-K210 WeakPolarHBondContact CA-O 2.94Å; W207-K210 HydrophobicContact CB-CB 4.15Å; W207-K210 WeakPolarHBondContact CB-O 3.38Å; W207-K210 HydrophobicContact CE3-CB 3.88Å; W207-K210 HydrophobicContact CE3-CD 3.81Å; W207-K210 HydrophobicContact CE3-CG 3.96Å; W207-K210 HydrophobicContact CZ3-CD 4.1Å; W207-K210 HydrophobicContact CZ3-CG 4.42Å; W207-K210 PolarHBondContact N-O 2.92Å; W207-K210 VanDerWaalsContact O-O 3.08Å; W207-D212 HydrophobicContact CH2-CB 3.6Å; W207-D212 VanDerWaalsContact CH2-CG 3.42Å; W207-D212 WeakPolarHBondContact CH2-OD2 3.37Å; W207-D212 HydrophobicContact CZ3-CB 3.53Å; W207-D212 VanDerWaalsContact CZ3-N 3.3Å; W207-D212 WeakPolarHBondContact CZ3-OD2 3.45Å
208	P	88.5	Confident	89	Confident	32 Å²	32	25.1 Å²	25.1	21%	0.208	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-48.2	177.4	-27.4	26.9	0	0	0	113.7	E190 P242 L243	E190-P208 HydrophobicContact CB-CG 3.94Å; E190-P208 WeakPolarHBondContact O-CD 3.28Å; E190-P208 WeakPolarHBondContact OE2-CG 3.43Å; P208-P242 HydrophobicContact CB-CB 4.17Å; P208-P242 HydrophobicContact CB-CG 4.39Å; P208-P242 CarbonylContact O-C 3.55Å; P208-P242 WeakPolarHBondContact O-CA 3.42Å; P208-L243 PolarHBondContact O-N 2.94Å
209	N	89.9	Confident	87.1	Confident	54 Å²	54	24.2 Å²	24.2	29%	0.289	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	17.2	-173.8	65.9	-12.7	0	0	0	113.5	W207 Q238 F239 N241	W207-N209 VanDerWaalsContact C-N 3.28Å; W207-N209 PolarHBondContact O-N 2.79Å; N209-Q238 PolarHBondContact ND2-NE2 2.93Å; N209-Q238 PolarHBondContact O-NE2 3.05Å; N209-Q238 PolarHBondContact OD1-NE2 2.64Å; N209-Q238 VanDerWaalsContact OD1-NE2 3.09Å; N209-F239 PolarHBondContact O-N 2.89Å; N209-N241 WeakPolarHBondContact CB-O 3.34Å
210	K	90.8	Very high	85	Confident	47 Å²	47	27.6 Å²	27.6	20%	0.204	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	154.5	-176	-168.4	-161.9	174.9	-154	0	110.4	W207 D212 V237 Q238	W207-K210 WeakPolarHBondContact CA-O 2.94Å; W207-K210 HydrophobicContact CB-CB 4.15Å; W207-K210 WeakPolarHBondContact CB-O 3.38Å; W207-K210 HydrophobicContact CE3-CB 3.88Å; W207-K210 HydrophobicContact CE3-CD 3.81Å; W207-K210 HydrophobicContact CE3-CG 3.96Å; W207-K210 HydrophobicContact CZ3-CD 4.1Å; W207-K210 HydrophobicContact CZ3-CG 4.42Å; W207-K210 PolarHBondContact N-O 2.92Å; W207-K210 VanDerWaalsContact O-O 3.08Å; K210-D212 WeakPolarHBondContact CE-OD1 3.08Å; K210-D212 IonicContact NZ-OD1 3.43Å; K210-D212 PolarHBondContact NZ-OD1 2.78Å; K210-D212 IonicContact NZ-OD2 3.07Å; K210-D212 PolarHBondContact NZ-OD2 3.08Å; K210-V237 CarbonylContact C-O 3.49Å; K210-V237 WeakPolarHBondContact CA-O 3.3Å; K210-V237 WeakPolarHBondContact CG-O 3.17Å; K210-Q238 VanDerWaalsContact CB-OE1 3.25Å; K210-Q238 HydrophobicContact CG-CB 4.37Å
211	F	93.8	Very high	82.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.1	157.6	67.3	-89.2	0	0	0	112	L204 F205 I206 V237 F239 P247 V269 V271 I280 F282	L204-F211 HydrophobicContact CD2-CD2 3.82Å; L204-F211 HydrophobicContact CD2-CE2 4.19Å; F205-F211 CarbonylContact O-C 3.59Å; F205-F211 WeakPolarHBondContact O-CA 3.36Å; F205-F211 VanDerWaalsContact O-CB 3.25Å; F205-F211 WeakPolarHBondContact O-CB 3.25Å; I206-F211 HydrophobicContact CG1-CB 4.2Å; F211-V237 HydrophobicContact CD1-CB 4.23Å; F211-V237 HydrophobicContact CE1-CB 3.72Å; F211-V237 HydrophobicContact CE1-CG1 4.16Å; F211-V237 HydrophobicContact CE1-CG2 4.15Å; F211-V237 HydrophobicContact CE2-CB 4.43Å; F211-V237 HydrophobicContact CE2-CG2 4.19Å; F211-V237 HydrophobicContact CZ-CB 3.85Å; F211-V237 HydrophobicContact CZ-CG2 3.74Å; F211-V237 PolarHBondContact N-O 3.03Å; F211-V237 PolarHBondContact O-N 2.5Å; F211-F239 AromaticContact CD1-CE2 3.95Å; F211-F239 HydrophobicContact CD1-CE2 3.95Å; F211-F239 AromaticContact CE1-CE2 3.77Å; F211-F239 HydrophobicContact CE1-CE2 3.77Å; F211-F239 HydrophobicContact CE1-CZ 4.05Å; F211-P247 HydrophobicContact CB-CG 4.03Å; F211-P247 HydrophobicContact CD1-CB 3.92Å; F211-P247 HydrophobicContact CD1-CG 3.39Å; F211-P247 HydrophobicContact CE1-CB 4.17Å; F211-P247 HydrophobicContact CE1-CG 3.97Å; F211-P247 HydrophobicContact CG-CB 4.1Å; F211-P247 HydrophobicContact CG-CG 3.79Å; F211-V269 HydrophobicContact CE2-CB 4.46Å; F211-V269 HydrophobicContact CE2-CG1 4.17Å; F211-V269 HydrophobicContact CE2-CG2 4.33Å; F211-V269 HydrophobicContact CZ-CB 4.34Å; F211-V269 HydrophobicContact CZ-CG1 3.98Å; F211-V271 HydrophobicContact CE1-CG2 3.81Å; F211-V271 HydrophobicContact CZ-CG2 4.28Å; F211-I280 HydrophobicContact CE1-CD1 4.14Å; F211-I280 HydrophobicContact CZ-CD1 4.04Å; F211-F282 HydrophobicContact CD2-CZ 4.41Å; F211-F282 AromaticContact CE2-CE2 3.7Å; F211-F282 HydrophobicContact CE2-CE2 3.7Å; F211-F282 AromaticContact CE2-CZ 3.45Å; F211-F282 HydrophobicContact CE2-CZ 3.45Å; F211-F282 VanDerWaalsContact CE2-CZ 3.45Å; F211-F282 AromaticContact CZ-CE2 3.99Å; F211-F282 HydrophobicContact CZ-CE2 3.99Å; F211-F282 AromaticContact CZ-CZ 3.98Å; F211-F282 HydrophobicContact CZ-CZ 3.98Å
212	D	91.9	Very high	80.2	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.4	179.1	-69.6	-27.4	0	0	0	107.9	L204 F205 W207 K210 I233 S236	L204-D212 WeakPolarHBondContact CA-O 3.25Å; F205-D212 PolarHBondContact N-O 3.48Å; F205-D212 PolarHBondContact O-N 3.06Å; W207-D212 HydrophobicContact CH2-CB 3.6Å; W207-D212 VanDerWaalsContact CH2-CG 3.42Å; W207-D212 WeakPolarHBondContact CH2-OD2 3.37Å; W207-D212 HydrophobicContact CZ3-CB 3.53Å; W207-D212 VanDerWaalsContact CZ3-N 3.3Å; W207-D212 WeakPolarHBondContact CZ3-OD2 3.45Å; K210-D212 WeakPolarHBondContact CE-OD1 3.08Å; K210-D212 IonicContact NZ-OD1 3.43Å; K210-D212 PolarHBondContact NZ-OD1 2.78Å; K210-D212 IonicContact NZ-OD2 3.07Å; K210-D212 PolarHBondContact NZ-OD2 3.08Å; D212-I233 HydrophobicContact CB-CG2 4.35Å; D212-S236 WeakPolarHBondContact OD1-CA 3.36Å; D212-S236 WeakPolarHBondContact OD1-CB 3.3Å; D212-S236 PolarHBondContact OD1-OG 2.98Å
213	M	93.1	Very high	77.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125	171.1	-175.2	178.9	-65.7	0	0	109.1	R202 L204 I233 V234 G235 F249 A267 V269 F282	R202-M213 HydrophobicContact CB-CG 4.27Å; R202-M213 HydrophobicContact CG-CG 4.37Å; R202-M213 HydrophobicContact CG-SD 4.31Å; L204-M213 HydrophobicContact CD2-CB 3.69Å; L204-M213 HydrophobicContact CD2-CE 3.97Å; L204-M213 HydrophobicContact CD2-CG 4.01Å; M213-I233 CarbonylContact O-C 3.54Å; M213-I233 WeakPolarHBondContact O-CA 3.36Å; M213-V234 HydrophobicContact CB-CB 4.26Å; M213-V234 HydrophobicContact CG-CB 4.13Å; M213-V234 HydrophobicContact CG-CG2 4.26Å; M213-V234 PolarHBondContact O-N 2.87Å; M213-V234 HydrophobicContact SD-CB 4.32Å; M213-V234 HydrophobicContact SD-CG1 4.26Å; M213-G235 PolarHBondContact N-O 3.04Å; M213-F249 HydrophobicContact CE-CE1 3.86Å; M213-F249 HydrophobicContact CE-CZ 4.45Å; M213-A267 HydrophobicContact CE-CB 3.93Å; M213-A267 HydrophobicContact SD-CB 3.93Å; M213-V269 HydrophobicContact CE-CG2 3.6Å; M213-F282 HydrophobicContact CB-CD1 4.27Å; M213-F282 HydrophobicContact CB-CE1 3.97Å; M213-F282 HydrophobicContact CB-CZ 4.42Å; M213-F282 HydrophobicContact CE-CB 4.25Å; M213-F282 HydrophobicContact CE-CD1 4.12Å; M213-F282 HydrophobicContact CE-CD2 3.61Å; M213-F282 HydrophobicContact CE-CE1 4.36Å; M213-F282 HydrophobicContact CE-CE2 3.91Å; M213-F282 HydrophobicContact CE-CG 3.73Å; M213-F282 HydrophobicContact CE-CZ 4.27Å; M213-F282 HydrophobicContact SD-CB 4.15Å; M213-F282 HydrophobicContact SD-CD1 4.03Å; M213-F282 HydrophobicContact SD-CD2 4.46Å; M213-F282 HydrophobicContact SD-CG 3.97Å
214	I	91.2	Very high	75.2	Confident	31 Å²	31	49.1 Å²	49.1	16%	0.159	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135	-178.8	-56.3	-169.2	0	0	0	109.6	R202 L203 F205 A231 F232 I233	R202-I214 VanDerWaalsContact CA-O 3.29Å; R202-I214 WeakPolarHBondContact CA-O 3.21Å; R202-I214 VanDerWaalsContact CD-O 3.25Å; R202-I214 WeakPolarHBondContact CD-O 3.37Å; L203-I214 PolarHBondContact N-O 2.94Å; L203-I214 PolarHBondContact O-N 3.03Å; F205-I214 HydrophobicContact CD2-CD1 3.43Å; F205-I214 VanDerWaalsContact CD2-CD1 3.43Å; F205-I214 HydrophobicContact CD2-CG1 4.1Å; F205-I214 HydrophobicContact CE2-CD1 3.45Å; F205-I214 VanDerWaalsContact CE2-CD1 3.45Å; F205-I214 HydrophobicContact CE2-CG1 4.42Å; F205-I214 HydrophobicContact CG-CD1 4.47Å; I214-A231 HydrophobicContact CG2-CB 3.93Å; I214-F232 WeakPolarHBondContact CA-O 3.37Å; I214-I233 HydrophobicContact CG1-CG1 4.42Å
215	D	89.2	Confident	72.8	Confident	9 Å²	9	56.7 Å²	56.7	5%	0.048	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	124.8	170.7	-156.2	-16.9	0	0	0	112	R202 L217 A231 F232 V234	R202-D215 VanDerWaalsContact CD-CA 3.5Å; R202-D215 IonicContact CZ-OD1 3.65Å; R202-D215 IonicContact CZ-OD2 2.74Å; R202-D215 IonicContact NE-OD1 3.76Å; R202-D215 PolarHBondContact NE-OD1 3.36Å; R202-D215 IonicContact NE-OD2 3.62Å; R202-D215 PolarHBondContact NE-OD2 3.03Å; R202-D215 IonicContact NH1-OD1 3.49Å; R202-D215 PolarHBondContact NH1-OD1 3.25Å; R202-D215 IonicContact NH1-OD2 3.85Å; R202-D215 IonicContact NH2-OD1 2.77Å; R202-D215 PolarHBondContact NH2-OD1 2.98Å; R202-D215 IonicContact NH2-OD2 3.51Å; R202-D215 PolarHBondContact NH2-OD2 2.8Å; D215-L217 PolarHBondContact OD1-N 3.23Å; D215-A231 WeakPolarHBondContact O-CA 3.17Å; D215-A231 VanDerWaalsContact O-CB 3.29Å; D215-A231 WeakPolarHBondContact O-CB 3.47Å; D215-F232 HydrophobicContact CB-CD1 4.1Å; D215-F232 HydrophobicContact CB-CE1 3.7Å; D215-F232 HydrophobicContact CB-CE2 4.37Å; D215-F232 HydrophobicContact CB-CZ 3.85Å; D215-F232 PolarHBondContact N-O 3.15Å; D215-F232 WeakPolarHBondContact OD2-CZ 3.47Å; D215-V234 HydrophobicContact CB-CG2 3.85Å
216	L	87.4	Confident	70.4	Confident	56 Å²	56	60.2 Å²	60.2	29%	0.293	35%	0.349	S	S	.	.	S	Bend	trans	-95.1	-14.8	173.6	-57.7	-177.7	0	0	0	112.3	F160 M196 N201 L203	F160-L216 HydrophobicContact CZ-CD1 4.32Å; M196-L216 HydrophobicContact CE-CD1 3.76Å; M196-L216 HydrophobicContact SD-CD1 4.03Å; N201-L216 WeakPolarHBondContact O-CB 3.49Å; N201-L216 PolarHBondContact O-N 2.72Å; L203-L216 HydrophobicContact CB-CD1 4.27Å; L203-L216 HydrophobicContact CB-CD2 4.4Å; L203-L216 HydrophobicContact CB-CG 4.44Å
217	L	76.9	Confident	67.9	Low	96 Å²	96	65.6 Å²	65.6	50%	0.503	39%	0.387	S	S	.	.			trans	-100.4	81.4	177	-65.3	-175.4	0	0	0	110.3	N201 D215	N201-L217 HydrophobicContact CB-CD1 3.72Å; N201-L217 HydrophobicContact CB-CG 4Å; N201-L217 VanDerWaalsContact OD1-CD1 3.29Å; N201-L217 WeakPolarHBondContact OD1-CD1 3.46Å; D215-L217 PolarHBondContact OD1-N 3.23Å
218	S	54.7	Low	65.7	Low	31 Å²	31	71.9 Å²	71.9	22%	0.217	42%	0.415	C	S	.	.			trans	-77.1	127.2	166.7	54.4	0	0	0	0	110.8	N229	S218-N229 PolarHBondContact O-OD1 2.86Å; S218-N229 VanDerWaalsContact OG-CA 3.26Å; S218-N229 WeakPolarHBondContact OG-CA 3.27Å; S218-N229 WeakPolarHBondContact OG-CB 3.46Å; S218-N229 PolarHBondContact OG-OD1 2.93Å
219	G	48.3	Very low	63.7	Low	40 Å²	40	76.2 Å²	76.2	41%	0.412	44%	0.436	S	S	.	.			trans	103	33.1	144.7	0	0	0	0	0	121.1
220	S	45.6	Very low	62.1	Low	106 Å²	106	79.3 Å²	79.3	74%	0.741	45%	0.449	S	S	*	.	S	Bend	trans	-84.4	-10.6	164.2	62.1	0	0	0	0	114.4
221	Q	42.6	Very low	60.9	Low	180 Å²	180	80.1 Å²	80.1	84%	0.841	47%	0.465	S	S	*	.	S	Bend	trans	-141.9	24.8	-176.2	-68.9	-68.2	-9.2	0	0	113.8
222	I	39.6	Very low	60.1	Low	107 Å²	107	84.2 Å²	84.2	55%	0.549	48%	0.482	S	S	.	.	S	Bend	trans	-105	125.7	168.8	-56.4	175	0	0	0	106.5	T226	I222-T226 VanDerWaalsContact CG2-OG1 3.31Å; I222-T226 WeakPolarHBondContact CG2-OG1 3.44Å
223	S	37.5	Very low	59.7	Low	75 Å²	75	88.4 Å²	88.4	52%	0.524	50%	0.504	S	S	.	.			trans	-40	142.9	-178.3	48.7	0	0	0	0	113.1	D225 T226	S223-D225 PolarHBondContact O-N 3.4Å; S223-T226 PolarHBondContact O-N 2.56Å; S223-T226 PolarHBondContact O-OG1 3.42Å
224	P	46.6	Very low	59.4	Low	133 Å²	133	88.7 Å²	88.7	86%	0.864	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-12.5	-173.3	19.7	-31.2	0	0	0	115.5
225	D	44.7	Very low	59.3	Low	158 Å²	158	87.7 Å²	87.7	85%	0.845	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-4.8	179.8	-88.1	-15.7	0	0	0	115.9	S223	S223-D225 PolarHBondContact O-N 3.4Å
226	T	43.5	Very low	59.4	Low	88 Å²	88	89.8 Å²	89.8	54%	0.54	52%	0.518	S	S	.	.			trans	-107	84.7	174.2	5.6	0	0	0	0	110.3	I222 S223 K228	I222-T226 VanDerWaalsContact CG2-OG1 3.31Å; I222-T226 WeakPolarHBondContact CG2-OG1 3.44Å; S223-T226 PolarHBondContact O-N 2.56Å; S223-T226 PolarHBondContact O-OG1 3.42Å; T226-K228 PolarHBondContact O-N 3.32Å
227	S	39.8	Very low	59.6	Low	119 Å²	119	87.9 Å²	87.9	83%	0.832	51%	0.509	S	S	*	.			trans	-68.4	27	-177.8	58	0	0	0	0	115.6
228	K	43.3	Very low	60.4	Low	145 Å²	145	88.5 Å²	88.5	63%	0.63	51%	0.509	S	S	*	.			trans	-126.8	97.6	179	-67.5	-160.2	-173	175.3	0	110.7	T226 E230	T226-K228 PolarHBondContact O-N 3.32Å; K228-E230 HydrophobicContact CB-CG 4.03Å; K228-E230 HydrophobicContact CD-CG 4.49Å; K228-E230 WeakPolarHBondContact CD-OE1 3.36Å; K228-E230 IonicContact NZ-OE1 3.3Å; K228-E230 PolarHBondContact O-N 3.11Å
229	N	46.4	Very low	62.1	Low	122 Å²	122	87.8 Å²	87.8	65%	0.652	50%	0.502	S	S	*	.			trans	-64.7	69.2	160.4	-89.3	1.2	0	0	0	109.6	S218	S218-N229 PolarHBondContact O-OD1 2.86Å; S218-N229 VanDerWaalsContact OG-CA 3.26Å; S218-N229 WeakPolarHBondContact OG-CA 3.27Å; S218-N229 WeakPolarHBondContact OG-CB 3.46Å; S218-N229 PolarHBondContact OG-OD1 2.93Å
230	E	56.3	Low	64.1	Low	120 Å²	120	91.6 Å²	91.6	56%	0.561	52%	0.52	S	S	*	.			trans	-86.8	126.7	175.5	-82	174.3	-169.4	0	0	109	K228 F232	K228-E230 HydrophobicContact CB-CG 4.03Å; K228-E230 HydrophobicContact CD-CG 4.49Å; K228-E230 WeakPolarHBondContact CD-OE1 3.36Å; K228-E230 IonicContact NZ-OE1 3.3Å; K228-E230 PolarHBondContact O-N 3.11Å; E230-F232 PolarHBondContact O-N 3.05Å
231	A	65.7	Low	66.2	Low	64 Å²	64	91.9 Å²	91.9	53%	0.529	51%	0.513	S	S	.	.			trans	-62.8	126.1	165.8	0	0	0	0	0	108.3	I214 D215	I214-A231 HydrophobicContact CG2-CB 3.93Å; D215-A231 WeakPolarHBondContact O-CA 3.17Å; D215-A231 VanDerWaalsContact O-CB 3.29Å; D215-A231 WeakPolarHBondContact O-CB 3.47Å
232	F	77.8	Confident	68.3	Low	85 Å²	85	87.1 Å²	87.1	37%	0.373	50%	0.497	S	S	.	.			trans	-116.1	156.3	179.5	68.6	-85.9	0	0	0	110.8	I214 D215 E230 V234	I214-F232 WeakPolarHBondContact CA-O 3.37Å; D215-F232 HydrophobicContact CB-CD1 4.1Å; D215-F232 HydrophobicContact CB-CE1 3.7Å; D215-F232 HydrophobicContact CB-CE2 4.37Å; D215-F232 HydrophobicContact CB-CZ 3.85Å; D215-F232 PolarHBondContact N-O 3.15Å; D215-F232 WeakPolarHBondContact OD2-CZ 3.47Å; E230-F232 PolarHBondContact O-N 3.05Å; F232-V234 HydrophobicContact CE2-CG2 4.27Å; F232-V234 PolarHBondContact O-N 2.9Å
233	I	83.3	Confident	70.7	Confident	91 Å²	91	83.3 Å²	83.3	47%	0.467	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.1	174.9	-62.3	172.7	0	0	0	107.3	D212 M213 I214 G235	D212-I233 HydrophobicContact CB-CG2 4.35Å; M213-I233 CarbonylContact O-C 3.54Å; M213-I233 WeakPolarHBondContact O-CA 3.36Å; I214-I233 HydrophobicContact CG1-CG1 4.42Å; I233-G235 VanDerWaalsContact C-N 3.29Å
234	V	87	Confident	73.2	Confident	7 Å²	7	81 Å²	81	4%	0.042	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	-41.7	173.2	-178.9	0	0	0	0	109.8	M213 D215 F232 F282 V284	M213-V234 HydrophobicContact CB-CB 4.26Å; M213-V234 HydrophobicContact CG-CB 4.13Å; M213-V234 HydrophobicContact CG-CG2 4.26Å; M213-V234 PolarHBondContact O-N 2.87Å; M213-V234 HydrophobicContact SD-CB 4.32Å; M213-V234 HydrophobicContact SD-CG1 4.26Å; D215-V234 HydrophobicContact CB-CG2 3.85Å; F232-V234 HydrophobicContact CE2-CG2 4.27Å; F232-V234 PolarHBondContact O-N 2.9Å; V234-F282 HydrophobicContact CG1-CD1 4.34Å; V234-V284 HydrophobicContact CG1-CG2 4.45Å
235	G	88.7	Confident	75.4	Confident	9 Å²	9	75 Å²	75	9%	0.093	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	163.1	174.4	0	0	0	0	0	112.6	M213 I233	M213-G235 PolarHBondContact N-O 3.04Å; I233-G235 VanDerWaalsContact C-N 3.29Å
236	S	91	Very high	77.7	Confident	53 Å²	53	70 Å²	70	37%	0.371	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.3	179.4	-65.3	0	0	0	0	109.7	D212 P294	D212-S236 WeakPolarHBondContact OD1-CA 3.36Å; D212-S236 WeakPolarHBondContact OD1-CB 3.3Å; D212-S236 PolarHBondContact OD1-OG 2.98Å; S236-P294 WeakPolarHBondContact O-CG 3.27Å
237	V	93.2	Very high	80.2	Confident	16 Å²	16	65.9 Å²	65.9	10%	0.097	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.2	171.9	-176	0	0	0	0	108.8	K210 F211 F239 I280 F282 P294	K210-V237 CarbonylContact C-O 3.49Å; K210-V237 WeakPolarHBondContact CA-O 3.3Å; K210-V237 WeakPolarHBondContact CG-O 3.17Å; F211-V237 HydrophobicContact CD1-CB 4.23Å; F211-V237 HydrophobicContact CE1-CB 3.72Å; F211-V237 HydrophobicContact CE1-CG1 4.16Å; F211-V237 HydrophobicContact CE1-CG2 4.15Å; F211-V237 HydrophobicContact CE2-CB 4.43Å; F211-V237 HydrophobicContact CE2-CG2 4.19Å; F211-V237 HydrophobicContact CZ-CB 3.85Å; F211-V237 HydrophobicContact CZ-CG2 3.74Å; F211-V237 PolarHBondContact N-O 3.03Å; F211-V237 PolarHBondContact O-N 2.5Å; V237-F239 HydrophobicContact CB-CE2 4.27Å; V237-F239 HydrophobicContact CB-CZ 4.43Å; V237-F239 HydrophobicContact CG1-CD2 4.33Å; V237-F239 HydrophobicContact CG1-CE1 4Å; V237-F239 HydrophobicContact CG1-CE2 3.56Å; V237-F239 HydrophobicContact CG1-CZ 3.39Å; V237-I280 HydrophobicContact CG1-CD1 3.96Å; V237-I280 HydrophobicContact CG2-CD1 4.38Å; V237-I280 HydrophobicContact CG2-CG2 4.19Å; V237-F282 HydrophobicContact CG2-CE1 4.44Å; V237-F282 HydrophobicContact CG2-CE2 4.27Å; V237-F282 HydrophobicContact CG2-CZ 3.64Å; V237-P294 HydrophobicContact CG2-CB 3.58Å; V237-P294 HydrophobicContact CG2-CG 3.46Å; V237-P294 VanDerWaalsContact CG2-CG 3.46Å
238	Q	92.2	Very high	82.9	Confident	110 Å²	110	61.3 Å²	61.3	51%	0.514	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135.9	177.6	-177.4	69.1	49.2	0	0	109.6	N209 K210	N209-Q238 PolarHBondContact ND2-NE2 2.93Å; N209-Q238 PolarHBondContact O-NE2 3.05Å; N209-Q238 PolarHBondContact OD1-NE2 2.64Å; N209-Q238 VanDerWaalsContact OD1-NE2 3.09Å; K210-Q238 VanDerWaalsContact CB-OE1 3.25Å; K210-Q238 HydrophobicContact CG-CB 4.37Å
239	F	91.4	Very high	85.4	Confident	16 Å²	16	55 Å²	55	7%	0.07	31%	0.31	C	S	.	.			trans	-112.3	152	175.4	-58.6	-84.3	0	0	0	110	N209 F211 V237 N241 L243 V271 I273 I280	N209-F239 PolarHBondContact O-N 2.89Å; F211-F239 AromaticContact CD1-CE2 3.95Å; F211-F239 HydrophobicContact CD1-CE2 3.95Å; F211-F239 AromaticContact CE1-CE2 3.77Å; F211-F239 HydrophobicContact CE1-CE2 3.77Å; F211-F239 HydrophobicContact CE1-CZ 4.05Å; V237-F239 HydrophobicContact CB-CE2 4.27Å; V237-F239 HydrophobicContact CB-CZ 4.43Å; V237-F239 HydrophobicContact CG1-CD2 4.33Å; V237-F239 HydrophobicContact CG1-CE1 4Å; V237-F239 HydrophobicContact CG1-CE2 3.56Å; V237-F239 HydrophobicContact CG1-CZ 3.39Å; F239-N241 VanDerWaalsContact C-N 3.29Å; F239-N241 WeakPolarHBondContact CB-O 3.35Å; F239-N241 PolarHBondContact O-N 2.92Å; F239-L243 HydrophobicContact CB-CD2 4.4Å; F239-L243 HydrophobicContact CD1-CD2 4.22Å; F239-L243 HydrophobicContact CD2-CD1 4.14Å; F239-L243 HydrophobicContact CD2-CD2 3.51Å; F239-L243 HydrophobicContact CD2-CG 3.98Å; F239-L243 HydrophobicContact CE1-CD2 4.38Å; F239-L243 HydrophobicContact CE2-CD1 4.01Å; F239-L243 HydrophobicContact CE2-CD2 3.7Å; F239-L243 HydrophobicContact CE2-CG 4.26Å; F239-L243 HydrophobicContact CG-CD2 3.78Å; F239-L243 HydrophobicContact CZ-CD2 4.12Å; F239-V271 HydrophobicContact CE2-CG1 4.43Å; F239-V271 HydrophobicContact CZ-CG1 4.07Å; F239-V271 HydrophobicContact CZ-CG2 4.42Å; F239-I273 HydrophobicContact CD1-CD1 3.55Å; F239-I273 HydrophobicContact CE1-CD1 3.54Å; F239-I273 HydrophobicContact CG-CD1 4.47Å; F239-I273 HydrophobicContact CZ-CD1 4.45Å; F239-I280 HydrophobicContact CE1-CD1 4.41Å; F239-I280 HydrophobicContact CZ-CD1 3.8Å
240	P	90.5	Very high	87.7	Confident	120 Å²	120	49.2 Å²	49.2	78%	0.779	28%	0.279	S	S	*	.	S	Bend	trans	-66.7	-34.6	178.4	25.9	-33.9	0	0	0	112
241	N	88.8	Confident	89.5	Confident	111 Å²	111	43.6 Å²	43.6	59%	0.594	25%	0.253	S	S	*	.	S	Bend	trans	-119.5	158.5	-179.2	-64.4	-42.1	0	0	0	110.4	N209 F239	N209-N241 WeakPolarHBondContact CB-O 3.34Å; F239-N241 VanDerWaalsContact C-N 3.29Å; F239-N241 WeakPolarHBondContact CB-O 3.35Å; F239-N241 PolarHBondContact O-N 2.92Å
242	P	86.9	Confident	90.6	Very high	80 Å²	80	40.7 Å²	40.7	52%	0.519	23%	0.228	S	C	.	.			trans	-56.1	142.2	170.7	-25.3	35.2	0	0	0	112.7	P208	P208-P242 HydrophobicContact CB-CB 4.17Å; P208-P242 HydrophobicContact CB-CG 4.39Å; P208-P242 CarbonylContact O-C 3.55Å; P208-P242 WeakPolarHBondContact O-CA 3.42Å
243	L	90	Very high	91.1	Very high	27 Å²	27	36.9 Å²	36.9	14%	0.141	21%	0.212	C	C	.	.			trans	-66.7	143.9	174.8	-64.1	178.8	0	0	0	110.5	P208 F239 P247 V271 I273	P208-L243 PolarHBondContact O-N 2.94Å; F239-L243 HydrophobicContact CB-CD2 4.4Å; F239-L243 HydrophobicContact CD1-CD2 4.22Å; F239-L243 HydrophobicContact CD2-CD1 4.14Å; F239-L243 HydrophobicContact CD2-CD2 3.51Å; F239-L243 HydrophobicContact CD2-CG 3.98Å; F239-L243 HydrophobicContact CE1-CD2 4.38Å; F239-L243 HydrophobicContact CE2-CD1 4.01Å; F239-L243 HydrophobicContact CE2-CD2 3.7Å; F239-L243 HydrophobicContact CE2-CG 4.26Å; F239-L243 HydrophobicContact CG-CD2 3.78Å; F239-L243 HydrophobicContact CZ-CD2 4.12Å; L243-P247 HydrophobicContact CD1-CG 3.56Å; L243-V271 HydrophobicContact CD1-CG1 3.9Å; L243-V271 HydrophobicContact CD2-CG1 3.39Å; L243-V271 HydrophobicContact CG-CG1 4.21Å; L243-I273 HydrophobicContact CD2-CD1 4.25Å; L243-I273 HydrophobicContact CD2-CG1 3.8Å
244	T	90.6	Very high	91	Very high	28 Å²	28	34.3 Å²	34.3	17%	0.172	20%	0.199	C	C	.	.	S	Bend	trans	-86.1	-22	178.5	56.5	0	0	0	0	112.8	G272 D274 R306 I307	T244-G272 PolarHBondContact N-O 2.79Å; T244-G272 PolarHBondContact OG1-O 2.88Å; T244-G272 VanDerWaalsContact OG1-O 3.14Å; T244-D274 PolarHBondContact OG1-N 3.05Å; T244-D274 VanDerWaalsContact OG1-N 3.14Å; T244-R306 HydrophobicContact CG2-CB 4.48Å; T244-R306 HydrophobicContact CG2-CG 4.36Å; T244-I307 CarbonylContact C-O 3.49Å; T244-I307 VanDerWaalsContact C-O 3.27Å; T244-I307 WeakPolarHBondContact CB-O 3.45Å; T244-I307 PolarHBondContact OG1-O 3.03Å
245	S	92.7	Very high	90.5	Very high	7 Å²	7	37.3 Å²	37.3	5%	0.049	21%	0.213	C	C	.	.	S	Bend	trans	-137.3	156.1	172.3	69.5	0	0	0	0	110.8	G272 K308 I310	S245-G272 VanDerWaalsContact OG-CA 3.27Å; S245-G272 WeakPolarHBondContact OG-CA 3.48Å; S245-G272 PolarHBondContact OG-N 2.79Å; S245-K308 VanDerWaalsContact CB-O 3.24Å; S245-K308 WeakPolarHBondContact CB-O 3.27Å; S245-I310 WeakPolarHBondContact OG-CD1 3.5Å
246	D	93.1	Very high	89.8	Confident	52 Å²	52	40.9 Å²	40.9	28%	0.278	23%	0.229	S	C	.	.			trans	-67.5	139.9	177.6	-54.8	-54.7	0	0	0	112	K193 I206 T248	K193-D246 VanDerWaalsContact CD-CG 3.47Å; K193-D246 WeakPolarHBondContact CD-OD1 3.48Å; K193-D246 VanDerWaalsContact CD-OD2 3.24Å; K193-D246 WeakPolarHBondContact CD-OD2 3.32Å; K193-D246 VanDerWaalsContact CE-OD2 3.28Å; K193-D246 WeakPolarHBondContact CE-OD2 3.36Å; K193-D246 IonicContact NZ-OD1 2.49Å; K193-D246 IonicContact NZ-OD2 3.13Å; K193-D246 PolarHBondContact NZ-OD2 2.71Å; I206-D246 HydrophobicContact CD1-CB 4.28Å; D246-T248 PolarHBondContact O-N 3.48Å; D246-T248 PolarHBondContact O-OG1 2.81Å
247	P	96.1	Very high	88.6	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	22%	0.224	C	C	.	.			trans	-55.2	131.2	168.4	-25.8	35.1	0	0	0	111.5	L204 I206 F211 L243 V269 L270 V271	L204-P247 HydrophobicContact CD1-CB 4.14Å; I206-P247 HydrophobicContact CG1-CG 4.27Å; I206-P247 HydrophobicContact CG2-CG 4.26Å; F211-P247 HydrophobicContact CB-CG 4.03Å; F211-P247 HydrophobicContact CD1-CB 3.92Å; F211-P247 HydrophobicContact CD1-CG 3.39Å; F211-P247 HydrophobicContact CE1-CB 4.17Å; F211-P247 HydrophobicContact CE1-CG 3.97Å; F211-P247 HydrophobicContact CG-CB 4.1Å; F211-P247 HydrophobicContact CG-CG 3.79Å; L243-P247 HydrophobicContact CD1-CG 3.56Å; P247-V269 HydrophobicContact CB-CG1 3.66Å; P247-L270 WeakPolarHBondContact CA-O 3.39Å; P247-V271 HydrophobicContact CB-CG2 4.1Å; P247-V271 HydrophobicContact CG-CG2 4.28Å
248	T	96.3	Very high	86.9	Confident	24 Å²	24	44.1 Å²	44.1	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131	-176.8	-56.2	0	0	0	0	110	D246 F250 V269 L270 I310 V312	D246-T248 PolarHBondContact O-N 3.48Å; D246-T248 PolarHBondContact O-OG1 2.81Å; T248-F250 PolarHBondContact O-N 2.84Å; T248-V269 WeakPolarHBondContact O-CA 3.31Å; T248-L270 PolarHBondContact N-O 2.74Å; T248-L270 PolarHBondContact O-N 2.88Å; T248-I310 PolarHBondContact OG1-O 2.98Å; T248-V312 HydrophobicContact CG2-CB 4.32Å; T248-V312 HydrophobicContact CG2-CG2 3.84Å
249	F	95.9	Very high	85.2	Confident	11 Å²	11	47.4 Å²	47.4	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	126.9	171.8	-80.2	-78.1	0	0	0	109.9	S197 R202 L204 M213 E252 V269	S197-F249 VanDerWaalsContact N-CE2 3.33Å; R202-F249 HydrophobicContact CB-CE1 4.17Å; R202-F249 HydrophobicContact CB-CZ 3.84Å; L204-F249 HydrophobicContact CB-CE2 4.34Å; L204-F249 HydrophobicContact CD1-CD2 4.1Å; L204-F249 HydrophobicContact CD1-CE2 3.87Å; L204-F249 HydrophobicContact CD1-CZ 4.17Å; L204-F249 HydrophobicContact CD2-CE2 4.43Å; L204-F249 HydrophobicContact CD2-CZ 4.03Å; L204-F249 HydrophobicContact CG-CD2 4.25Å; L204-F249 HydrophobicContact CG-CE1 4.41Å; L204-F249 HydrophobicContact CG-CE2 3.51Å; L204-F249 HydrophobicContact CG-CZ 3.6Å; M213-F249 HydrophobicContact CE-CE1 3.86Å; M213-F249 HydrophobicContact CE-CZ 4.45Å; F249-E252 HydrophobicContact CD1-CG 4.49Å; F249-V269 HydrophobicContact CD1-CG2 4.47Å
250	F	95.3	Very high	83.6	Confident	1 Å²	1	56.3 Å²	56.3	0%	0.004	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-55.4	175.9	175.5	-98.9	0	0	0	111.1	T248 Y268 L270 L279 V312 R329 R331 V333 V350 L352	T248-F250 PolarHBondContact O-N 2.84Å; F250-Y268 PolarHBondContact N-O 3.22Å; F250-L270 HydrophobicContact CB-CD1 4.37Å; F250-L270 HydrophobicContact CB-CG 4.1Å; F250-L270 HydrophobicContact CD2-CD1 3.58Å; F250-L270 HydrophobicContact CD2-CG 4.07Å; F250-L270 HydrophobicContact CE2-CD1 4.32Å; F250-L270 HydrophobicContact CG-CD1 4.34Å; F250-L270 HydrophobicContact CG-CG 4.37Å; F250-L279 HydrophobicContact CD1-CD1 4.45Å; F250-L279 HydrophobicContact CG-CD1 4.47Å; F250-V312 HydrophobicContact CD2-CG1 4.09Å; F250-V312 HydrophobicContact CD2-CG2 4.41Å; F250-R329 HydrophobicContact CE1-CB 4.5Å; F250-R329 WeakPolarHBondContact CE1-O 3.34Å; F250-R329 WeakPolarHBondContact CZ-O 3.32Å; F250-R331 HydrophobicContact CD1-CG 4.45Å; F250-R331 HydrophobicContact CD2-CB 4.13Å; F250-R331 HydrophobicContact CD2-CG 3.96Å; F250-R331 HydrophobicContact CE1-CG 4.1Å; F250-R331 HydrophobicContact CE2-CB 3.53Å; F250-R331 HydrophobicContact CE2-CG 3.61Å; F250-R331 HydrophobicContact CG-CG 4.38Å; F250-R331 HydrophobicContact CZ-CB 3.9Å; F250-R331 HydrophobicContact CZ-CG 3.68Å; F250-R331 WeakPolarHBondContact O-CD 3.31Å; F250-R331 WeakPolarHBondContact O-CG 3.45Å; F250-R331 PolarHBondContact O-NE 3Å; F250-V333 HydrophobicContact CD2-CG2 4.26Å; F250-V333 HydrophobicContact CE2-CG2 3.98Å; F250-V350 HydrophobicContact CE2-CB 4.05Å; F250-V350 HydrophobicContact CE2-CG1 3.94Å; F250-V350 HydrophobicContact CZ-CB 4.28Å; F250-V350 HydrophobicContact CZ-CG1 3.94Å; F250-L352 HydrophobicContact CD1-CD1 4.23Å; F250-L352 HydrophobicContact CE1-CB 4.37Å; F250-L352 HydrophobicContact CE1-CD1 3.58Å; F250-L352 HydrophobicContact CE1-CG 4.13Å; F250-L352 HydrophobicContact CZ-CD1 3.89Å; F250-L352 HydrophobicContact CZ-CG 4.15Å
251	S	92.5	Very high	82.3	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.014	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	154.8	-177.1	-172.2	0	0	0	0	109.6	Y268 R331	S251-Y268 PolarHBondContact O-N 2.82Å; S251-R331 PolarHBondContact OG-NH2 3.13Å
252	E	90.4	Very high	81.4	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.9	168.4	-66.5	179.3	130.8	0	0	108.9	S197 T199 R202 F249 D254 E255 A267	S197-E252 VanDerWaalsContact CB-OE1 3.31Å; S197-E252 WeakPolarHBondContact CB-OE1 3.4Å; S197-E252 WeakPolarHBondContact CB-OE2 3.49Å; T199-E252 WeakPolarHBondContact CB-OE2 3.4Å; T199-E252 HydrophobicContact CG2-CB 4.3Å; T199-E252 WeakPolarHBondContact CG2-OE2 3.42Å; T199-E252 PolarHBondContact OG1-OE2 3.39Å; R202-E252 WeakPolarHBondContact CG-OE1 3.44Å; F249-E252 HydrophobicContact CD1-CG 4.49Å; E252-D254 HydrophobicContact CB-CB 4.45Å; E252-D254 PolarHBondContact O-N 2.55Å; E252-E255 PolarHBondContact O-N 2.95Å; E252-A267 HydrophobicContact CG-CB 4.07Å
253	D	86.3	Confident	80.9	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.032	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-71.6	-17.1	177.4	-68.1	-22.5	0	0	0	112.2	E255 L256 C257 L265 F266 R329	D253-E255 PolarHBondContact O-N 2.92Å; D253-E255 VanDerWaalsContact O-N 3.16Å; D253-L256 PolarHBondContact O-N 2.82Å; D253-C257 PolarHBondContact O-N 3.25Å; D253-L265 HydrophobicContact CB-CB 4.47Å; D253-L265 HydrophobicContact CB-CD2 3.92Å; D253-F266 PolarHBondContact N-O 2.9Å; D253-F266 WeakPolarHBondContact OD2-CB 3.46Å; D253-F266 VanDerWaalsContact OD2-CD2 3.25Å; D253-F266 WeakPolarHBondContact OD2-CD2 3.3Å; D253-F266 PolarHBondContact OD2-N 3.42Å; D253-R329 VanDerWaalsContact CG-NH2 3.33Å; D253-R329 IonicContact OD1-CZ 3.63Å; D253-R329 IonicContact OD1-NE 3.18Å; D253-R329 PolarHBondContact OD1-NE 2.82Å; D253-R329 IonicContact OD1-NH2 3.42Å; D253-R329 PolarHBondContact OD1-NH2 3.21Å; D253-R329 IonicContact OD2-CZ 3.01Å; D253-R329 IonicContact OD2-NE 3.22Å; D253-R329 IonicContact OD2-NH2 3.49Å; D253-R329 PolarHBondContact OD2-NH2 3.29Å
254	D	81.6	Confident	80.5	Confident	36 Å²	36	52.5 Å²	52.5	19%	0.193	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-54.5	-29.7	171.1	-80.7	-1.6	0	0	0	112.5	T199 N201 E252 L256 L265	T199-D254 HydrophobicContact CG2-CB 4.04Å; N201-D254 PolarHBondContact ND2-OD2 3.3Å; E252-D254 HydrophobicContact CB-CB 4.45Å; E252-D254 PolarHBondContact O-N 2.55Å; D254-L256 VanDerWaalsContact C-N 3.34Å; D254-L265 VanDerWaalsContact OD1-CD1 3.28Å; D254-L265 WeakPolarHBondContact OD1-CD1 3.48Å
255	E	77.6	Confident	80.3	Confident	71 Å²	71	51.5 Å²	51.5	33%	0.332	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-73.6	-27.2	175.7	-62.1	176.6	165.6	0	0	112.9	P198 T199 E252 D253 H314 R331	P198-E255 WeakPolarHBondContact CB-OE1 3.44Å; T199-E255 HydrophobicContact CG2-CB 4.39Å; T199-E255 HydrophobicContact CG2-CG 3.17Å; E252-E255 PolarHBondContact O-N 2.95Å; D253-E255 PolarHBondContact O-N 2.92Å; D253-E255 VanDerWaalsContact O-N 3.16Å; E255-H314 IonicContact OE1-CE1 3.26Å; E255-H314 PolarHBondContact OE1-CE1 2.95Å; E255-H314 IonicContact OE2-CE1 2.64Å; E255-H314 PolarHBondContact OE2-CE1 2.93Å; E255-H314 IonicContact OE2-ND1 3.99Å; E255-R331 IonicContact OE2-NH2 3.71Å; E255-R331 PolarHBondContact OE2-NH2 2.9Å
256	L	73.4	Confident	80.2	Confident	84 Å²	84	52.6 Å²	52.6	44%	0.44	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-34.1	-172.1	-65.5	164.2	0	0	0	111.6	D253 D254 R329	D253-L256 PolarHBondContact O-N 2.82Å; D254-L256 VanDerWaalsContact C-N 3.34Å; L256-R329 HydrophobicContact CD1-CG 4.01Å
257	C	66.2	Low	80.1	Confident	39 Å²	39	50.1 Å²	50.1	26%	0.264	27%	0.272	S	S	.	.	S	Bend	trans	-89.8	112.3	-177.2	-69.8	0	0	0	0	110.6	D253 Q259 L265	D253-C257 PolarHBondContact O-N 3.25Å; C257-Q259 PolarHBondContact O-N 3.19Å; C257-L265 HydrophobicContact CB-CD2 3.75Å; C257-L265 VanDerWaalsContact SG-CD2 3.52Å
258	S	56.8	Low	80.1	Confident	98 Å²	98	50.1 Å²	50.1	69%	0.685	27%	0.271	S	S	*	.			trans	-57.6	127.7	162.3	74.3	0	0	0	0	108	K260 S261	S258-K260 PolarHBondContact O-N 3.11Å; S258-S261 PolarHBondContact O-N 3.07Å
259	Q	57.2	Low	80.1	Confident	179 Å²	179	49 Å²	49	84%	0.836	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	5.1	-160.4	-65.7	-179.1	-18.3	0	0	117.9	C257	C257-Q259 PolarHBondContact O-N 3.19Å
260	K	57.3	Low	80.2	Confident	203 Å²	203	48.5 Å²	48.5	88%	0.883	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-5.1	-178	-63.7	-175.6	178.8	-179.3	0	114.7	S258	S258-K260 PolarHBondContact O-N 3.11Å
261	S	62.9	Low	80.2	Confident	37 Å²	37	48.5 Å²	48.5	26%	0.259	26%	0.262	S	S	.	.			trans	-80.2	135.1	176.6	-174	0	0	0	0	111.7	S258 D263	S258-S261 PolarHBondContact O-N 3.07Å; S261-D263 PolarHBondContact O-N 2.92Å; S261-D263 VanDerWaalsContact OG-CB 3.29Å; S261-D263 WeakPolarHBondContact OG-CB 3.48Å; S261-D263 PolarHBondContact OG-N 3.28Å; S261-D263 PolarHBondContact OG-OD2 3.27Å
262	S	70.6	Confident	80.2	Confident	87 Å²	87	48.4 Å²	48.4	61%	0.608	26%	0.261	S	S	*	.			trans	-79.5	15.6	165.1	59	0	0	0	0	112	N287	S262-N287 PolarHBondContact O-ND2 3.16Å; S262-N287 PolarHBondContact O-OD1 2.76Å
263	D	76.3	Confident	80.3	Confident	87 Å²	87	50.3 Å²	50.3	47%	0.465	27%	0.271	S	S	.	.			trans	-69.7	149.5	179.4	-67.2	-33.1	0	0	0	111.6	S261 L265	S261-D263 PolarHBondContact O-N 2.92Å; S261-D263 VanDerWaalsContact OG-CB 3.29Å; S261-D263 WeakPolarHBondContact OG-CB 3.48Å; S261-D263 PolarHBondContact OG-N 3.28Å; S261-D263 PolarHBondContact OG-OD2 3.27Å; D263-L265 PolarHBondContact O-N 3.26Å
264	P	81.3	Confident	80.6	Confident	46 Å²	46	53.7 Å²	53.7	30%	0.299	29%	0.29	S	S	.	.			trans	-62.8	136.8	171.1	28.2	-34.5	0	0	0	110.2	F266 R285	P264-F266 HydrophobicContact CB-CE2 4.25Å; P264-F266 HydrophobicContact CB-CZ 3.87Å; P264-F266 HydrophobicContact CG-CE2 4.3Å; P264-F266 HydrophobicContact CG-CZ 4.16Å; P264-R285 CarbonylContact C-O 3.49Å; P264-R285 WeakPolarHBondContact CA-O 3.34Å
265	L	87.1	Confident	81.1	Confident	7 Å²	7	52.5 Å²	52.5	4%	0.037	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.5	-178.5	-59.4	171.6	0	0	0	109.7	D253 D254 C257 D263 V284 R285	D253-L265 HydrophobicContact CB-CB 4.47Å; D253-L265 HydrophobicContact CB-CD2 3.92Å; D254-L265 VanDerWaalsContact OD1-CD1 3.28Å; D254-L265 WeakPolarHBondContact OD1-CD1 3.48Å; C257-L265 HydrophobicContact CB-CD2 3.75Å; C257-L265 VanDerWaalsContact SG-CD2 3.52Å; D263-L265 PolarHBondContact O-N 3.26Å; L265-V284 WeakPolarHBondContact O-CB 3.46Å; L265-V284 PolarHBondContact O-N 2.93Å; L265-R285 HydrophobicContact CB-CB 3.87Å; L265-R285 HydrophobicContact CD1-CB 4.02Å; L265-R285 HydrophobicContact CG-CB 4.03Å; L265-R285 PolarHBondContact N-O 2.86Å; L265-R285 PolarHBondContact O-N 2.96Å
266	F	89.3	Confident	81.9	Confident	31 Å²	31	51 Å²	51	14%	0.136	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.5	-179.4	-52	-73.3	0	0	0	111.9	D253 P264 Y268 K281 F282 N283	D253-F266 PolarHBondContact N-O 2.9Å; D253-F266 WeakPolarHBondContact OD2-CB 3.46Å; D253-F266 VanDerWaalsContact OD2-CD2 3.25Å; D253-F266 WeakPolarHBondContact OD2-CD2 3.3Å; D253-F266 PolarHBondContact OD2-N 3.42Å; P264-F266 HydrophobicContact CB-CE2 4.25Å; P264-F266 HydrophobicContact CB-CZ 3.87Å; P264-F266 HydrophobicContact CG-CE2 4.3Å; P264-F266 HydrophobicContact CG-CZ 4.16Å; F266-Y268 HydrophobicContact CB-CD2 4.42Å; F266-Y268 HydrophobicContact CB-CE2 3.58Å; F266-K281 HydrophobicContact CB-CG 4.23Å; F266-K281 HydrophobicContact CD1-CD 4.2Å; F266-K281 HydrophobicContact CD1-CG 4.14Å; F266-K281 VanDerWaalsContact CE1-CE 3.44Å; F266-K281 HydrophobicContact CG-CD 4.39Å; F266-K281 HydrophobicContact CG-CG 4.35Å; F266-F282 VanDerWaalsContact CA-O 3.23Å; F266-F282 WeakPolarHBondContact CA-O 3.36Å; F266-N283 HydrophobicContact CD1-CB 4.46Å; F266-N283 WeakPolarHBondContact CD1-OD1 3.45Å; F266-N283 HydrophobicContact CE1-CB 4.46Å; F266-N283 WeakPolarHBondContact CE1-OD1 3.36Å
267	A	93	Very high	83	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	139.3	166.5	0	0	0	0	0	109.2	M213 E252 F282 V284	M213-A267 HydrophobicContact CE-CB 3.93Å; M213-A267 HydrophobicContact SD-CB 3.93Å; E252-A267 HydrophobicContact CG-CB 4.07Å; A267-F282 HydrophobicContact CB-CB 4.33Å; A267-F282 PolarHBondContact N-O 2.59Å; A267-F282 PolarHBondContact O-N 3.19Å; A267-V284 HydrophobicContact CB-CG2 3.59Å
268	Y	94.8	Very high	84.4	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135	-176.4	-62	-94.7	0	0	0	110.1	F250 S251 F266 L279 I280 K281 R329 D356	F250-Y268 PolarHBondContact N-O 3.22Å; S251-Y268 PolarHBondContact O-N 2.82Å; F266-Y268 HydrophobicContact CB-CD2 4.42Å; F266-Y268 HydrophobicContact CB-CE2 3.58Å; Y268-L279 HydrophobicContact CD1-CD1 4.22Å; Y268-L279 HydrophobicContact CD1-CD2 4.24Å; Y268-L279 HydrophobicContact CD1-CG 4.36Å; Y268-I280 WeakPolarHBondContact CA-O 3.31Å; Y268-K281 HydrophobicContact CD1-CB 4.06Å; Y268-K281 HydrophobicContact CD1-CG 4.16Å; Y268-K281 HydrophobicContact CE1-CB 3.9Å; Y268-K281 HydrophobicContact CE1-CD 3.74Å; Y268-K281 HydrophobicContact CE1-CG 3.62Å; Y268-K281 VanDerWaalsContact OH-CE 3.23Å; Y268-K281 WeakPolarHBondContact OH-CE 3.32Å; Y268-K281 PolarHBondContact OH-NZ 2.67Å; Y268-R329 VanDerWaalsContact OH-CZ 3.26Å; Y268-R329 PolarHBondContact OH-NH1 2.95Å; Y268-D356 PolarHBondContact OH-OD1 2.91Å
269	V	97	Very high	86.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.4	178.6	-178.6	0	0	0	0	108.9	L204 F211 M213 P247 T248 F249 V271 I280 F282	L204-V269 HydrophobicContact CD1-CG1 4.13Å; L204-V269 HydrophobicContact CD1-CG2 4.2Å; F211-V269 HydrophobicContact CE2-CB 4.46Å; F211-V269 HydrophobicContact CE2-CG1 4.17Å; F211-V269 HydrophobicContact CE2-CG2 4.33Å; F211-V269 HydrophobicContact CZ-CB 4.34Å; F211-V269 HydrophobicContact CZ-CG1 3.98Å; M213-V269 HydrophobicContact CE-CG2 3.6Å; P247-V269 HydrophobicContact CB-CG1 3.66Å; T248-V269 WeakPolarHBondContact O-CA 3.31Å; F249-V269 HydrophobicContact CD1-CG2 4.47Å; V269-V271 HydrophobicContact CG1-CG2 4.06Å; V269-I280 PolarHBondContact N-O 3.44Å; V269-I280 PolarHBondContact O-N 3.07Å; V269-F282 HydrophobicContact CG2-CD2 4.33Å; V269-F282 HydrophobicContact CG2-CE2 4.09Å
270	L	96.8	Very high	88.1	Confident	1 Å²	1	32 Å²	32	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	136.8	169.3	-77	175.4	0	0	0	110.2	P247 T248 F250 L277 T278 L279 I310 V312 V333 L358	P247-L270 WeakPolarHBondContact CA-O 3.39Å; T248-L270 PolarHBondContact N-O 2.74Å; T248-L270 PolarHBondContact O-N 2.88Å; F250-L270 HydrophobicContact CB-CD1 4.37Å; F250-L270 HydrophobicContact CB-CG 4.1Å; F250-L270 HydrophobicContact CD2-CD1 3.58Å; F250-L270 HydrophobicContact CD2-CG 4.07Å; F250-L270 HydrophobicContact CE2-CD1 4.32Å; F250-L270 HydrophobicContact CG-CD1 4.34Å; F250-L270 HydrophobicContact CG-CG 4.37Å; L270-L277 HydrophobicContact CB-CD1 4.18Å; L270-L277 HydrophobicContact CD2-CD1 4.11Å; L270-L277 HydrophobicContact CD2-CD2 4.3Å; L270-L277 HydrophobicContact CD2-CG 4.02Å; L270-T278 WeakPolarHBondContact CA-O 3.39Å; L270-L279 HydrophobicContact CD2-CB 4.2Å; L270-L279 HydrophobicContact CD2-CD1 3.86Å; L270-L279 HydrophobicContact CG-CD1 4.35Å; L270-I310 HydrophobicContact CB-CG2 4.41Å; L270-I310 HydrophobicContact CD1-CG2 4.41Å; L270-V312 HydrophobicContact CD1-CG2 4Å; L270-V333 HydrophobicContact CD1-CG1 3.95Å; L270-V333 HydrophobicContact CD1-CG2 3.88Å; L270-L358 HydrophobicContact CD2-CD1 4.18Å
271	V	95.8	Very high	89.8	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.7	-179.7	-174.4	0	0	0	0	109.7	F211 F239 L243 P247 V269 I273 T278 I280	F211-V271 HydrophobicContact CE1-CG2 3.81Å; F211-V271 HydrophobicContact CZ-CG2 4.28Å; F239-V271 HydrophobicContact CE2-CG1 4.43Å; F239-V271 HydrophobicContact CZ-CG1 4.07Å; F239-V271 HydrophobicContact CZ-CG2 4.42Å; L243-V271 HydrophobicContact CD1-CG1 3.9Å; L243-V271 HydrophobicContact CD2-CG1 3.39Å; L243-V271 HydrophobicContact CG-CG1 4.21Å; P247-V271 HydrophobicContact CB-CG2 4.1Å; P247-V271 HydrophobicContact CG-CG2 4.28Å; V269-V271 HydrophobicContact CG1-CG2 4.06Å; V271-I273 HydrophobicContact CG1-CG1 4.1Å; V271-T278 PolarHBondContact N-O 2.74Å; V271-T278 PolarHBondContact O-N 2.93Å; V271-I280 HydrophobicContact CG2-CD1 3.92Å; V271-I280 HydrophobicContact CG2-CG1 4.49Å
272	G	93.3	Very high	91.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.1	171.4	0	0	0	0	0	111	T244 S245	T244-G272 PolarHBondContact N-O 2.79Å; T244-G272 PolarHBondContact OG1-O 2.88Å; T244-G272 VanDerWaalsContact OG1-O 3.14Å; S245-G272 VanDerWaalsContact OG-CA 3.27Å; S245-G272 WeakPolarHBondContact OG-CA 3.48Å; S245-G272 PolarHBondContact OG-N 2.79Å
273	I	92	Very high	92	Very high	43 Å²	43	19.2 Å²	19.2	22%	0.221	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	109.3	173.6	-52.6	173.5	0	0	0	107.4	F239 L243 V271 A275 S276	F239-I273 HydrophobicContact CD1-CD1 3.55Å; F239-I273 HydrophobicContact CE1-CD1 3.54Å; F239-I273 HydrophobicContact CG-CD1 4.47Å; F239-I273 HydrophobicContact CZ-CD1 4.45Å; L243-I273 HydrophobicContact CD2-CD1 4.25Å; L243-I273 HydrophobicContact CD2-CG1 3.8Å; V271-I273 HydrophobicContact CG1-CG1 4.1Å; I273-A275 PolarHBondContact O-N 3.39Å; I273-S276 PolarHBondContact N-O 3.36Å; I273-S276 WeakPolarHBondContact O-CB 3.48Å; I273-S276 PolarHBondContact O-N 3.06Å
274	D	92.3	Very high	92.5	Very high	78 Å²	78	16 Å²	16	42%	0.417	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	-128.6	-166.5	-63.9	-53.4	0	0	0	109.3	T244 S276 K305 R306 I307	T244-D274 PolarHBondContact OG1-N 3.05Å; T244-D274 VanDerWaalsContact OG1-N 3.14Å; D274-S276 VanDerWaalsContact C-N 3.29Å; D274-S276 PolarHBondContact O-N 2.96Å; D274-K305 CarbonylContact C-O 3.54Å; D274-R306 CarbonylContact O-C 3.5Å; D274-R306 WeakPolarHBondContact O-CA 3.26Å; D274-R306 IonicContact OD1-NE 3.94Å; D274-I307 WeakPolarHBondContact O-CB 3.47Å; D274-I307 WeakPolarHBondContact O-CG1 2.95Å; D274-I307 PolarHBondContact O-N 2.52Å
275	A	93	Very high	92.4	Very high	10 Å²	10	18.8 Å²	18.8	8%	0.083	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.1	179	0	0	0	0	0	114	I273 L301 L302 G304 K305	I273-A275 PolarHBondContact O-N 3.39Å; A275-L301 HydrophobicContact CB-CD1 3.64Å; A275-L302 PolarHBondContact O-N 3.1Å; A275-G304 WeakPolarHBondContact CB-O 3.22Å; A275-K305 PolarHBondContact N-O 3.3Å
276	S	94.6	Very high	91.5	Very high	40 Å²	40	20.4 Å²	20.4	28%	0.28	10%	0.103	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.3	-175.7	-62.6	0	0	0	0	111.9	I273 D274 V300 I307	I273-S276 PolarHBondContact N-O 3.36Å; I273-S276 WeakPolarHBondContact O-CB 3.48Å; I273-S276 PolarHBondContact O-N 3.06Å; D274-S276 VanDerWaalsContact C-N 3.29Å; D274-S276 PolarHBondContact O-N 2.96Å; S276-V300 WeakPolarHBondContact CA-O 3.11Å; S276-I307 VanDerWaalsContact C-CD1 3.46Å
277	L	95.7	Very high	90.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	117.6	169.9	-176.5	67.1	0	0	0	108.9	L270 K299 V300 L302 I307 I310 V333 L358 F364	L270-L277 HydrophobicContact CB-CD1 4.18Å; L270-L277 HydrophobicContact CD2-CD1 4.11Å; L270-L277 HydrophobicContact CD2-CD2 4.3Å; L270-L277 HydrophobicContact CD2-CG 4.02Å; L277-K299 WeakPolarHBondContact O-CA 3.27Å; L277-V300 HydrophobicContact CB-CG1 3.87Å; L277-V300 HydrophobicContact CD2-CG1 4.31Å; L277-V300 HydrophobicContact CG-CG1 4.5Å; L277-V300 PolarHBondContact N-O 2.98Å; L277-V300 PolarHBondContact O-N 2.99Å; L277-L302 HydrophobicContact CB-CD1 4.17Å; L277-L302 HydrophobicContact CB-CG 4.38Å; L277-I307 HydrophobicContact CB-CD1 3.92Å; L277-I307 HydrophobicContact CD1-CD1 4.5Å; L277-I310 HydrophobicContact CD1-CD1 3.47Å; L277-I310 VanDerWaalsContact CD1-CD1 3.47Å; L277-I310 HydrophobicContact CD1-CG1 4.17Å; L277-V333 HydrophobicContact CD2-CG1 4.5Å; L277-L358 HydrophobicContact CG-CD1 4.45Å; L277-F364 HydrophobicContact CD2-CE2 3.84Å; L277-F364 HydrophobicContact CD2-CZ 4.16Å
278	T	95	Very high	88.7	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.3	-175.4	-58.9	0	0	0	0	110.6	L270 V271 I280 I296 K299	L270-T278 WeakPolarHBondContact CA-O 3.39Å; V271-T278 PolarHBondContact N-O 2.74Å; V271-T278 PolarHBondContact O-N 2.93Å; T278-I280 HydrophobicContact CG2-CG1 4.1Å; T278-I296 HydrophobicContact CG2-CG1 4.41Å; T278-I296 HydrophobicContact CG2-CG2 3.6Å; T278-K299 HydrophobicContact CG2-CD 4.33Å; T278-K299 HydrophobicContact CG2-CG 3.86Å; T278-K299 WeakPolarHBondContact OG1-CG 3.36Å
279	L	96.3	Very high	86.9	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.2	170.8	-176.3	74.6	0	0	0	110.4	F250 Y268 L270 T297 S298 L352 D356 L358	F250-L279 HydrophobicContact CD1-CD1 4.45Å; F250-L279 HydrophobicContact CG-CD1 4.47Å; Y268-L279 HydrophobicContact CD1-CD1 4.22Å; Y268-L279 HydrophobicContact CD1-CD2 4.24Å; Y268-L279 HydrophobicContact CD1-CG 4.36Å; L270-L279 HydrophobicContact CD2-CB 4.2Å; L270-L279 HydrophobicContact CD2-CD1 3.86Å; L270-L279 HydrophobicContact CG-CD1 4.35Å; L279-T297 PolarHBondContact O-N 2.86Å; L279-S298 PolarHBondContact N-O 3.37Å; L279-L352 HydrophobicContact CD1-CD1 4Å; L279-L352 HydrophobicContact CD2-CD1 3.35Å; L279-L352 HydrophobicContact CG-CD1 4.31Å; L279-D356 WeakPolarHBondContact CD2-O 3.38Å; L279-L358 HydrophobicContact CB-CD1 4.08Å; L279-L358 HydrophobicContact CB-CG 4.33Å
280	I	95.5	Very high	84.9	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.3	176.4	-53.4	-174.7	0	0	0	108.9	F211 V237 F239 Y268 V269 V271 T278 F282 P294 K295 I296	F211-I280 HydrophobicContact CE1-CD1 4.14Å; F211-I280 HydrophobicContact CZ-CD1 4.04Å; V237-I280 HydrophobicContact CG1-CD1 3.96Å; V237-I280 HydrophobicContact CG2-CD1 4.38Å; V237-I280 HydrophobicContact CG2-CG2 4.19Å; F239-I280 HydrophobicContact CE1-CD1 4.41Å; F239-I280 HydrophobicContact CZ-CD1 3.8Å; Y268-I280 WeakPolarHBondContact CA-O 3.31Å; V269-I280 PolarHBondContact N-O 3.44Å; V269-I280 PolarHBondContact O-N 3.07Å; V271-I280 HydrophobicContact CG2-CD1 3.92Å; V271-I280 HydrophobicContact CG2-CG1 4.49Å; T278-I280 HydrophobicContact CG2-CG1 4.1Å; I280-F282 HydrophobicContact CB-CE2 4.42Å; I280-F282 HydrophobicContact CG2-CD2 4.13Å; I280-F282 HydrophobicContact CG2-CE2 3.67Å; I280-F282 HydrophobicContact CG2-CZ 4.46Å; I280-P294 HydrophobicContact CG2-CB 3.89Å; I280-K295 WeakPolarHBondContact CA-O 3.05Å; I280-I296 HydrophobicContact CD1-CG1 4.4Å; I280-I296 HydrophobicContact CG1-CG1 4.24Å
281	K	93.5	Very high	83.1	Confident	31 Å²	31	44 Å²	44	14%	0.135	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.1	177.4	-178.6	177.2	-175.2	167.2	0	109.9	F266 Y268 P294 K295 T297 D356	F266-K281 HydrophobicContact CB-CG 4.23Å; F266-K281 HydrophobicContact CD1-CD 4.2Å; F266-K281 HydrophobicContact CD1-CG 4.14Å; F266-K281 VanDerWaalsContact CE1-CE 3.44Å; F266-K281 HydrophobicContact CG-CD 4.39Å; F266-K281 HydrophobicContact CG-CG 4.35Å; Y268-K281 HydrophobicContact CD1-CB 4.06Å; Y268-K281 HydrophobicContact CD1-CG 4.16Å; Y268-K281 HydrophobicContact CE1-CB 3.9Å; Y268-K281 HydrophobicContact CE1-CD 3.74Å; Y268-K281 HydrophobicContact CE1-CG 3.62Å; Y268-K281 VanDerWaalsContact OH-CE 3.23Å; Y268-K281 WeakPolarHBondContact OH-CE 3.32Å; Y268-K281 PolarHBondContact OH-NZ 2.67Å; K281-P294 CarbonylContact O-C 3.56Å; K281-P294 WeakPolarHBondContact O-CA 3.42Å; K281-K295 PolarHBondContact N-O 3.47Å; K281-K295 PolarHBondContact O-N 2.94Å; K281-T297 WeakPolarHBondContact CB-OG1 3.12Å; K281-D356 WeakPolarHBondContact CD-OD2 3.33Å; K281-D356 IonicContact NZ-OD2 2.71Å; K281-D356 PolarHBondContact NZ-OD2 3.44Å
282	F	92.3	Very high	81.8	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.8	171.5	-74.4	-106.9	0	0	0	108.8	F211 M213 V234 V237 F266 A267 V269 I280 V284 P294	F211-F282 HydrophobicContact CD2-CZ 4.41Å; F211-F282 AromaticContact CE2-CE2 3.7Å; F211-F282 HydrophobicContact CE2-CE2 3.7Å; F211-F282 AromaticContact CE2-CZ 3.45Å; F211-F282 HydrophobicContact CE2-CZ 3.45Å; F211-F282 VanDerWaalsContact CE2-CZ 3.45Å; F211-F282 AromaticContact CZ-CE2 3.99Å; F211-F282 HydrophobicContact CZ-CE2 3.99Å; F211-F282 AromaticContact CZ-CZ 3.98Å; F211-F282 HydrophobicContact CZ-CZ 3.98Å; M213-F282 HydrophobicContact CB-CD1 4.27Å; M213-F282 HydrophobicContact CB-CE1 3.97Å; M213-F282 HydrophobicContact CB-CZ 4.42Å; M213-F282 HydrophobicContact CE-CB 4.25Å; M213-F282 HydrophobicContact CE-CD1 4.12Å; M213-F282 HydrophobicContact CE-CD2 3.61Å; M213-F282 HydrophobicContact CE-CE1 4.36Å; M213-F282 HydrophobicContact CE-CE2 3.91Å; M213-F282 HydrophobicContact CE-CG 3.73Å; M213-F282 HydrophobicContact CE-CZ 4.27Å; M213-F282 HydrophobicContact SD-CB 4.15Å; M213-F282 HydrophobicContact SD-CD1 4.03Å; M213-F282 HydrophobicContact SD-CD2 4.46Å; M213-F282 HydrophobicContact SD-CG 3.97Å; V234-F282 HydrophobicContact CG1-CD1 4.34Å; V237-F282 HydrophobicContact CG2-CE1 4.44Å; V237-F282 HydrophobicContact CG2-CE2 4.27Å; V237-F282 HydrophobicContact CG2-CZ 3.64Å; F266-F282 VanDerWaalsContact CA-O 3.23Å; F266-F282 WeakPolarHBondContact CA-O 3.36Å; A267-F282 HydrophobicContact CB-CB 4.33Å; A267-F282 PolarHBondContact N-O 2.59Å; A267-F282 PolarHBondContact O-N 3.19Å; V269-F282 HydrophobicContact CG2-CD2 4.33Å; V269-F282 HydrophobicContact CG2-CE2 4.09Å; I280-F282 HydrophobicContact CB-CE2 4.42Å; I280-F282 HydrophobicContact CG2-CD2 4.13Å; I280-F282 HydrophobicContact CG2-CE2 3.67Å; I280-F282 HydrophobicContact CG2-CZ 4.46Å; F282-V284 HydrophobicContact CB-CG2 4.49Å; F282-P294 HydrophobicContact CD1-CB 3.84Å; F282-P294 HydrophobicContact CD1-CG 4.41Å; F282-P294 HydrophobicContact CD2-CB 4.15Å; F282-P294 HydrophobicContact CE1-CB 3.57Å; F282-P294 HydrophobicContact CE1-CG 3.88Å; F282-P294 HydrophobicContact CE2-CB 3.88Å; F282-P294 HydrophobicContact CG-CB 4.13Å; F282-P294 HydrophobicContact CZ-CB 3.58Å; F282-P294 HydrophobicContact CZ-CG 4.12Å
283	N	88	Confident	81.2	Confident	26 Å²	26	51 Å²	51	14%	0.139	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.5	164.3	-62	-9.9	0	0	0	106.9	F266 L292	F266-N283 HydrophobicContact CD1-CB 4.46Å; F266-N283 WeakPolarHBondContact CD1-OD1 3.45Å; F266-N283 HydrophobicContact CE1-CB 4.46Å; F266-N283 WeakPolarHBondContact CE1-OD1 3.36Å; N283-L292 HydrophobicContact CB-CD2 3.76Å; N283-L292 WeakPolarHBondContact O-CD2 3.4Å
284	V	85.4	Confident	81	Confident	20 Å²	20	50.6 Å²	50.6	12%	0.121	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-43	-175.9	177.8	0	0	0	0	110.3	V234 L265 A267 F282	V234-V284 HydrophobicContact CG1-CG2 4.45Å; L265-V284 WeakPolarHBondContact O-CB 3.46Å; L265-V284 PolarHBondContact O-N 2.93Å; A267-V284 HydrophobicContact CB-CG2 3.59Å; F282-V284 HydrophobicContact CB-CG2 4.49Å
285	R	79.6	Confident	80.9	Confident	103 Å²	103	53.6 Å²	53.6	39%	0.389	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.9	170.9	-170.3	179.4	-61	170.5	8	107.2	P264 L265	P264-R285 CarbonylContact C-O 3.49Å; P264-R285 WeakPolarHBondContact CA-O 3.34Å; L265-R285 HydrophobicContact CB-CB 3.87Å; L265-R285 HydrophobicContact CD1-CB 4.02Å; L265-R285 HydrophobicContact CG-CB 4.03Å; L265-R285 PolarHBondContact N-O 2.86Å; L265-R285 PolarHBondContact O-N 2.96Å
286	N	68.8	Low	80.7	Confident	42 Å²	42	57 Å²	57	23%	0.225	31%	0.311	C	S	.	.			trans	-131.8	142.8	179.2	-141.9	3.8	0	0	0	109.6	T288 L292	N286-T288 VanDerWaalsContact C-N 3.32Å; N286-T288 PolarHBondContact ND2-OG1 3.5Å; N286-T288 PolarHBondContact OD1-OG1 3.13Å; N286-L292 HydrophobicContact CB-CD2 4.32Å
287	N	64.6	Low	80.4	Confident	107 Å²	107	57 Å²	57	57%	0.572	31%	0.31	S	S	*	.	S	Bend	trans	-81.9	-20.8	171.3	-68.9	-16.3	0	0	0	111.8	S262	S262-N287 PolarHBondContact O-ND2 3.16Å; S262-N287 PolarHBondContact O-OD1 2.76Å
288	T	57.7	Low	80.3	Confident	75 Å²	75	57.7 Å²	57.7	46%	0.46	31%	0.314	S	S	.	.	S	Bend	trans	-95.4	151.2	-178.4	58.1	0	0	0	0	110.4	N286 E290	N286-T288 VanDerWaalsContact C-N 3.32Å; N286-T288 PolarHBondContact ND2-OG1 3.5Å; N286-T288 PolarHBondContact OD1-OG1 3.13Å; T288-E290 PolarHBondContact O-N 2.49Å
289	S	57.3	Low	80.2	Confident	134 Å²	134	63.4 Å²	63.4	94%	0.937	34%	0.339	S	S	*	.	S	Bend	trans	-68.9	11.6	173.6	54.4	0	0	0	0	113.9
290	E	56.7	Low	80.1	Confident	120 Å²	120	63.9 Å²	63.9	56%	0.561	34%	0.342	S	S	*	.			trans	-65.8	139.6	177.6	-72.6	-173.7	168.5	0	0	110.3	T288	T288-E290 PolarHBondContact O-N 2.49Å
291	P	57.9	Low	80.1	Confident	92 Å²	92	69.8 Å²	69.8	60%	0.597	37%	0.373	S	S	*	.			trans	-63.4	142.1	179.8	28.9	-35.1	0	0	0	110.1	T293	P291-T293 HydrophobicContact CB-CG2 4.07Å; P291-T293 HydrophobicContact CG-CG2 4.23Å; P291-T293 PolarHBondContact O-N 2.68Å
292	L	68.4	Low	80.2	Confident	61 Å²	61	68.7 Å²	68.7	32%	0.319	37%	0.369	S	S	.	.			trans	-73.8	55.5	178	-60.2	163.2	0	0	0	110.5	N283 N286	N283-L292 HydrophobicContact CB-CD2 3.76Å; N283-L292 WeakPolarHBondContact O-CD2 3.4Å; N286-L292 HydrophobicContact CB-CD2 4.32Å
293	T	79.9	Confident	80.1	Confident	86 Å²	86	72.5 Å²	72.5	53%	0.528	39%	0.393	S	S	.	.			trans	-86.4	130.6	-179.1	53.1	0	0	0	0	110.5	P291 K295	P291-T293 HydrophobicContact CB-CG2 4.07Å; P291-T293 HydrophobicContact CG-CG2 4.23Å; P291-T293 PolarHBondContact O-N 2.68Å; T293-K295 PolarHBondContact O-N 3.26Å
294	P	89.4	Confident	80.2	Confident	34 Å²	34	72.7 Å²	72.7	22%	0.221	40%	0.401	C	S	.	.			trans	-63.3	134.8	173.1	23.8	-30.6	0	0	0	111.1	S236 V237 I280 K281 F282	S236-P294 WeakPolarHBondContact O-CG 3.27Å; V237-P294 HydrophobicContact CG2-CB 3.58Å; V237-P294 HydrophobicContact CG2-CG 3.46Å; V237-P294 VanDerWaalsContact CG2-CG 3.46Å; I280-P294 HydrophobicContact CG2-CB 3.89Å; K281-P294 CarbonylContact O-C 3.56Å; K281-P294 WeakPolarHBondContact O-CA 3.42Å; F282-P294 HydrophobicContact CD1-CB 3.84Å; F282-P294 HydrophobicContact CD1-CG 4.41Å; F282-P294 HydrophobicContact CD2-CB 4.15Å; F282-P294 HydrophobicContact CE1-CB 3.57Å; F282-P294 HydrophobicContact CE1-CG 3.88Å; F282-P294 HydrophobicContact CE2-CB 3.88Å; F282-P294 HydrophobicContact CG-CB 4.13Å; F282-P294 HydrophobicContact CZ-CB 3.58Å; F282-P294 HydrophobicContact CZ-CG 4.12Å
295	K	89.3	Confident	80.6	Confident	142 Å²	142	78 Å²	78	62%	0.617	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.4	179.4	-174.4	176.7	178.5	-179.8	0	110	I280 K281 T293 T297	I280-K295 WeakPolarHBondContact CA-O 3.05Å; K281-K295 PolarHBondContact N-O 3.47Å; K281-K295 PolarHBondContact O-N 2.94Å; T293-K295 PolarHBondContact O-N 3.26Å; K295-T297 PolarHBondContact O-N 2.94Å; K295-T297 PolarHBondContact O-OG1 3.31Å
296	I	88.6	Confident	81.3	Confident	80 Å²	80	78.4 Å²	78.4	41%	0.41	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	116.5	167	-63.4	173	0	0	0	107.3	T278 I280 K299	T278-I296 HydrophobicContact CG2-CG1 4.41Å; T278-I296 HydrophobicContact CG2-CG2 3.6Å; I280-I296 HydrophobicContact CD1-CG1 4.4Å; I280-I296 HydrophobicContact CG1-CG1 4.24Å; I296-K299 HydrophobicContact CG2-CG 4.38Å
297	T	89.6	Confident	82.6	Confident	42 Å²	42	76.4 Å²	76.4	26%	0.258	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-41.4	-173.8	-36	0	0	0	0	112.7	L279 K281 K295 D356	L279-T297 PolarHBondContact O-N 2.86Å; K281-T297 WeakPolarHBondContact CB-OG1 3.12Å; K295-T297 PolarHBondContact O-N 2.94Å; K295-T297 PolarHBondContact O-OG1 3.31Å; T297-D356 WeakPolarHBondContact CB-O 3.16Å; T297-D356 HydrophobicContact CG2-CB 3.28Å; T297-D356 VanDerWaalsContact CG2-O 3.25Å; T297-D356 WeakPolarHBondContact CG2-O 3.41Å
298	S	92.2	Very high	84.1	Confident	13 Å²	13	73.3 Å²	73.3	9%	0.091	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	161.8	-179.2	55.1	0	0	0	0	112.3	L279 D356 I357 L358	L279-S298 PolarHBondContact N-O 3.37Å; S298-D356 PolarHBondContact OG-O 3.18Å; S298-I357 WeakPolarHBondContact OG-CA 3.11Å; S298-L358 PolarHBondContact OG-N 3.31Å
299	K	93.1	Very high	86	Confident	121 Å²	121	71.9 Å²	71.9	53%	0.526	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	140.7	179.1	-62.5	-171.8	179.7	179.9	0	109.7	L277 T278 I296	L277-K299 WeakPolarHBondContact O-CA 3.27Å; T278-K299 HydrophobicContact CG2-CD 4.33Å; T278-K299 HydrophobicContact CG2-CG 3.86Å; T278-K299 WeakPolarHBondContact OG1-CG 3.36Å; I296-K299 HydrophobicContact CG2-CG 4.38Å
300	V	95.2	Very high	87.9	Confident	11 Å²	11	66 Å²	66	7%	0.067	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.9	171.6	65.4	0	0	0	0	109.8	S276 L277 L302 L358 P360 F364	S276-V300 WeakPolarHBondContact CA-O 3.11Å; L277-V300 HydrophobicContact CB-CG1 3.87Å; L277-V300 HydrophobicContact CD2-CG1 4.31Å; L277-V300 HydrophobicContact CG-CG1 4.5Å; L277-V300 PolarHBondContact N-O 2.98Å; L277-V300 PolarHBondContact O-N 2.99Å; V300-L302 HydrophobicContact CG1-CD2 4.16Å; V300-L358 HydrophobicContact CB-CB 4.19Å; V300-L358 HydrophobicContact CG1-CB 4.18Å; V300-L358 HydrophobicContact CG1-CD1 4Å; V300-P360 HydrophobicContact CG2-CG 3.79Å; V300-F364 HydrophobicContact CG1-CD1 4.45Å; V300-F364 HydrophobicContact CG1-CD2 4.29Å; V300-F364 HydrophobicContact CG1-CE1 4.14Å; V300-F364 HydrophobicContact CG1-CE2 4.01Å; V300-F364 HydrophobicContact CG1-CZ 3.93Å; V300-F364 HydrophobicContact CG2-CD1 4.2Å; V300-F364 HydrophobicContact CG2-CE1 4.27Å
301	L	95.2	Very high	89.8	Confident	125 Å²	125	63.3 Å²	63.3	65%	0.654	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.7	175.4	-175.5	65.9	0	0	0	109.3	A275	A275-L301 HydrophobicContact CB-CD1 3.64Å
302	L	94.3	Very high	91.7	Very high	8 Å²	8	59.7 Å²	59.7	4%	0.042	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-100.6	155.8	176.1	-55.6	-175.3	0	0	0	110.7	A275 L277 V300 I307 V335 T337 Y348 F364	A275-L302 PolarHBondContact O-N 3.1Å; L277-L302 HydrophobicContact CB-CD1 4.17Å; L277-L302 HydrophobicContact CB-CG 4.38Å; V300-L302 HydrophobicContact CG1-CD2 4.16Å; L302-I307 HydrophobicContact CD1-CD1 3.92Å; L302-I307 HydrophobicContact CD1-CG1 4.17Å; L302-I307 HydrophobicContact CG-CD1 4.45Å; L302-V335 HydrophobicContact CD1-CB 4.3Å; L302-V335 HydrophobicContact CD1-CG1 3.85Å; L302-V335 HydrophobicContact CD1-CG2 4.23Å; L302-T337 HydrophobicContact CB-CG2 4.22Å; L302-T337 HydrophobicContact CD1-CG2 4.42Å; L302-Y348 HydrophobicContact CD1-CE2 4.42Å; L302-Y348 HydrophobicContact CD2-CE2 4.3Å; L302-F364 HydrophobicContact CD2-CE1 3.65Å; L302-F364 HydrophobicContact CD2-CZ 3.64Å
303	P	90.9	Very high	93	Very high	81 Å²	81	57.7 Å²	57.7	53%	0.526	29%	0.294	S	S	.	.	S	Bend	trans	-60.5	149.5	170.5	-22.8	34.1	0	0	0	112.7	T337	P303-T337 WeakPolarHBondContact O-CB 3.29Å; P303-T337 WeakPolarHBondContact O-CG2 3.45Å; P303-T337 PolarHBondContact O-OG1 2.8Å
304	G	90.6	Very high	93.6	Very high	29 Å²	29	57 Å²	57	30%	0.299	28%	0.284	S	S	.	.	S	Bend	trans	96.7	-176.7	-176.5	0	0	0	0	0	112.7	A275	A275-G304 WeakPolarHBondContact CB-O 3.22Å
305	K	92.9	Very high	93.8	Very high	133 Å²	133	56.1 Å²	56.1	58%	0.578	28%	0.276	S	S	*	.	S	Bend	trans	-94.9	-40.3	-174.4	-168.5	179.8	-179.8	169.6	0	112.7	D274 A275 T338 D339	D274-K305 CarbonylContact C-O 3.54Å; A275-K305 PolarHBondContact N-O 3.3Å; K305-T338 WeakPolarHBondContact CA-O 3.49Å; K305-T338 WeakPolarHBondContact CB-O 3.25Å; K305-T338 PolarHBondContact N-O 3Å; K305-D339 HydrophobicContact CB-CB 3.9Å
306	R	94.7	Very high	93.8	Very high	110 Å²	110	50.5 Å²	50.5	42%	0.415	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	130.2	-174.2	-61.8	-177.8	175.5	160.1	-1.4	112.6	T244 D274 T337 T338	T244-R306 HydrophobicContact CG2-CB 4.48Å; T244-R306 HydrophobicContact CG2-CG 4.36Å; D274-R306 CarbonylContact O-C 3.5Å; D274-R306 WeakPolarHBondContact O-CA 3.26Å; D274-R306 IonicContact OD1-NE 3.94Å; R306-T337 CarbonylContact O-C 3.52Å; R306-T337 VanDerWaalsContact O-CA 3.23Å; R306-T337 WeakPolarHBondContact O-CA 3.39Å; R306-T338 PolarHBondContact N-O 3.08Å; R306-T338 PolarHBondContact O-N 2.86Å; R306-T338 PolarHBondContact O-OG1 3.29Å
307	I	96.6	Very high	93.7	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	124.7	165.1	-63.1	163.4	0	0	0	108.1	T244 D274 S276 L277 L302 I310 V335 T337	T244-I307 CarbonylContact C-O 3.49Å; T244-I307 VanDerWaalsContact C-O 3.27Å; T244-I307 WeakPolarHBondContact CB-O 3.45Å; T244-I307 PolarHBondContact OG1-O 3.03Å; D274-I307 WeakPolarHBondContact O-CB 3.47Å; D274-I307 WeakPolarHBondContact O-CG1 2.95Å; D274-I307 PolarHBondContact O-N 2.52Å; S276-I307 VanDerWaalsContact C-CD1 3.46Å; L277-I307 HydrophobicContact CB-CD1 3.92Å; L277-I307 HydrophobicContact CD1-CD1 4.5Å; L302-I307 HydrophobicContact CD1-CD1 3.92Å; L302-I307 HydrophobicContact CD1-CG1 4.17Å; L302-I307 HydrophobicContact CG-CD1 4.45Å; I307-I310 HydrophobicContact CG2-CD1 4.03Å; I307-I310 HydrophobicContact CG2-CG1 3.69Å; I307-V335 HydrophobicContact CB-CG1 4.46Å; I307-V335 HydrophobicContact CG1-CG1 4.13Å; I307-V335 HydrophobicContact CG2-CG1 3.69Å; I307-T337 HydrophobicContact CG1-CG2 3.81Å
308	K	95.3	Very high	93.5	Very high	43 Å²	43	54.5 Å²	54.5	19%	0.187	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-41	178.4	-72.1	-60.9	-169.7	-179.3	0	112.9	S245 V336 T338	S245-K308 VanDerWaalsContact CB-O 3.24Å; S245-K308 WeakPolarHBondContact CB-O 3.27Å; K308-V336 PolarHBondContact N-O 3.19Å; K308-T338 HydrophobicContact CG-CG2 3.66Å; K308-T338 WeakPolarHBondContact CG-OG1 3.09Å
309	F	97.1	Very high	93.2	Very high	45 Å²	45	54.2 Å²	54.2	20%	0.197	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.2	-177.1	-53.9	-68.6	0	0	0	110.2	V335 V336 I377 T378 L380	F309-V335 WeakPolarHBondContact O-CA 3.47Å; F309-V336 HydrophobicContact CB-CB 4.26Å; F309-V336 HydrophobicContact CD2-CB 3.96Å; F309-V336 HydrophobicContact CD2-CG1 4.16Å; F309-V336 HydrophobicContact CD2-CG2 4.43Å; F309-V336 PolarHBondContact N-O 3.3Å; F309-V336 PolarHBondContact O-N 3.26Å; F309-I377 HydrophobicContact CD2-CG2 4.18Å; F309-I377 HydrophobicContact CE2-CG2 4.07Å; F309-I377 WeakPolarHBondContact CE2-O 3.13Å; F309-T378 WeakPolarHBondContact CZ-O 3.47Å; F309-L380 HydrophobicContact CB-CB 3.9Å; F309-L380 HydrophobicContact CB-CD2 3.87Å; F309-L380 HydrophobicContact CD2-CB 4.37Å; F309-L380 HydrophobicContact CG-CB 4.12Å
310	I	97.6	Very high	92.8	Very high	11 Å²	11	49.7 Å²	49.7	6%	0.056	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.7	172.4	-58.1	166.8	0	0	0	105.6	S245 T248 L270 L277 I307 V312 V333 V334	S245-I310 WeakPolarHBondContact OG-CD1 3.5Å; T248-I310 PolarHBondContact OG1-O 2.98Å; L270-I310 HydrophobicContact CB-CG2 4.41Å; L270-I310 HydrophobicContact CD1-CG2 4.41Å; L277-I310 HydrophobicContact CD1-CD1 3.47Å; L277-I310 VanDerWaalsContact CD1-CD1 3.47Å; L277-I310 HydrophobicContact CD1-CG1 4.17Å; I307-I310 HydrophobicContact CG2-CD1 4.03Å; I307-I310 HydrophobicContact CG2-CG1 3.69Å; I310-V312 HydrophobicContact CG2-CG2 4.26Å; I310-V333 HydrophobicContact CG2-CG1 3.99Å; I310-V334 CarbonylContact C-O 3.58Å; I310-V334 WeakPolarHBondContact CA-O 3.43Å
311	Q	97.3	Very high	92.2	Very high	62 Å²	62	56.8 Å²	56.8	29%	0.29	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.7	171.7	-175.4	65.6	40	0	0	107.8	L313 V334 L380 A382	Q311-L313 HydrophobicContact CG-CD2 4.34Å; Q311-V334 HydrophobicContact CB-CB 4.35Å; Q311-V334 PolarHBondContact N-O 2.68Å; Q311-V334 PolarHBondContact O-N 3Å; Q311-L380 HydrophobicContact CB-CD2 4.05Å; Q311-A382 HydrophobicContact CG-CB 4.06Å
312	V	97.4	Very high	91.7	Very high	16 Å²	16	57 Å²	57	10%	0.097	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.9	177	-175.8	0	0	0	0	109.1	T248 F250 L270 I310 R331 V333	T248-V312 HydrophobicContact CG2-CB 4.32Å; T248-V312 HydrophobicContact CG2-CG2 3.84Å; F250-V312 HydrophobicContact CD2-CG1 4.09Å; F250-V312 HydrophobicContact CD2-CG2 4.41Å; L270-V312 HydrophobicContact CD1-CG2 4Å; I310-V312 HydrophobicContact CG2-CG2 4.26Å; V312-R331 HydrophobicContact CG1-CB 3.61Å; V312-R331 HydrophobicContact CG1-CG 3.69Å; V312-V333 HydrophobicContact CG2-CG2 4.39Å
313	L	95.8	Very high	91.3	Very high	20 Å²	20	58.1 Å²	58.1	11%	0.105	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.4	177.7	-59.4	175.8	0	0	0	110.4	V4 Q311 L332 A382	V4-L313 HydrophobicContact CG1-CD1 4.21Å; Q311-L313 HydrophobicContact CG-CD2 4.34Å; L313-L332 HydrophobicContact CB-CB 4.24Å; L313-L332 HydrophobicContact CD1-CD2 4Å; L313-L332 PolarHBondContact N-O 2.96Å; L313-L332 PolarHBondContact O-N 2.81Å; L313-A382 HydrophobicContact CD1-CB 3.84Å; L313-A382 VanDerWaalsContact CD2-O 3.28Å; L313-A382 WeakPolarHBondContact CD2-O 3.41Å
314	H	93.2	Very high	90.9	Very high	70 Å²	70	59.4 Å²	59.4	32%	0.324	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	147.2	168.3	-63	-107	0	0	0	109.4	E255 R331 W384	E255-H314 IonicContact OE1-CE1 3.26Å; E255-H314 PolarHBondContact OE1-CE1 2.95Å; E255-H314 IonicContact OE2-CE1 2.64Å; E255-H314 PolarHBondContact OE2-CE1 2.93Å; E255-H314 IonicContact OE2-ND1 3.99Å; H314-R331 PolarHBondContact CE1-NE 3.37Å; H314-R331 PolarHBondContact CE1-NH2 3.36Å; H314-R331 PolarHBondContact ND1-NE 3.49Å; H314-R331 PolarHBondContact ND1-NH2 3.15Å; H314-W384 PolarHBondContact O-NE1 2.86Å
315	W	92.4	Very high	90.6	Very high	17 Å²	17	60 Å²	60	6%	0.064	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-70	134.3	167.7	-67.5	102.9	0	0	0	109.4	H22 I25 S317 L319 C326 R331 L332 A349 L367 W384	H22-W315 AromaticContact CD2-CZ3 3.96Å; H22-W315 AromaticContact CE1-CZ3 3.95Å; H22-W315 AromaticContact NE2-CZ3 3.58Å; I25-W315 HydrophobicContact CD1-CH2 4.15Å; I25-W315 HydrophobicContact CD1-CZ2 4.15Å; I25-W315 HydrophobicContact CG1-CH2 4.33Å; W315-S317 PolarHBondContact O-N 3.45Å; W315-L319 HydrophobicContact CE3-CD1 4.23Å; W315-C326 HydrophobicContact CB-CB 3.88Å; W315-C326 WeakPolarHBondContact CB-O 3.5Å; W315-C326 VanDerWaalsContact CD1-O 3.3Å; W315-C326 HydrophobicContact CD2-CB 3.92Å; W315-C326 HydrophobicContact CE3-CB 4.39Å; W315-C326 HydrophobicContact CG-CB 3.64Å; W315-R331 VanDerWaalsContact NE1-C 3.31Å; W315-L332 HydrophobicContact CH2-CB 4.46Å; W315-L332 HydrophobicContact CZ2-CB 4.12Å; W315-A349 HydrophobicContact CH2-CB 4.44Å; W315-A349 HydrophobicContact CZ2-CB 3.87Å; W315-L367 HydrophobicContact CH2-CD1 3.86Å; W315-L367 HydrophobicContact CZ2-CD1 4.42Å; W315-W384 HydrophobicContact CD2-CZ2 4.37Å; W315-W384 AromaticContact CE3-CH2 3.92Å; W315-W384 HydrophobicContact CE3-CH2 3.92Å; W315-W384 AromaticContact CE3-CZ2 3.44Å; W315-W384 HydrophobicContact CE3-CZ2 3.44Å; W315-W384 VanDerWaalsContact CE3-CZ2 3.44Å; W315-W384 HydrophobicContact CH2-CZ2 4.29Å; W315-W384 AromaticContact CZ3-CH2 3.57Å; W315-W384 HydrophobicContact CZ3-CH2 3.57Å; W315-W384 AromaticContact CZ3-CZ2 3.42Å; W315-W384 HydrophobicContact CZ3-CZ2 3.42Å; W315-W384 VanDerWaalsContact CZ3-CZ2 3.42Å
316	P	90.2	Very high	90.3	Very high	24 Å²	24	53.9 Å²	53.9	16%	0.156	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-53.8	138.8	169.7	-24.9	32.7	0	0	0	110.6	F2 Y318 L319 A320 W384	F2-P316 HydrophobicContact CD1-CB 4.19Å; F2-P316 HydrophobicContact CD1-CG 3.93Å; F2-P316 HydrophobicContact CE1-CB 3.85Å; F2-P316 HydrophobicContact CE1-CG 4.07Å; F2-P316 HydrophobicContact CZ-CB 4.23Å; P316-Y318 PolarHBondContact O-N 3.21Å; P316-Y318 VanDerWaalsContact O-N 3.13Å; P316-L319 HydrophobicContact CG-CD1 4.12Å; P316-L319 WeakPolarHBondContact O-CA 3.26Å; P316-L319 PolarHBondContact O-N 2.8Å; P316-A320 PolarHBondContact O-N 3.43Å; P316-W384 HydrophobicContact CG-CB 4.14Å; P316-W384 HydrophobicContact CG-CD2 3.67Å; P316-W384 HydrophobicContact CG-CE3 4.05Å; P316-W384 HydrophobicContact CG-CG 3.69Å
317	S	86.5	Confident	89.9	Confident	91 Å²	91	51.1 Å²	51.1	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-52.9	-40.4	-175.6	-46.1	0	0	0	0	112.9	W315 L319 A320 E321	W315-S317 PolarHBondContact O-N 3.45Å; S317-L319 VanDerWaalsContact C-N 3.28Å; S317-L319 PolarHBondContact O-N 2.93Å; S317-A320 WeakPolarHBondContact O-CB 3.27Å; S317-A320 PolarHBondContact O-N 3.21Å; S317-A320 VanDerWaalsContact O-N 3.11Å; S317-E321 WeakPolarHBondContact O-CG 3.26Å; S317-E321 PolarHBondContact O-N 3.43Å
318	Y	85.2	Confident	89.5	Confident	114 Å²	114	52.4 Å²	52.4	45%	0.447	28%	0.278	S	S	.	.	H	α-helix	trans	-57	-37.8	175.5	176	-94.9	0	0	0	113.9	F2 P316 K322	F2-Y318 HydrophobicContact CD2-CD1 4Å; F2-Y318 HydrophobicContact CD2-CE1 4.46Å; F2-Y318 AromaticContact CE2-CD1 3.44Å; F2-Y318 HydrophobicContact CE2-CD1 3.44Å; F2-Y318 VanDerWaalsContact CE2-CD1 3.44Å; F2-Y318 HydrophobicContact CE2-CE1 4.11Å; F2-Y318 AromaticContact CE2-CG 3.95Å; F2-Y318 HydrophobicContact CE2-CG 3.95Å; F2-Y318 HydrophobicContact CZ-CD1 4.42Å; P316-Y318 PolarHBondContact O-N 3.21Å; P316-Y318 VanDerWaalsContact O-N 3.13Å; Y318-K322 HydrophobicContact CD1-CD 4.33Å; Y318-K322 HydrophobicContact CE1-CD 3.72Å; Y318-K322 HydrophobicContact CE2-CD 4.4Å; Y318-K322 WeakPolarHBondContact O-CG 3.49Å; Y318-K322 PolarHBondContact O-N 3Å; Y318-K322 WeakPolarHBondContact OH-CE 3.18Å; Y318-K322 PolarHBondContact OH-NZ 3.1Å
319	L	85.4	Confident	89.3	Confident	7 Å²	7	52.5 Å²	52.5	4%	0.037	28%	0.277	C	S	.	.	H	α-helix	trans	-76.9	-38	176.4	-69.9	175.2	0	0	0	110.8	F2 W315 P316 S317 E321 K322 E323 W384	F2-L319 HydrophobicContact CB-CD1 4.14Å; F2-L319 HydrophobicContact CD2-CD1 4.43Å; F2-L319 HydrophobicContact CD2-CG 4.28Å; F2-L319 HydrophobicContact CG-CD1 4.27Å; W315-L319 HydrophobicContact CE3-CD1 4.23Å; P316-L319 HydrophobicContact CG-CD1 4.12Å; P316-L319 WeakPolarHBondContact O-CA 3.26Å; P316-L319 PolarHBondContact O-N 2.8Å; S317-L319 VanDerWaalsContact C-N 3.28Å; S317-L319 PolarHBondContact O-N 2.93Å; L319-E321 VanDerWaalsContact C-N 3.27Å; L319-E321 PolarHBondContact O-N 2.84Å; L319-K322 PolarHBondContact O-N 3.22Å; L319-E323 PolarHBondContact O-N 2.75Å; L319-W384 HydrophobicContact CD1-CH2 3.97Å; L319-W384 HydrophobicContact CD1-CZ3 4.04Å
320	A	84.6	Confident	89.1	Confident	26 Å²	26	50.4 Å²	50.4	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-32.3	175	0	0	0	0	0	113.2	P316 S317 C326 C327	P316-A320 PolarHBondContact O-N 3.43Å; S317-A320 WeakPolarHBondContact O-CB 3.27Å; S317-A320 PolarHBondContact O-N 3.21Å; S317-A320 VanDerWaalsContact O-N 3.11Å; A320-C326 HydrophobicContact CB-CB 4.41Å; A320-C327 HydrophobicContact CB-CB 4.41Å
321	E	82.8	Confident	89	Confident	160 Å²	160	50.2 Å²	50.2	75%	0.748	27%	0.266	S	S	*	.	H	α-helix	trans	-72.6	-34.1	174.4	-73.8	168.2	-162.7	0	0	112.7	S317 L319	S317-E321 WeakPolarHBondContact O-CG 3.26Å; S317-E321 PolarHBondContact O-N 3.43Å; L319-E321 VanDerWaalsContact C-N 3.27Å; L319-E321 PolarHBondContact O-N 2.84Å
322	K	84.4	Confident	88.9	Confident	131 Å²	131	47.3 Å²	47.3	57%	0.57	25%	0.253	S	S	*	.	H	α-helix	trans	-83.7	-34.6	-178.5	-77.8	-172	162.5	-162.1	0	113.7	Y318 L319	Y318-K322 HydrophobicContact CD1-CD 4.33Å; Y318-K322 HydrophobicContact CE1-CD 3.72Å; Y318-K322 HydrophobicContact CE2-CD 4.4Å; Y318-K322 WeakPolarHBondContact O-CG 3.49Å; Y318-K322 PolarHBondContact O-N 3Å; Y318-K322 WeakPolarHBondContact OH-CE 3.18Å; Y318-K322 PolarHBondContact OH-NZ 3.1Å; L319-K322 PolarHBondContact O-N 3.22Å
323	E	85.5	Confident	88.9	Confident	31 Å²	31	46.6 Å²	46.6	15%	0.145	25%	0.248	C	C	.	.			trans	-121.3	109.7	-177.5	-65.7	-163.3	164.6	0	0	109.6	T24 I25 L319 M325 C326	T24-E323 WeakPolarHBondContact CA-OE1 3.36Å; T24-E323 WeakPolarHBondContact CB-OE1 3.42Å; T24-E323 WeakPolarHBondContact CG2-OE1 3.37Å; I25-E323 WeakPolarHBondContact CG1-OE2 3.49Å; I25-E323 PolarHBondContact N-OE1 2.83Å; L319-E323 PolarHBondContact O-N 2.75Å; E323-M325 PolarHBondContact O-N 3.26Å; E323-C326 HydrophobicContact CB-CB 4.24Å; E323-C326 WeakPolarHBondContact O-CB 3.25Å; E323-C326 PolarHBondContact O-N 3.4Å
324	P	82.5	Confident	89	Confident	108 Å²	108	45.6 Å²	45.6	70%	0.701	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-55.7	-25.3	175.6	-26.1	34.3	0	0	0	113.1	C326 C327	P324-C326 PolarHBondContact O-N 3.05Å; P324-C327 PolarHBondContact O-N 2.84Å; P324-C327 PolarHBondContact O-SG 3.11Å
325	M	85	Confident	89.3	Confident	41 Å²	41	42.3 Å²	42.3	20%	0.202	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-63.2	-24.9	173.5	172.9	168.2	-170.2	0	0	113.5	I25 E323 S330 A349 N351 I365	I25-M325 HydrophobicContact CB-SD 4.02Å; I25-M325 HydrophobicContact CD1-CB 4.27Å; I25-M325 HydrophobicContact CD1-CE 3.69Å; I25-M325 HydrophobicContact CD1-CG 3.53Å; I25-M325 HydrophobicContact CD1-SD 3.25Å; I25-M325 WeakPolarHBondContact CD1-SD 3.36Å; I25-M325 HydrophobicContact CG1-SD 4.19Å; I25-M325 HydrophobicContact CG2-CE 3.98Å; I25-M325 HydrophobicContact CG2-SD 3.7Å; E323-M325 PolarHBondContact O-N 3.26Å; M325-S330 WeakPolarHBondContact O-CB 3.21Å; M325-S330 PolarHBondContact O-OG 2.82Å; M325-A349 HydrophobicContact CE-CB 3.68Å; M325-N351 HydrophobicContact CG-CB 4.47Å; M325-I365 HydrophobicContact CE-CB 4.46Å; M325-I365 HydrophobicContact CE-CD1 3.4Å; M325-I365 VanDerWaalsContact CE-CD1 3.4Å; M325-I365 HydrophobicContact CE-CG1 3.95Å; M325-I365 HydrophobicContact SD-CD1 4.21Å
326	C	86.6	Confident	89.5	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.027	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-93.7	-0.7	-174.7	-71.7	0	0	0	0	113.6	W315 A320 E323 P324	W315-C326 HydrophobicContact CB-CB 3.88Å; W315-C326 WeakPolarHBondContact CB-O 3.5Å; W315-C326 VanDerWaalsContact CD1-O 3.3Å; W315-C326 HydrophobicContact CD2-CB 3.92Å; W315-C326 HydrophobicContact CE3-CB 4.39Å; W315-C326 HydrophobicContact CG-CB 3.64Å; A320-C326 HydrophobicContact CB-CB 4.41Å; E323-C326 HydrophobicContact CB-CB 4.24Å; E323-C326 WeakPolarHBondContact O-CB 3.25Å; E323-C326 PolarHBondContact O-N 3.4Å; P324-C326 PolarHBondContact O-N 3.05Å
327	C	86.5	Confident	89.9	Confident	53 Å²	53	40.5 Å²	40.5	36%	0.358	22%	0.219	S	C	.	.	S	Bend	trans	-90.9	175	-177.6	77.8	0	0	0	0	113.1	A320 P324 R329 S330 N353	A320-C327 HydrophobicContact CB-CB 4.41Å; P324-C327 PolarHBondContact O-N 2.84Å; P324-C327 PolarHBondContact O-SG 3.11Å; C327-R329 PolarHBondContact O-N 2.86Å; C327-S330 WeakPolarHBondContact O-CB 3.44Å; C327-S330 PolarHBondContact O-N 3.34Å; C327-S330 PolarHBondContact O-OG 2.84Å; C327-N353 PolarHBondContact O-ND2 3.06Å; C327-N353 PolarHBondContact O-OD1 3.4Å
328	G	87.5	Confident	90.3	Very high	26 Å²	26	36.9 Å²	36.9	27%	0.268	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	-127.9	169.9	0	0	0	0	0	113.8	S330 R331 N353	G328-S330 PolarHBondContact O-N 2.97Å; G328-R331 PolarHBondContact O-NH1 2.92Å; G328-N353 WeakPolarHBondContact CA-OD1 3.48Å
329	R	91.1	Very high	90.7	Very high	45 Å²	45	34.1 Å²	34.1	17%	0.17	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	3.4	175.8	-62.3	-178.4	-175.4	146.8	3.6	113	F250 D253 L256 Y268 C327 L352 N353 D356	F250-R329 HydrophobicContact CE1-CB 4.5Å; F250-R329 WeakPolarHBondContact CE1-O 3.34Å; F250-R329 WeakPolarHBondContact CZ-O 3.32Å; D253-R329 VanDerWaalsContact CG-NH2 3.33Å; D253-R329 IonicContact OD1-CZ 3.63Å; D253-R329 IonicContact OD1-NE 3.18Å; D253-R329 PolarHBondContact OD1-NE 2.82Å; D253-R329 IonicContact OD1-NH2 3.42Å; D253-R329 PolarHBondContact OD1-NH2 3.21Å; D253-R329 IonicContact OD2-CZ 3.01Å; D253-R329 IonicContact OD2-NE 3.22Å; D253-R329 IonicContact OD2-NH2 3.49Å; D253-R329 PolarHBondContact OD2-NH2 3.29Å; L256-R329 HydrophobicContact CD1-CG 4.01Å; Y268-R329 VanDerWaalsContact OH-CZ 3.26Å; Y268-R329 PolarHBondContact OH-NH1 2.95Å; C327-R329 PolarHBondContact O-N 2.86Å; R329-L352 HydrophobicContact CB-CB 4.18Å; R329-N353 PolarHBondContact N-OD1 3.5Å; R329-D356 IonicContact NH1-OD1 2.77Å
330	S	93.1	Very high	91	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.007	22%	0.224	C	C	.	.			trans	-69.8	138.8	176	-64	0	0	0	0	111.9	M325 C327 G328 V350 N351 N353	M325-S330 WeakPolarHBondContact O-CB 3.21Å; M325-S330 PolarHBondContact O-OG 2.82Å; C327-S330 WeakPolarHBondContact O-CB 3.44Å; C327-S330 PolarHBondContact O-N 3.34Å; C327-S330 PolarHBondContact O-OG 2.84Å; G328-S330 PolarHBondContact O-N 2.97Å; S330-V350 CarbonylContact C-O 3.6Å; S330-V350 WeakPolarHBondContact CA-O 3.42Å; S330-N351 WeakPolarHBondContact OG-CA 3.17Å; S330-N351 WeakPolarHBondContact OG-CB 3.27Å; S330-N351 PolarHBondContact OG-OD1 2.86Å; S330-N351 VanDerWaalsContact OG-OD1 3.06Å; S330-N353 PolarHBondContact OG-ND2 3.38Å
331	R	95.6	Very high	91.3	Very high	8 Å²	8	43 Å²	43	3%	0.03	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	158.4	179	-59	-70.2	179.8	-88.9	7	111	F250 S251 E255 V312 H314 W315 G328 V350	F250-R331 HydrophobicContact CD1-CG 4.45Å; F250-R331 HydrophobicContact CD2-CB 4.13Å; F250-R331 HydrophobicContact CD2-CG 3.96Å; F250-R331 HydrophobicContact CE1-CG 4.1Å; F250-R331 HydrophobicContact CE2-CB 3.53Å; F250-R331 HydrophobicContact CE2-CG 3.61Å; F250-R331 HydrophobicContact CG-CG 4.38Å; F250-R331 HydrophobicContact CZ-CB 3.9Å; F250-R331 HydrophobicContact CZ-CG 3.68Å; F250-R331 WeakPolarHBondContact O-CD 3.31Å; F250-R331 WeakPolarHBondContact O-CG 3.45Å; F250-R331 PolarHBondContact O-NE 3Å; S251-R331 PolarHBondContact OG-NH2 3.13Å; E255-R331 IonicContact OE2-NH2 3.71Å; E255-R331 PolarHBondContact OE2-NH2 2.9Å; V312-R331 HydrophobicContact CG1-CB 3.61Å; V312-R331 HydrophobicContact CG1-CG 3.69Å; H314-R331 PolarHBondContact CE1-NE 3.37Å; H314-R331 PolarHBondContact CE1-NH2 3.36Å; H314-R331 PolarHBondContact ND1-NE 3.49Å; H314-R331 PolarHBondContact ND1-NH2 3.15Å; W315-R331 VanDerWaalsContact NE1-C 3.31Å; G328-R331 PolarHBondContact O-NH1 2.92Å; R331-V350 PolarHBondContact N-O 2.72Å; R331-V350 PolarHBondContact O-N 3.02Å
332	L	96.3	Very high	91.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.3	162.4	170.5	65.2	0	0	0	108.1	V4 L313 W315 V334 Y348 L367 F368 W384	V4-L332 HydrophobicContact CB-CD2 4.38Å; V4-L332 HydrophobicContact CG1-CD2 4.06Å; V4-L332 HydrophobicContact CG2-CD2 3.41Å; V4-L332 VanDerWaalsContact CG2-CD2 3.41Å; L313-L332 HydrophobicContact CB-CB 4.24Å; L313-L332 HydrophobicContact CD1-CD2 4Å; L313-L332 PolarHBondContact N-O 2.96Å; L313-L332 PolarHBondContact O-N 2.81Å; W315-L332 HydrophobicContact CH2-CB 4.46Å; W315-L332 HydrophobicContact CZ2-CB 4.12Å; L332-V334 HydrophobicContact CG-CG2 4.28Å; L332-Y348 WeakPolarHBondContact CA-O 3.32Å; L332-L367 HydrophobicContact CD1-CD1 3.79Å; L332-F368 HydrophobicContact CD1-CE1 4.04Å; L332-F368 HydrophobicContact CD2-CE1 4.49Å; L332-W384 HydrophobicContact CB-CZ2 4.5Å; L332-W384 HydrophobicContact CD2-CH2 4.47Å; L332-W384 HydrophobicContact CD2-CZ2 3.7Å
333	V	97.6	Very high	92.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116.5	178.4	-175.3	0	0	0	0	108.9	F250 L270 L277 I310 V312 V335 G347 Y348 V350	F250-V333 HydrophobicContact CD2-CG2 4.26Å; F250-V333 HydrophobicContact CE2-CG2 3.98Å; L270-V333 HydrophobicContact CD1-CG1 3.95Å; L270-V333 HydrophobicContact CD1-CG2 3.88Å; L277-V333 HydrophobicContact CD2-CG1 4.5Å; I310-V333 HydrophobicContact CG2-CG1 3.99Å; V312-V333 HydrophobicContact CG2-CG2 4.39Å; V333-V335 HydrophobicContact CG1-CG2 3.8Å; V333-G347 CarbonylContact O-C 3.55Å; V333-G347 WeakPolarHBondContact O-CA 3.28Å; V333-Y348 PolarHBondContact N-O 3.35Å; V333-Y348 PolarHBondContact O-N 2.92Å; V333-V350 HydrophobicContact CB-CG2 4.03Å; V333-V350 HydrophobicContact CG2-CB 4.06Å; V333-V350 HydrophobicContact CG2-CG2 3.54Å
334	V	98.1	Very high	93.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.9	175.1	-169.8	0	0	0	0	108.4	V6 I310 Q311 L332 L345 R346 F368 L380 A382	V6-V334 HydrophobicContact CG1-CG1 4.42Å; I310-V334 CarbonylContact C-O 3.58Å; I310-V334 WeakPolarHBondContact CA-O 3.43Å; Q311-V334 HydrophobicContact CB-CB 4.35Å; Q311-V334 PolarHBondContact N-O 2.68Å; Q311-V334 PolarHBondContact O-N 3Å; L332-V334 HydrophobicContact CG-CG2 4.28Å; V334-L345 HydrophobicContact CG1-CD2 3.94Å; V334-R346 CarbonylContact C-O 3.56Å; V334-R346 WeakPolarHBondContact CA-O 3.43Å; V334-F368 HydrophobicContact CG1-CE2 4.22Å; V334-F368 HydrophobicContact CG1-CZ 4.32Å; V334-F368 HydrophobicContact CG2-CZ 3.89Å; V334-L380 HydrophobicContact CG1-CD1 4.42Å; V334-L380 HydrophobicContact CG1-CD2 4.17Å; V334-A382 HydrophobicContact CB-CB 4.41Å; V334-A382 HydrophobicContact CG2-CB 3.97Å
335	V	98	Very high	93.8	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142	-175.6	-172.7	0	0	0	0	109.5	L302 I307 F309 V333 T337 L345 R346 Y348	L302-V335 HydrophobicContact CD1-CB 4.3Å; L302-V335 HydrophobicContact CD1-CG1 3.85Å; L302-V335 HydrophobicContact CD1-CG2 4.23Å; I307-V335 HydrophobicContact CB-CG1 4.46Å; I307-V335 HydrophobicContact CG1-CG1 4.13Å; I307-V335 HydrophobicContact CG2-CG1 3.69Å; F309-V335 WeakPolarHBondContact O-CA 3.47Å; V333-V335 HydrophobicContact CG1-CG2 3.8Å; V335-T337 HydrophobicContact CG1-CG2 4.07Å; V335-L345 WeakPolarHBondContact O-CA 3.49Å; V335-R346 PolarHBondContact N-O 3.36Å; V335-R346 PolarHBondContact O-N 2.93Å; V335-Y348 HydrophobicContact CG2-CD2 4.41Å; V335-Y348 HydrophobicContact CG2-CE2 4.42Å
336	V	97.9	Very high	94.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.4	164.5	172	0	0	0	0	108.4	K308 F309 H344 L345 I377 L380	K308-V336 PolarHBondContact N-O 3.19Å; F309-V336 HydrophobicContact CB-CB 4.26Å; F309-V336 HydrophobicContact CD2-CB 3.96Å; F309-V336 HydrophobicContact CD2-CG1 4.16Å; F309-V336 HydrophobicContact CD2-CG2 4.43Å; F309-V336 PolarHBondContact N-O 3.3Å; F309-V336 PolarHBondContact O-N 3.26Å; V336-H344 CarbonylContact C-O 3.56Å; V336-H344 WeakPolarHBondContact CA-O 3.4Å; V336-L345 HydrophobicContact CG2-CB 4.43Å; V336-L345 HydrophobicContact CG2-CG 4.16Å; V336-I377 HydrophobicContact CG1-CB 4.04Å; V336-I377 HydrophobicContact CG1-CD1 4.05Å; V336-I377 HydrophobicContact CG1-CG2 4.2Å; V336-I377 HydrophobicContact CG2-CD1 4.17Å; V336-I377 HydrophobicContact CG2-CG2 4.36Å; V336-L380 HydrophobicContact CG2-CD1 4.16Å; V336-L380 HydrophobicContact CG2-CD2 4.07Å; V336-L380 HydrophobicContact CG2-CG 4.49Å
337	T	97.1	Very high	94.9	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.018	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	160.5	166.9	67.3	0	0	0	0	110.3	L302 P303 R306 I307 V335 S343 H344	L302-T337 HydrophobicContact CB-CG2 4.22Å; L302-T337 HydrophobicContact CD1-CG2 4.42Å; P303-T337 WeakPolarHBondContact O-CB 3.29Å; P303-T337 WeakPolarHBondContact O-CG2 3.45Å; P303-T337 PolarHBondContact O-OG1 2.8Å; R306-T337 CarbonylContact O-C 3.52Å; R306-T337 VanDerWaalsContact O-CA 3.23Å; R306-T337 WeakPolarHBondContact O-CA 3.39Å; I307-T337 HydrophobicContact CG1-CG2 3.81Å; V335-T337 HydrophobicContact CG1-CG2 4.07Å; T337-S343 CarbonylContact O-C 3.6Å; T337-S343 WeakPolarHBondContact O-CA 3.44Å; T337-H344 PolarHBondContact N-O 3.12Å; T337-H344 PolarHBondContact O-N 3.03Å; T337-H344 WeakPolarHBondContact OG1-CB 3.46Å
338	T	95.3	Very high	95.3	Very high	15 Å²	15	21.9 Å²	21.9	9%	0.092	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	146.9	-179.9	52	0	0	0	0	109.7	K305 R306 K308 G342	K305-T338 WeakPolarHBondContact CA-O 3.49Å; K305-T338 WeakPolarHBondContact CB-O 3.25Å; K305-T338 PolarHBondContact N-O 3Å; R306-T338 PolarHBondContact N-O 3.08Å; R306-T338 PolarHBondContact O-N 2.86Å; R306-T338 PolarHBondContact O-OG1 3.29Å; K308-T338 HydrophobicContact CG-CG2 3.66Å; K308-T338 WeakPolarHBondContact CG-OG1 3.09Å; T338-G342 WeakPolarHBondContact CA-O 3.29Å
339	D	93.3	Very high	95.7	Very high	56 Å²	56	20.7 Å²	20.7	30%	0.299	12%	0.119	S	C	.	.			trans	-145.8	-153.1	169.6	59.2	30	0	0	0	110.3	K305 D341 G342 H344	K305-D339 HydrophobicContact CB-CB 3.9Å; D339-D341 WeakPolarHBondContact OD1-CB 3.4Å; D339-D341 PolarHBondContact OD1-N 2.84Å; D339-G342 PolarHBondContact N-O 3.23Å; D339-G342 VanDerWaalsContact N-O 3.16Å; D339-G342 PolarHBondContact OD1-N 2.77Å; D339-H344 IonicContact OD1-NE2 3.44Å; D339-H344 PolarHBondContact OD1-NE2 3.45Å; D339-H344 IonicContact OD2-CD2 3.27Å; D339-H344 IonicContact OD2-NE2 2.74Å; D339-H344 PolarHBondContact OD2-NE2 2.99Å; D339-H344 VanDerWaalsContact OD2-NE2 3.17Å
340	A	91.6	Very high	95.9	Very high	101 Å²	101	18.7 Å²	18.7	84%	0.835	11%	0.112	S	C	*	.	S	Bend	trans	-75.9	-24.8	179.2	0	0	0	0	0	112.8
341	D	92.3	Very high	95.9	Very high	119 Å²	119	20.1 Å²	20.1	64%	0.636	12%	0.119	S	C	*	.	S	Bend	trans	-89	-17.8	-173.4	-61.8	-26.1	0	0	0	111.8	D339 P373 S374	D339-D341 WeakPolarHBondContact OD1-CB 3.4Å; D339-D341 PolarHBondContact OD1-N 2.84Å; D341-P373 CarbonylContact O-C 3.57Å; D341-P373 WeakPolarHBondContact O-CA 3.47Å; D341-S374 PolarHBondContact O-N 3.19Å
342	G	95.2	Very high	95.6	Very high	8 Å²	8	19.8 Å²	19.8	8%	0.082	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.7	-139.6	170.5	0	0	0	0	0	113.6	T338 D339 V372	T338-G342 WeakPolarHBondContact CA-O 3.29Å; D339-G342 PolarHBondContact N-O 3.23Å; D339-G342 VanDerWaalsContact N-O 3.16Å; D339-G342 PolarHBondContact OD1-N 2.77Å; G342-V372 WeakPolarHBondContact CA-O 3.45Å
343	S	97.3	Very high	95.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.6	176.9	-52	0	0	0	0	111.3	T337 V372 T375 R376 I377	T337-S343 CarbonylContact O-C 3.6Å; T337-S343 WeakPolarHBondContact O-CA 3.44Å; S343-V372 PolarHBondContact N-O 3.29Å; S343-V372 PolarHBondContact O-N 2.96Å; S343-T375 WeakPolarHBondContact CB-O 3.48Å; S343-T375 PolarHBondContact N-O 2.91Å; S343-T375 PolarHBondContact OG-O 3.45Å; S343-R376 WeakPolarHBondContact OG-CA 3.46Å; S343-I377 PolarHBondContact OG-N 2.92Å
344	H	97.1	Very high	94.5	Very high	24 Å²	24	27.8 Å²	27.8	11%	0.111	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	111.8	-175	-54.5	-69.2	0	0	0	109.5	V336 T337 D339 D371	V336-H344 CarbonylContact C-O 3.56Å; V336-H344 WeakPolarHBondContact CA-O 3.4Å; T337-H344 PolarHBondContact N-O 3.12Å; T337-H344 PolarHBondContact O-N 3.03Å; T337-H344 WeakPolarHBondContact OG1-CB 3.46Å; D339-H344 IonicContact OD1-NE2 3.44Å; D339-H344 PolarHBondContact OD1-NE2 3.45Å; D339-H344 IonicContact OD2-CD2 3.27Å; D339-H344 IonicContact OD2-NE2 2.74Å; D339-H344 PolarHBondContact OD2-NE2 2.99Å; D339-H344 VanDerWaalsContact OD2-NE2 3.17Å; H344-D371 IonicContact CE1-OD1 2.91Å; H344-D371 IonicContact CG-OD1 2.67Å; H344-D371 IonicContact ND1-OD1 3.21Å; H344-D371 PolarHBondContact ND1-OD1 3.27Å
345	L	97.5	Very high	93.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.1	177.1	-163.9	161.5	0	0	0	109.1	V6 L18 L33 V334 V335 V336 F368 T369 Y370 L380	V6-L345 HydrophobicContact CB-CD1 4.46Å; V6-L345 HydrophobicContact CG1-CD1 3.52Å; V6-L345 HydrophobicContact CG1-CD2 4.35Å; V6-L345 HydrophobicContact CG1-CG 4.42Å; L18-L345 HydrophobicContact CD1-CD1 4.25Å; L33-L345 HydrophobicContact CD1-CD1 4.36Å; L33-L345 HydrophobicContact CD1-CD2 3.51Å; L33-L345 HydrophobicContact CD1-CG 4.45Å; V334-L345 HydrophobicContact CG1-CD2 3.94Å; V335-L345 WeakPolarHBondContact O-CA 3.49Å; V336-L345 HydrophobicContact CG2-CB 4.43Å; V336-L345 HydrophobicContact CG2-CG 4.16Å; L345-F368 HydrophobicContact CD2-CD2 4.14Å; L345-F368 HydrophobicContact CD2-CE2 3.69Å; L345-T369 CarbonylContact O-C 3.6Å; L345-T369 WeakPolarHBondContact O-CA 3.45Å; L345-Y370 WeakPolarHBondContact CB-O 3.23Å; L345-Y370 PolarHBondContact N-O 3.15Å; L345-Y370 PolarHBondContact O-N 2.81Å; L345-L380 HydrophobicContact CD1-CD1 4.19Å
346	R	97.1	Very high	93.3	Very high	35 Å²	35	31.7 Å²	31.7	13%	0.132	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	146.3	-178.3	-57.4	-64.7	-179.7	-94.7	7.7	110.5	V334 V335 Y348 F368 T369 Y370 D371	V334-R346 CarbonylContact C-O 3.56Å; V334-R346 WeakPolarHBondContact CA-O 3.43Å; V335-R346 PolarHBondContact N-O 3.36Å; V335-R346 PolarHBondContact O-N 2.93Å; R346-Y348 HydrophobicContact CB-CD2 4.4Å; R346-Y348 HydrophobicContact CB-CE2 3.48Å; R346-Y348 VanDerWaalsContact CB-CE2 3.48Å; R346-Y348 HydrophobicContact CG-CE2 4.49Å; R346-F368 WeakPolarHBondContact CA-O 3.27Å; R346-T369 WeakPolarHBondContact CD-OG1 3.4Å; R346-T369 PolarHBondContact NE-OG1 3.3Å; R346-T369 VanDerWaalsContact NE-OG1 3.13Å; R346-T369 PolarHBondContact NH1-OG1 3.07Å; R346-T369 PolarHBondContact NH2-OG1 3.34Å; R346-Y370 PolarHBondContact NH1-O 3.35Å; R346-D371 IonicContact CZ-OD1 2.85Å; R346-D371 IonicContact NH1-OD1 2.64Å; R346-D371 PolarHBondContact NH1-OD1 2.92Å; R346-D371 IonicContact NH2-OD1 3.9Å; R346-D371 PolarHBondContact NH2-OD1 3.23Å; R346-D371 IonicContact NH2-OD2 3.12Å; R346-D371 PolarHBondContact NH2-OD2 3.26Å
347	G	96.9	Very high	92.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136	173.9	0	0	0	0	0	110.9	V333 L367 F368	V333-G347 CarbonylContact O-C 3.55Å; V333-G347 WeakPolarHBondContact O-CA 3.28Å; G347-L367 PolarHBondContact O-N 3.43Å; G347-F368 VanDerWaalsContact CA-CE2 3.47Å; G347-F368 PolarHBondContact N-O 2.73Å; G347-F368 PolarHBondContact O-N 2.82Å
348	Y	96.1	Very high	92.6	Very high	17 Å²	17	36.3 Å²	36.3	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.8	-177.5	-57	-87.6	0	0	0	111.2	L302 L332 V333 V335 R346 F364 I365 P366	L302-Y348 HydrophobicContact CD1-CE2 4.42Å; L302-Y348 HydrophobicContact CD2-CE2 4.3Å; L332-Y348 WeakPolarHBondContact CA-O 3.32Å; V333-Y348 PolarHBondContact N-O 3.35Å; V333-Y348 PolarHBondContact O-N 2.92Å; V335-Y348 HydrophobicContact CG2-CD2 4.41Å; V335-Y348 HydrophobicContact CG2-CE2 4.42Å; R346-Y348 HydrophobicContact CB-CD2 4.4Å; R346-Y348 HydrophobicContact CB-CE2 3.48Å; R346-Y348 VanDerWaalsContact CB-CE2 3.48Å; R346-Y348 HydrophobicContact CG-CE2 4.49Å; Y348-F364 AromaticContact CD1-CD1 3.84Å; Y348-F364 HydrophobicContact CD1-CD1 3.84Å; Y348-F364 AromaticContact CD1-CE1 3.21Å; Y348-F364 HydrophobicContact CD1-CE1 3.21Å; Y348-F364 HydrophobicContact CD1-CE2 4.37Å; Y348-F364 AromaticContact CD1-CZ 3.52Å; Y348-F364 HydrophobicContact CD1-CZ 3.52Å; Y348-F364 HydrophobicContact CD2-CE1 4.19Å; Y348-F364 HydrophobicContact CD2-CE2 4.4Å; Y348-F364 AromaticContact CD2-CZ 3.65Å; Y348-F364 HydrophobicContact CD2-CZ 3.65Å; Y348-F364 HydrophobicContact CE1-CD1 4.23Å; Y348-F364 AromaticContact CE1-CE1 3.37Å; Y348-F364 HydrophobicContact CE1-CE1 3.37Å; Y348-F364 AromaticContact CE1-CZ 3.87Å; Y348-F364 HydrophobicContact CE1-CZ 3.87Å; Y348-F364 HydrophobicContact CE2-CE1 4.3Å; Y348-F364 AromaticContact CE2-CZ 3.98Å; Y348-F364 HydrophobicContact CE2-CZ 3.98Å; Y348-F364 HydrophobicContact CG-CD1 4.43Å; Y348-F364 AromaticContact CG-CE1 3.66Å; Y348-F364 HydrophobicContact CG-CE1 3.66Å; Y348-F364 HydrophobicContact CG-CE2 4.02Å; Y348-F364 AromaticContact CG-CZ 3.4Å; Y348-F364 HydrophobicContact CG-CZ 3.4Å; Y348-F364 VanDerWaalsContact CG-CZ 3.4Å; Y348-F364 AromaticContact CZ-CE1 3.93Å; Y348-I365 CarbonylContact C-O 3.47Å; Y348-I365 WeakPolarHBondContact CA-O 3.22Å; Y348-P366 HydrophobicContact CD1-CB 4.02Å; Y348-P366 HydrophobicContact CE1-CB 3.91Å
349	A	95.2	Very high	92.3	Very high	1 Å²	1	41 Å²	41	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.3	160.3	0	0	0	0	0	107.8	I25 W315 M325 I365 L367	I25-A349 HydrophobicContact CD1-CB 3.91Å; I25-A349 HydrophobicContact CG1-CB 4.44Å; W315-A349 HydrophobicContact CH2-CB 4.44Å; W315-A349 HydrophobicContact CZ2-CB 3.87Å; M325-A349 HydrophobicContact CE-CB 3.68Å; A349-I365 HydrophobicContact CB-CB 4.41Å; A349-I365 PolarHBondContact N-O 3.46Å; A349-I365 PolarHBondContact O-N 3.38Å; A349-L367 HydrophobicContact CB-CD1 3.95Å; A349-L367 HydrophobicContact CB-CD2 4.09Å; A349-L367 HydrophobicContact CB-CG 4.04Å
350	V	95.1	Very high	92.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.1	179.7	-175.2	0	0	0	0	109	F250 S330 R331 V333 L352 L358 S363 F364	F250-V350 HydrophobicContact CE2-CB 4.05Å; F250-V350 HydrophobicContact CE2-CG1 3.94Å; F250-V350 HydrophobicContact CZ-CB 4.28Å; F250-V350 HydrophobicContact CZ-CG1 3.94Å; S330-V350 CarbonylContact C-O 3.6Å; S330-V350 WeakPolarHBondContact CA-O 3.42Å; R331-V350 PolarHBondContact N-O 2.72Å; R331-V350 PolarHBondContact O-N 3.02Å; V333-V350 HydrophobicContact CB-CG2 4.03Å; V333-V350 HydrophobicContact CG2-CB 4.06Å; V333-V350 HydrophobicContact CG2-CG2 3.54Å; V350-L352 HydrophobicContact CG1-CD2 4.43Å; V350-L352 HydrophobicContact CG1-CG 4.18Å; V350-L358 HydrophobicContact CG1-CD2 3.43Å; V350-L358 VanDerWaalsContact CG1-CD2 3.43Å; V350-S363 CarbonylContact C-O 3.49Å; V350-S363 WeakPolarHBondContact CA-O 3.41Å; V350-F364 HydrophobicContact CG1-CD2 4.4Å; V350-F364 HydrophobicContact CG2-CD2 3.55Å; V350-F364 HydrophobicContact CG2-CE2 3.71Å
351	N	92.7	Very high	91.8	Very high	32 Å²	32	40.7 Å²	40.7	17%	0.171	24%	0.239	C	C	.	.			trans	-117	108.8	-177.6	177.9	-2	0	0	0	111.5	M325 S330 N353 S363	M325-N351 HydrophobicContact CG-CB 4.47Å; S330-N351 WeakPolarHBondContact OG-CA 3.17Å; S330-N351 WeakPolarHBondContact OG-CB 3.27Å; S330-N351 PolarHBondContact OG-OD1 2.86Å; S330-N351 VanDerWaalsContact OG-OD1 3.06Å; N351-N353 WeakPolarHBondContact OD1-CB 3.29Å; N351-N353 PolarHBondContact OD1-N 3.33Å; N351-N353 PolarHBondContact OD1-ND2 3.37Å; N351-S363 PolarHBondContact N-O 2.86Å; N351-S363 WeakPolarHBondContact O-CB 3.32Å
352	L	90.6	Very high	91.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.228	C	C	.	.			trans	-112.7	27	-179.6	-60.4	-175.6	0	0	0	113.1	F250 L279 R329 V350 T355 I357 L358	F250-L352 HydrophobicContact CD1-CD1 4.23Å; F250-L352 HydrophobicContact CE1-CB 4.37Å; F250-L352 HydrophobicContact CE1-CD1 3.58Å; F250-L352 HydrophobicContact CE1-CG 4.13Å; F250-L352 HydrophobicContact CZ-CD1 3.89Å; F250-L352 HydrophobicContact CZ-CG 4.15Å; L279-L352 HydrophobicContact CD1-CD1 4Å; L279-L352 HydrophobicContact CD2-CD1 3.35Å; L279-L352 HydrophobicContact CG-CD1 4.31Å; R329-L352 HydrophobicContact CB-CB 4.18Å; V350-L352 HydrophobicContact CG1-CD2 4.43Å; V350-L352 HydrophobicContact CG1-CG 4.18Å; L352-T355 CarbonylContact C-O 3.24Å; L352-T355 VanDerWaalsContact C-O 3.24Å; L352-T355 WeakPolarHBondContact CA-O 3.06Å; L352-T355 VanDerWaalsContact CB-O 3.26Å; L352-T355 WeakPolarHBondContact CB-O 3.38Å; L352-I357 WeakPolarHBondContact CD2-O 3.24Å; L352-L358 HydrophobicContact CD2-CD2 4.25Å
353	N	86.9	Confident	91.3	Very high	60 Å²	60	37.8 Å²	37.8	32%	0.321	23%	0.227	S	C	.	.	S	Bend	trans	-69.5	-40.1	-178.3	-70.6	-29	0	0	0	112.7	C327 G328 R329 S330 N351	C327-N353 PolarHBondContact O-ND2 3.06Å; C327-N353 PolarHBondContact O-OD1 3.4Å; G328-N353 WeakPolarHBondContact CA-OD1 3.48Å; R329-N353 PolarHBondContact N-OD1 3.5Å; S330-N353 PolarHBondContact OG-ND2 3.38Å; N351-N353 WeakPolarHBondContact OD1-CB 3.29Å; N351-N353 PolarHBondContact OD1-N 3.33Å; N351-N353 PolarHBondContact OD1-ND2 3.37Å
354	S	83.5	Confident	91.1	Very high	109 Å²	109	38.1 Å²	38.1	76%	0.762	23%	0.229	S	C	*	.	S	Bend	trans	-103.5	-13.2	-178.2	54.6	0	0	0	0	113.7
355	T	85.1	Confident	91	Very high	52 Å²	52	37.5 Å²	37.5	32%	0.319	23%	0.226	S	C	.	.			trans	-144.4	155.6	-176.8	77.7	0	0	0	0	110.1	L352 I357	L352-T355 CarbonylContact C-O 3.24Å; L352-T355 VanDerWaalsContact C-O 3.24Å; L352-T355 WeakPolarHBondContact CA-O 3.06Å; L352-T355 VanDerWaalsContact CB-O 3.26Å; L352-T355 WeakPolarHBondContact CB-O 3.38Å; T355-I357 VanDerWaalsContact C-N 3.31Å; T355-I357 PolarHBondContact OG1-N 2.88Å; T355-I357 PolarHBondContact OG1-O 2.92Å
356	D	84.9	Confident	90.8	Very high	32 Å²	32	39.6 Å²	39.6	17%	0.171	24%	0.24	C	C	.	.	S	Bend	trans	-99.8	26.2	168.2	-64.1	-28.9	0	0	0	111.1	Y268 L279 K281 T297 S298 R329	Y268-D356 PolarHBondContact OH-OD1 2.91Å; L279-D356 WeakPolarHBondContact CD2-O 3.38Å; K281-D356 WeakPolarHBondContact CD-OD2 3.33Å; K281-D356 IonicContact NZ-OD2 2.71Å; K281-D356 PolarHBondContact NZ-OD2 3.44Å; T297-D356 WeakPolarHBondContact CB-O 3.16Å; T297-D356 HydrophobicContact CG2-CB 3.28Å; T297-D356 VanDerWaalsContact CG2-O 3.25Å; T297-D356 WeakPolarHBondContact CG2-O 3.41Å; S298-D356 PolarHBondContact OG-O 3.18Å; R329-D356 IonicContact NH1-OD1 2.77Å
357	I	89.9	Confident	90.7	Very high	95 Å²	95	38 Å²	38	49%	0.487	23%	0.234	S	C	.	.			trans	-114	129.3	-171.9	-56.2	175.6	0	0	0	110.6	S298 L352 T355 E359 S363	S298-I357 WeakPolarHBondContact OG-CA 3.11Å; L352-I357 WeakPolarHBondContact CD2-O 3.24Å; T355-I357 VanDerWaalsContact C-N 3.31Å; T355-I357 PolarHBondContact OG1-N 2.88Å; T355-I357 PolarHBondContact OG1-O 2.92Å; I357-E359 HydrophobicContact CG2-CB 4.32Å; I357-E359 PolarHBondContact O-N 3.33Å; I357-S363 PolarHBondContact O-OG 3.27Å
358	L	90.1	Very high	90.7	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.026	23%	0.234	C	C	.	.			trans	-82.7	85.5	169.1	-60.2	176.3	0	0	0	109.9	L270 L277 L279 S298 V300 V350 L352 F364	L270-L358 HydrophobicContact CD2-CD1 4.18Å; L277-L358 HydrophobicContact CG-CD1 4.45Å; L279-L358 HydrophobicContact CB-CD1 4.08Å; L279-L358 HydrophobicContact CB-CG 4.33Å; S298-L358 PolarHBondContact OG-N 3.31Å; V300-L358 HydrophobicContact CB-CB 4.19Å; V300-L358 HydrophobicContact CG1-CB 4.18Å; V300-L358 HydrophobicContact CG1-CD1 4Å; V350-L358 HydrophobicContact CG1-CD2 3.43Å; V350-L358 VanDerWaalsContact CG1-CD2 3.43Å; L352-L358 HydrophobicContact CD2-CD2 4.25Å; L358-F364 HydrophobicContact CB-CD2 4.49Å; L358-F364 HydrophobicContact CD2-CD2 4.1Å
359	E	90.1	Very high	90.8	Very high	113 Å²	113	38.4 Å²	38.4	53%	0.528	24%	0.238	S	C	.	.			trans	-99.9	116.8	-178.1	-175.3	-176.1	-154.6	0	0	110.2	I357 G361 S362 S363 F364	I357-E359 HydrophobicContact CG2-CB 4.32Å; I357-E359 PolarHBondContact O-N 3.33Å; E359-G361 PolarHBondContact O-N 2.93Å; E359-S362 WeakPolarHBondContact CB-OG 3.21Å; E359-S362 WeakPolarHBondContact CG-OG 3.28Å; E359-S362 PolarHBondContact O-N 3.22Å; E359-S362 PolarHBondContact O-OG 3.16Å; E359-S362 PolarHBondContact OE2-OG 3.49Å; E359-S363 PolarHBondContact N-OG 3.37Å; E359-S363 PolarHBondContact O-N 3.32Å; E359-F364 WeakPolarHBondContact O-CB 3.43Å; E359-F364 PolarHBondContact O-N 2.9Å
360	P	89.1	Confident	90.9	Very high	93 Å²	93	40.4 Å²	40.4	60%	0.604	25%	0.245	S	C	*	.	B	Isolated β-bridge	trans	-57.1	131.3	179.6	-25.9	35	0	0	0	112.7	V300 S362	V300-P360 HydrophobicContact CG2-CG 3.79Å; P360-S362 PolarHBondContact O-N 3.01Å
361	G	85.4	Confident	91	Very high	57 Å²	57	44 Å²	44	59%	0.588	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	-12.1	176.5	0	0	0	0	0	115.1	E359 F364	E359-G361 PolarHBondContact O-N 2.93Å; G361-F364 PolarHBondContact N-O 2.86Å
362	S	87	Confident	91.1	Very high	57 Å²	57	43.3 Å²	43.3	40%	0.399	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-77.7	174.6	59.9	0	0	0	0	111.4	E359 P360 I365	E359-S362 WeakPolarHBondContact CB-OG 3.21Å; E359-S362 WeakPolarHBondContact CG-OG 3.28Å; E359-S362 PolarHBondContact O-N 3.22Å; E359-S362 PolarHBondContact O-OG 3.16Å; E359-S362 PolarHBondContact OE2-OG 3.49Å; P360-S362 PolarHBondContact O-N 3.01Å; S362-I365 WeakPolarHBondContact O-CD1 3.49Å; S362-I365 WeakPolarHBondContact O-CG1 3.37Å
363	S	89.7	Confident	91.4	Very high	10 Å²	10	47.8 Å²	47.8	7%	0.07	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-12.4	177.5	62.3	0	0	0	0	113	V350 N351 I357 E359	V350-S363 CarbonylContact C-O 3.49Å; V350-S363 WeakPolarHBondContact CA-O 3.41Å; N351-S363 PolarHBondContact N-O 2.86Å; N351-S363 WeakPolarHBondContact O-CB 3.32Å; I357-S363 PolarHBondContact O-OG 3.27Å; E359-S363 PolarHBondContact N-OG 3.37Å; E359-S363 PolarHBondContact O-N 3.32Å
364	F	93.2	Very high	91.7	Very high	7 Å²	7	50.4 Å²	50.4	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	92.8	179.7	-167.4	-94.2	0	0	0	110.4	L277 V300 L302 Y348 V350 L358 E359 G361	L277-F364 HydrophobicContact CD2-CE2 3.84Å; L277-F364 HydrophobicContact CD2-CZ 4.16Å; V300-F364 HydrophobicContact CG1-CD1 4.45Å; V300-F364 HydrophobicContact CG1-CD2 4.29Å; V300-F364 HydrophobicContact CG1-CE1 4.14Å; V300-F364 HydrophobicContact CG1-CE2 4.01Å; V300-F364 HydrophobicContact CG1-CZ 3.93Å; V300-F364 HydrophobicContact CG2-CD1 4.2Å; V300-F364 HydrophobicContact CG2-CE1 4.27Å; L302-F364 HydrophobicContact CD2-CE1 3.65Å; L302-F364 HydrophobicContact CD2-CZ 3.64Å; Y348-F364 AromaticContact CD1-CD1 3.84Å; Y348-F364 HydrophobicContact CD1-CD1 3.84Å; Y348-F364 AromaticContact CD1-CE1 3.21Å; Y348-F364 HydrophobicContact CD1-CE1 3.21Å; Y348-F364 HydrophobicContact CD1-CE2 4.37Å; Y348-F364 AromaticContact CD1-CZ 3.52Å; Y348-F364 HydrophobicContact CD1-CZ 3.52Å; Y348-F364 HydrophobicContact CD2-CE1 4.19Å; Y348-F364 HydrophobicContact CD2-CE2 4.4Å; Y348-F364 AromaticContact CD2-CZ 3.65Å; Y348-F364 HydrophobicContact CD2-CZ 3.65Å; Y348-F364 HydrophobicContact CE1-CD1 4.23Å; Y348-F364 AromaticContact CE1-CE1 3.37Å; Y348-F364 HydrophobicContact CE1-CE1 3.37Å; Y348-F364 AromaticContact CE1-CZ 3.87Å; Y348-F364 HydrophobicContact CE1-CZ 3.87Å; Y348-F364 HydrophobicContact CE2-CE1 4.3Å; Y348-F364 AromaticContact CE2-CZ 3.98Å; Y348-F364 HydrophobicContact CE2-CZ 3.98Å; Y348-F364 HydrophobicContact CG-CD1 4.43Å; Y348-F364 AromaticContact CG-CE1 3.66Å; Y348-F364 HydrophobicContact CG-CE1 3.66Å; Y348-F364 HydrophobicContact CG-CE2 4.02Å; Y348-F364 AromaticContact CG-CZ 3.4Å; Y348-F364 HydrophobicContact CG-CZ 3.4Å; Y348-F364 VanDerWaalsContact CG-CZ 3.4Å; Y348-F364 AromaticContact CZ-CE1 3.93Å; V350-F364 HydrophobicContact CG1-CD2 4.4Å; V350-F364 HydrophobicContact CG2-CD2 3.55Å; V350-F364 HydrophobicContact CG2-CE2 3.71Å; L358-F364 HydrophobicContact CB-CD2 4.49Å; L358-F364 HydrophobicContact CD2-CD2 4.1Å; E359-F364 WeakPolarHBondContact O-CB 3.43Å; E359-F364 PolarHBondContact O-N 2.9Å; G361-F364 PolarHBondContact N-O 2.86Å
365	I	94	Very high	92.3	Very high	11 Å²	11	46.8 Å²	46.8	6%	0.056	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.5	-169.8	-49.9	-169.1	0	0	0	110.8	I25 T27 M325 Y348 A349 S362 L367	I25-I365 HydrophobicContact CG2-CD1 4.39Å; I25-I365 HydrophobicContact CG2-CG2 4.4Å; T27-I365 HydrophobicContact CG2-CD1 3.95Å; T27-I365 HydrophobicContact CG2-CG2 4.19Å; M325-I365 HydrophobicContact CE-CB 4.46Å; M325-I365 HydrophobicContact CE-CD1 3.4Å; M325-I365 VanDerWaalsContact CE-CD1 3.4Å; M325-I365 HydrophobicContact CE-CG1 3.95Å; M325-I365 HydrophobicContact SD-CD1 4.21Å; Y348-I365 CarbonylContact C-O 3.47Å; Y348-I365 WeakPolarHBondContact CA-O 3.22Å; A349-I365 HydrophobicContact CB-CB 4.41Å; A349-I365 PolarHBondContact N-O 3.46Å; A349-I365 PolarHBondContact O-N 3.38Å; S362-I365 WeakPolarHBondContact O-CD1 3.49Å; S362-I365 WeakPolarHBondContact O-CG1 3.37Å; I365-L367 PolarHBondContact O-N 2.73Å
366	P	95.2	Very high	92.8	Very high	44 Å²	44	50.6 Å²	50.6	29%	0.286	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	125.6	177.1	29.5	-33.6	0	0	0	111.5	P30 Y348	P30-P366 HydrophobicContact CB-CB 4.19Å; P30-P366 HydrophobicContact CG-CB 4.29Å; Y348-P366 HydrophobicContact CD1-CB 4.02Å; Y348-P366 HydrophobicContact CE1-CB 3.91Å
367	L	95	Very high	93.4	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-41.1	-178.9	-64.4	-176.5	0	0	0	113.7	Y20 I25 P30 K31 W315 L332 G347 A349 I365	Y20-L367 HydrophobicContact CE1-CB 4.39Å; Y20-L367 HydrophobicContact CE1-CD1 4.49Å; I25-L367 HydrophobicContact CB-CD2 4.49Å; I25-L367 HydrophobicContact CG1-CD2 4.31Å; I25-L367 HydrophobicContact CG2-CD2 3.99Å; P30-L367 WeakPolarHBondContact CA-O 3.45Å; K31-L367 PolarHBondContact N-O 3.46Å; W315-L367 HydrophobicContact CH2-CD1 3.86Å; W315-L367 HydrophobicContact CZ2-CD1 4.42Å; L332-L367 HydrophobicContact CD1-CD1 3.79Å; G347-L367 PolarHBondContact O-N 3.43Å; A349-L367 HydrophobicContact CB-CD1 3.95Å; A349-L367 HydrophobicContact CB-CD2 4.09Å; A349-L367 HydrophobicContact CB-CG 4.04Å; I365-L367 PolarHBondContact O-N 2.73Å
368	F	96.5	Very high	93.8	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	159.7	-177.8	60.1	-104.5	0	0	0	113.8	V4 V6 Y20 K31 L33 L332 V334 L345 R346 G347	V4-F368 HydrophobicContact CG1-CZ 4.46Å; V4-F368 HydrophobicContact CG2-CE1 4.43Å; V6-F368 HydrophobicContact CG2-CE2 4.46Å; V6-F368 HydrophobicContact CG2-CZ 4.41Å; Y20-F368 AromaticContact CD1-CD1 3.47Å; Y20-F368 HydrophobicContact CD1-CD1 3.47Å; Y20-F368 VanDerWaalsContact CD1-CD1 3.47Å; Y20-F368 AromaticContact CD1-CE1 3.86Å; Y20-F368 HydrophobicContact CD1-CE1 3.86Å; Y20-F368 HydrophobicContact CD1-CG 4.47Å; Y20-F368 HydrophobicContact CD2-CB 3.73Å; Y20-F368 AromaticContact CD2-CD1 3.92Å; Y20-F368 HydrophobicContact CD2-CD1 3.92Å; Y20-F368 HydrophobicContact CD2-CG 4.18Å; Y20-F368 AromaticContact CE1-CD1 3.83Å; Y20-F368 HydrophobicContact CE1-CD1 3.83Å; Y20-F368 HydrophobicContact CE1-CE1 4.4Å; Y20-F368 HydrophobicContact CE2-CB 3.99Å; Y20-F368 HydrophobicContact CE2-CD1 4.25Å; Y20-F368 HydrophobicContact CG-CB 4.18Å; Y20-F368 AromaticContact CG-CD1 3.52Å; Y20-F368 HydrophobicContact CG-CD1 3.52Å; Y20-F368 HydrophobicContact CG-CE1 4.14Å; Y20-F368 HydrophobicContact CG-CG 4.1Å; K31-F368 CarbonylContact O-C 3.58Å; K31-F368 WeakPolarHBondContact O-CA 3.21Å; K31-F368 VanDerWaalsContact O-CB 3.28Å; K31-F368 WeakPolarHBondContact O-CB 3.49Å; L33-F368 HydrophobicContact CD1-CD2 3.82Å; L33-F368 HydrophobicContact CD1-CE2 4.06Å; L33-F368 HydrophobicContact CD2-CB 3.87Å; L33-F368 HydrophobicContact CD2-CD1 4.38Å; L33-F368 HydrophobicContact CD2-CD2 3.53Å; L33-F368 HydrophobicContact CD2-CE2 4.08Å; L33-F368 HydrophobicContact CD2-CG 3.69Å; L33-F368 HydrophobicContact CG-CB 4.27Å; L33-F368 HydrophobicContact CG-CD2 3.76Å; L33-F368 HydrophobicContact CG-CE2 4.43Å; L33-F368 HydrophobicContact CG-CG 4.26Å; L332-F368 HydrophobicContact CD1-CE1 4.04Å; L332-F368 HydrophobicContact CD2-CE1 4.49Å; V334-F368 HydrophobicContact CG1-CE2 4.22Å; V334-F368 HydrophobicContact CG1-CZ 4.32Å; V334-F368 HydrophobicContact CG2-CZ 3.89Å; L345-F368 HydrophobicContact CD2-CD2 4.14Å; L345-F368 HydrophobicContact CD2-CE2 3.69Å; R346-F368 WeakPolarHBondContact CA-O 3.27Å; G347-F368 VanDerWaalsContact CA-CE2 3.47Å; G347-F368 PolarHBondContact N-O 2.73Å; G347-F368 PolarHBondContact O-N 2.82Å
369	T	97	Very high	94.1	Very high	23 Å²	23	46.3 Å²	46.3	14%	0.141	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	149.7	-176.2	-176.4	0	0	0	0	111.4	P30 K31 L32 L33 L345 R346	P30-T369 HydrophobicContact CB-CG2 4.03Å; P30-T369 HydrophobicContact CG-CG2 4.18Å; K31-T369 PolarHBondContact O-N 3.27Å; L32-T369 WeakPolarHBondContact CA-O 3.17Å; L32-T369 HydrophobicContact CD1-CG2 4.5Å; L33-T369 PolarHBondContact N-O 3.08Å; L345-T369 CarbonylContact O-C 3.6Å; L345-T369 WeakPolarHBondContact O-CA 3.45Å; R346-T369 WeakPolarHBondContact CD-OG1 3.4Å; R346-T369 PolarHBondContact NE-OG1 3.3Å; R346-T369 VanDerWaalsContact NE-OG1 3.13Å; R346-T369 PolarHBondContact NH1-OG1 3.07Å; R346-T369 PolarHBondContact NH2-OG1 3.34Å
370	Y	97.3	Very high	94.5	Very high	43 Å²	43	41.6 Å²	41.6	17%	0.169	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	131.3	167.5	-165.3	-91.4	0	0	0	110	L18 L32 L33 P35 L345 R346 V372	L18-Y370 HydrophobicContact CD1-CD1 3.57Å; L18-Y370 HydrophobicContact CD1-CD2 4.03Å; L18-Y370 HydrophobicContact CD1-CE1 4.08Å; L18-Y370 HydrophobicContact CD1-CE2 4.48Å; L18-Y370 HydrophobicContact CD1-CG 3.53Å; L18-Y370 HydrophobicContact CD2-CD2 4.44Å; L18-Y370 HydrophobicContact CD2-CE1 4.24Å; L18-Y370 HydrophobicContact CD2-CE2 4.15Å; L32-Y370 HydrophobicContact CD1-CD2 4.2Å; L32-Y370 HydrophobicContact CG-CD2 4.47Å; L33-Y370 HydrophobicContact CB-CD2 3.94Å; L33-Y370 HydrophobicContact CB-CG 4.29Å; L33-Y370 WeakPolarHBondContact O-CD2 3.18Å; P35-Y370 HydrophobicContact CG-CE2 3.87Å; L345-Y370 WeakPolarHBondContact CB-O 3.23Å; L345-Y370 PolarHBondContact N-O 3.15Å; L345-Y370 PolarHBondContact O-N 2.81Å; R346-Y370 PolarHBondContact NH1-O 3.35Å; Y370-V372 HydrophobicContact CD1-CG2 3.95Å; Y370-V372 HydrophobicContact CE1-CG2 4.06Å
371	D	96.8	Very high	94.9	Very high	78 Å²	78	37.8 Å²	37.8	42%	0.417	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	136.6	179.4	-67.7	-33.2	0	0	0	110.7	H344 R346	H344-D371 IonicContact CE1-OD1 2.91Å; H344-D371 IonicContact CG-OD1 2.67Å; H344-D371 IonicContact ND1-OD1 3.21Å; H344-D371 PolarHBondContact ND1-OD1 3.27Å; R346-D371 IonicContact CZ-OD1 2.85Å; R346-D371 IonicContact NH1-OD1 2.64Å; R346-D371 PolarHBondContact NH1-OD1 2.92Å; R346-D371 IonicContact NH2-OD1 3.9Å; R346-D371 PolarHBondContact NH2-OD1 3.23Å; R346-D371 IonicContact NH2-OD2 3.12Å; R346-D371 PolarHBondContact NH2-OD2 3.26Å
372	V	96.2	Very high	95.5	Very high	17 Å²	17	35.2 Å²	35.2	10%	0.103	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	93.5	176.9	-166.1	0	0	0	0	107.4	F16 G342 S343 Y370 T375 I377	F16-V372 HydrophobicContact CE2-CG2 4.46Å; F16-V372 HydrophobicContact CZ-CG2 3.84Å; G342-V372 WeakPolarHBondContact CA-O 3.45Å; S343-V372 PolarHBondContact N-O 3.29Å; S343-V372 PolarHBondContact O-N 2.96Å; Y370-V372 HydrophobicContact CD1-CG2 3.95Å; Y370-V372 HydrophobicContact CE1-CG2 4.06Å; V372-T375 HydrophobicContact CG1-CG2 4.32Å; V372-I377 HydrophobicContact CG2-CD1 4.01Å
373	P	95.5	Very high	96	Very high	95 Å²	95	34.2 Å²	34.2	62%	0.617	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	141.5	-173.4	28.4	-34.6	0	0	0	110.8	D341 T375	D341-P373 CarbonylContact O-C 3.57Å; D341-P373 WeakPolarHBondContact O-CA 3.47Å; P373-T375 PolarHBondContact O-N 3.02Å; P373-T375 PolarHBondContact O-OG1 2.94Å
374	S	94.2	Very high	96.2	Very high	115 Å²	115	35.8 Å²	35.8	80%	0.804	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	7.1	174.2	-54.6	0	0	0	0	116.2	D341	D341-S374 PolarHBondContact O-N 3.19Å
375	T	95.4	Very high	96	Very high	33 Å²	33	37 Å²	37	20%	0.202	21%	0.205	C	C	.	.			trans	-121.3	134.9	-179	-57.6	0	0	0	0	110	T10 S343 V372 P373	T10-T375 HydrophobicContact CG2-CG2 3.5Å; S343-T375 WeakPolarHBondContact CB-O 3.48Å; S343-T375 PolarHBondContact N-O 2.91Å; S343-T375 PolarHBondContact OG-O 3.45Å; V372-T375 HydrophobicContact CG1-CG2 4.32Å; P373-T375 PolarHBondContact O-N 3.02Å; P373-T375 PolarHBondContact O-OG1 2.94Å
376	R	95.5	Very high	95.5	Very high	132 Å²	132	39.3 Å²	39.3	50%	0.498	22%	0.223	S	C	.	.			trans	-91	116	175.8	-177.4	173.8	173.5	-172.3	-6.3	110.2	T10 Y11 S343	T10-R376 CarbonylContact C-O 3.41Å; T10-R376 VanDerWaalsContact CA-O 3.3Å; T10-R376 WeakPolarHBondContact CA-O 3.46Å; Y11-R376 PolarHBondContact N-O 2.79Å; S343-R376 WeakPolarHBondContact OG-CA 3.46Å
377	I	98	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.6	164.8	-65.4	172.7	0	0	0	108.1	C8 G9 F16 F309 V336 S343 V372 T379	C8-I377 HydrophobicContact CB-CD1 4.43Å; C8-I377 HydrophobicContact CB-CG1 4.48Å; C8-I377 HydrophobicContact CB-CG2 4.17Å; G9-I377 WeakPolarHBondContact O-CA 3.36Å; F16-I377 HydrophobicContact CZ-CD1 4.05Å; F16-I377 HydrophobicContact CZ-CG1 4.21Å; F309-I377 HydrophobicContact CD2-CG2 4.18Å; F309-I377 HydrophobicContact CE2-CG2 4.07Å; F309-I377 WeakPolarHBondContact CE2-O 3.13Å; V336-I377 HydrophobicContact CG1-CB 4.04Å; V336-I377 HydrophobicContact CG1-CD1 4.05Å; V336-I377 HydrophobicContact CG1-CG2 4.2Å; V336-I377 HydrophobicContact CG2-CD1 4.17Å; V336-I377 HydrophobicContact CG2-CG2 4.36Å; S343-I377 PolarHBondContact OG-N 2.92Å; V372-I377 HydrophobicContact CG2-CD1 4.01Å; I377-T379 WeakPolarHBondContact CG2-O 3.44Å
378	T	97.7	Very high	92.2	Very high	28 Å²	28	43.3 Å²	43.3	17%	0.172	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-12.7	-176.6	44.3	0	0	0	0	113	G9 T10 Y11 V47 F309	G9-T378 PolarHBondContact O-N 2.99Å; G9-T378 PolarHBondContact O-OG1 3.4Å; G9-T378 VanDerWaalsContact O-OG1 3.11Å; T10-T378 WeakPolarHBondContact CA-OG1 3.46Å; T10-T378 PolarHBondContact N-OG1 2.77Å; T10-T378 PolarHBondContact O-OG1 2.82Å; Y11-T378 HydrophobicContact CD2-CG2 4.21Å; V47-T378 WeakPolarHBondContact O-CB 3.43Å; V47-T378 PolarHBondContact O-OG1 3.18Å; F309-T378 WeakPolarHBondContact CZ-O 3.47Å
379	T	98.2	Very high	89.3	Confident	13 Å²	13	50.4 Å²	50.4	8%	0.08	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	151.6	175.1	-178.5	0	0	0	0	110.5	C8 G9 V47 T49 I50 I377	C8-T379 WeakPolarHBondContact CA-O 3.35Å; G9-T379 PolarHBondContact N-O 2.84Å; G9-T379 VanDerWaalsContact N-O 3.15Å; G9-T379 PolarHBondContact O-N 3.37Å; V47-T379 HydrophobicContact CB-CG2 4.44Å; V47-T379 HydrophobicContact CG1-CG2 3.86Å; T49-T379 WeakPolarHBondContact CA-OG1 3.39Å; I50-T379 HydrophobicContact CB-CG2 3.69Å; I50-T379 HydrophobicContact CG2-CG2 3.76Å; I50-T379 WeakPolarHBondContact CG2-OG1 3.42Å; I50-T379 PolarHBondContact N-OG1 3.07Å; I377-T379 WeakPolarHBondContact CG2-O 3.44Å
380	L	98	Very high	86.2	Confident	15 Å²	15	54.7 Å²	54.7	8%	0.079	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	136.7	-177.3	173.6	72.6	0	0	0	109.2	V6 C8 F309 Q311 V334 V336 L345	V6-L380 HydrophobicContact CG1-CD1 3.4Å; V6-L380 VanDerWaalsContact CG1-CD1 3.4Å; C8-L380 VanDerWaalsContact SG-CD1 3.56Å; F309-L380 HydrophobicContact CB-CB 3.9Å; F309-L380 HydrophobicContact CB-CD2 3.87Å; F309-L380 HydrophobicContact CD2-CB 4.37Å; F309-L380 HydrophobicContact CG-CB 4.12Å; Q311-L380 HydrophobicContact CB-CD2 4.05Å; V334-L380 HydrophobicContact CG1-CD1 4.42Å; V334-L380 HydrophobicContact CG1-CD2 4.17Å; V336-L380 HydrophobicContact CG2-CD1 4.16Å; V336-L380 HydrophobicContact CG2-CD2 4.07Å; V336-L380 HydrophobicContact CG2-CG 4.49Å; L345-L380 HydrophobicContact CD1-CD1 4.19Å
381	A	98.1	Very high	82.9	Confident	12 Å²	12	60.3 Å²	60.3	10%	0.099	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	143.2	160	0	0	0	0	0	109.4	V6 S7 I50	V6-A381 CarbonylContact C-O 3.52Å; V6-A381 WeakPolarHBondContact CA-O 3.32Å; S7-A381 PolarHBondContact N-O 3.44Å; S7-A381 PolarHBondContact O-N 3.37Å; I50-A381 HydrophobicContact CG2-CB 3.78Å
382	A	97.8	Very high	79.7	Confident	4 Å²	4	63.6 Å²	63.6	3%	0.033	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.8	175.1	0	0	0	0	0	109.4	V4 L5 V6 Q311 L313 V334	V4-A382 HydrophobicContact CG1-CB 4.44Å; L5-A382 CarbonylContact O-C 3.29Å; L5-A382 VanDerWaalsContact O-CA 3.25Å; L5-A382 WeakPolarHBondContact O-CA 3.19Å; V6-A382 HydrophobicContact CG1-CB 4.47Å; V6-A382 HydrophobicContact CG2-CB 4.14Å; Q311-A382 HydrophobicContact CG-CB 4.06Å; L313-A382 HydrophobicContact CD1-CB 3.84Å; L313-A382 VanDerWaalsContact CD2-O 3.28Å; L313-A382 WeakPolarHBondContact CD2-O 3.41Å; V334-A382 HydrophobicContact CB-CB 4.41Å; V334-A382 HydrophobicContact CG2-CB 3.97Å
383	I	95.8	Very high	76.8	Confident	35 Å²	35	67.7 Å²	67.7	18%	0.179	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	157.8	174.9	62.9	164.9	0	0	0	110.8	V4 L5 T52 T385	V4-I383 WeakPolarHBondContact CA-O 3.14Å; L5-I383 HydrophobicContact CB-CG1 4.07Å; L5-I383 HydrophobicContact CD2-CD1 4.34Å; L5-I383 HydrophobicContact CD2-CG1 4.33Å; L5-I383 PolarHBondContact N-O 3.15Å; L5-I383 PolarHBondContact O-N 2.96Å; T52-I383 HydrophobicContact CG2-CD1 3.71Å; T52-I383 HydrophobicContact CG2-CG1 3.9Å; I383-T385 HydrophobicContact CD1-CG2 3.95Å; I383-T385 HydrophobicContact CG1-CG2 4.09Å
384	W	94.1	Very high	73.8	Confident	44 Å²	44	72.6 Å²	72.6	17%	0.167	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.7	162.9	-75.1	102.2	0	0	0	110.4	F2 V4 H22 H314 W315 P316 L319 L332	F2-W384 HydrophobicContact CB-CE3 4.1Å; F2-W384 HydrophobicContact CB-CZ3 4Å; V4-W384 HydrophobicContact CG2-CD2 4.14Å; V4-W384 HydrophobicContact CG2-CE3 3.92Å; V4-W384 HydrophobicContact CG2-CH2 3.7Å; V4-W384 HydrophobicContact CG2-CZ2 3.92Å; V4-W384 HydrophobicContact CG2-CZ3 3.69Å; H22-W384 HydrophobicContact CB-CH2 3.9Å; H22-W384 HydrophobicContact CB-CZ3 3.82Å; H22-W384 AromaticContact CD2-CH2 3.89Å; H22-W384 AromaticContact CG-CH2 3.91Å; H314-W384 PolarHBondContact O-NE1 2.86Å; W315-W384 HydrophobicContact CD2-CZ2 4.37Å; W315-W384 AromaticContact CE3-CH2 3.92Å; W315-W384 HydrophobicContact CE3-CH2 3.92Å; W315-W384 AromaticContact CE3-CZ2 3.44Å; W315-W384 HydrophobicContact CE3-CZ2 3.44Å; W315-W384 VanDerWaalsContact CE3-CZ2 3.44Å; W315-W384 HydrophobicContact CH2-CZ2 4.29Å; W315-W384 AromaticContact CZ3-CH2 3.57Å; W315-W384 HydrophobicContact CZ3-CH2 3.57Å; W315-W384 AromaticContact CZ3-CZ2 3.42Å; W315-W384 HydrophobicContact CZ3-CZ2 3.42Å; W315-W384 VanDerWaalsContact CZ3-CZ2 3.42Å; P316-W384 HydrophobicContact CG-CB 4.14Å; P316-W384 HydrophobicContact CG-CD2 3.67Å; P316-W384 HydrophobicContact CG-CE3 4.05Å; P316-W384 HydrophobicContact CG-CG 3.69Å; L319-W384 HydrophobicContact CD1-CH2 3.97Å; L319-W384 HydrophobicContact CD1-CZ3 4.04Å; L332-W384 HydrophobicContact CB-CZ2 4.5Å; L332-W384 HydrophobicContact CD2-CH2 4.47Å; L332-W384 HydrophobicContact CD2-CZ2 3.7Å
385	T	90.1	Very high	71.3	Confident	31 Å²	31	77 Å²	77	19%	0.19	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.5	174.3	54.7	0	0	0	0	108.3	F2 S3 L5 I383	F2-T385 WeakPolarHBondContact CA-O 3.2Å; S3-T385 PolarHBondContact N-O 3.36Å; S3-T385 PolarHBondContact O-N 2.89Å; S3-T385 PolarHBondContact O-OG1 3.23Å; S3-T385 PolarHBondContact OG-OG1 2.79Å; L5-T385 HydrophobicContact CB-CG2 3.74Å; L5-T385 HydrophobicContact CD2-CG2 4.14Å; I383-T385 HydrophobicContact CD1-CG2 3.95Å; I383-T385 HydrophobicContact CG1-CG2 4.09Å
386	S	82.8	Confident	70	Confident	61 Å²	61	79.2 Å²	79.2	43%	0.427	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.3	171.8	74.6	0	0	0	0	109.3	S388	S386-S388 PolarHBondContact O-N 3.45Å; S386-S388 VanDerWaalsContact O-N 3.14Å
387	T	67	Low	68.7	Low	57 Å²	57	76.4 Å²	76.4	35%	0.35	41%	0.411	S	S	.	.			trans	-76.7	96.3	158.2	53.9	0	0	0	0	107.2	M1 H389	M1-T387 WeakPolarHBondContact CB-OG1 3.15Å; M1-T387 PolarHBondContact N-O 3.45Å; M1-T387 VanDerWaalsContact N-O 3.14Å; M1-T387 PolarHBondContact N-OG1 3.06Å; M1-T387 PolarHBondContact O-N 2.87Å; M1-T387 PolarHBondContact O-OG1 3.14Å; T387-H389 PolarHBondContact O-N 2.99Å
388	S	54.2	Low	67.1	Low	72 Å²	72	80.6 Å²	80.6	50%	0.503	43%	0.433	S	S	.	.			trans	-62.8	122	149.9	50	0	0	0	0	104.7	S386 M390	S386-S388 PolarHBondContact O-N 3.45Å; S386-S388 VanDerWaalsContact O-N 3.14Å; S388-M390 PolarHBondContact O-N 3.13Å
389	H	34.6	Very low	65.3	Low	150 Å²	150	83.7 Å²	83.7	69%	0.694	45%	0.449	S	S	*	.			trans	-58.8	92.6	166.7	-77.2	-92.9	0	0	0	106.5	T387 H391	T387-H389 PolarHBondContact O-N 2.99Å; H389-H391 PolarHBondContact O-N 2.84Å
390	M	32.4	Very low	63.2	Low	114 Å²	114	88.1 Å²	88.1	56%	0.562	47%	0.472	S	S	*	.			trans	-70.1	69.9	162.2	-77.5	-98.9	167.9	0	0	105.5	S388 H392	S388-M390 PolarHBondContact O-N 3.13Å; M390-H392 PolarHBondContact O-N 3.13Å
391	H	28.1	Very low	60.9	Low	160 Å²	160	93 Å²	93	74%	0.741	50%	0.498	S	S	*	.			trans	-69.8	80.3	152.7	-83.2	-63	0	0	0	105.5	H389 P393	H389-H391 PolarHBondContact O-N 2.84Å; H391-P393 WeakPolarHBondContact O-CD 3.41Å
392	H	29.7	Very low	58.2	Low	147 Å²	147	98.8 Å²	98.8	68%	0.681	53%	0.527	S	S	*	.			trans	-78	115.9	149.2	-84.6	-68.7	0	0	0	105.2	M390 E394	M390-H392 PolarHBondContact O-N 3.13Å; H392-E394 PolarHBondContact O-N 3.26Å
393	P	35.2	Very low	55.2	Low	103 Å²	103	106.1 Å²	106.1	67%	0.669	57%	0.565	S	S	*	*			trans	-62.9	126.1	171.2	26.4	-28.3	0	0	0	106.7	H391 V395	H391-P393 WeakPolarHBondContact O-CD 3.41Å; P393-V395 PolarHBondContact O-N 2.78Å
394	E	32.1	Very low	51.8	Low	199 Å²	199	112 Å²	112	93%	0.93	60%	0.597	S	S	*	*			trans	-51.4	120.6	161.2	-68.5	175.8	161	0	0	107	H392	H392-E394 PolarHBondContact O-N 3.26Å
395	V	41.4	Very low	48	Very low	206 Å²	206	118.2 Å²	118.2	100%	1.248	64%	0.636	S	S	*	*			trans	-102.5	0	166.3	178.5	0	0	0	0	107.3	P393	P393-V395 PolarHBondContact O-N 2.78Å

Retrieved 395 of 395 residues in 116 ms (Link to these results)

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