A0A077Z4J7_TRITR Loading...

Elongator complex protein 2

AlphaFold DB , UniProt , Accession A0A077Z4J7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 306 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	72.8	Confident	222 Å²	222	80.8 Å²	80.8	100%	1.094	46%	0.455	S	S	*	.				0	138.4	0	-68	-130.8	-89.6	0	0	107.7	T3	M1-T3 PolarHBondContact O-N 2.74Å
2	P	41	Very low	74.2	Confident	97 Å²	97	74.6 Å²	74.6	63%	0.63	42%	0.42	S	S	*	.			trans	-63.5	111.7	173.9	16.4	-11.2	0	0	0	107.6	G4	P2-G4 PolarHBondContact O-N 2.98Å
3	T	58.8	Low	75.3	Confident	141 Å²	141	72.5 Å²	72.5	87%	0.865	42%	0.418	S	S	*	.			trans	-76.8	98.1	178.3	49.5	0	0	0	0	107.5	M1	M1-T3 PolarHBondContact O-N 2.74Å
4	G	69.9	Low	76	Confident	22 Å²	22	70.2 Å²	70.2	23%	0.227	40%	0.399	C	S	.	.	S	Bend	trans	164.3	-177.6	179.1	0	0	0	0	0	113.4	P2 R31	P2-G4 PolarHBondContact O-N 2.98Å; G4-R31 VanDerWaalsContact C-CZ 3.47Å; G4-R31 VanDerWaalsContact C-NH1 3.32Å; G4-R31 PolarHBondContact O-NH1 3.02Å; G4-R31 PolarHBondContact O-NH2 3.43Å
5	H	76.9	Confident	76.3	Confident	19 Å²	19	67.8 Å²	67.8	9%	0.088	39%	0.385	C	S	.	.			trans	-64.9	147.3	171.2	-74.5	-61.9	0	0	0	111.3	V9 S23 S25 D27 T29 R31 Y298	H5-V9 HydrophobicContact CB-CG2 4.13Å; H5-V9 WeakPolarHBondContact CD2-CG2 3.47Å; H5-S23 PolarHBondContact CD2-OG 2.81Å; H5-S23 VanDerWaalsContact CD2-OG 3.24Å; H5-S23 PolarHBondContact NE2-OG 2.91Å; H5-S25 WeakPolarHBondContact CE1-CB 3.4Å; H5-S25 VanDerWaalsContact CG-CB 3.42Å; H5-S25 WeakPolarHBondContact ND1-CB 3.44Å; H5-D27 WeakPolarHBondContact CA-OD2 3.47Å; H5-D27 VanDerWaalsContact CB-OD2 3.31Å; H5-D27 WeakPolarHBondContact CB-OD2 3.23Å; H5-D27 IonicContact CE1-OD1 3.85Å; H5-D27 IonicContact CG-OD2 2.99Å; H5-D27 IonicContact ND1-OD1 3.64Å; H5-D27 PolarHBondContact ND1-OD1 2.87Å; H5-D27 IonicContact ND1-OD2 3.13Å; H5-D27 PolarHBondContact ND1-OD2 3.12Å; H5-T29 PolarHBondContact CE1-O 3.27Å; H5-T29 VanDerWaalsContact CE1-O 3.31Å; H5-T29 PolarHBondContact CE1-OG1 2.97Å; H5-T29 PolarHBondContact ND1-OG1 3.32Å; H5-T29 VanDerWaalsContact ND1-OG1 3.11Å; H5-R31 VanDerWaalsContact CE1-CD 3.47Å; H5-R31 WeakPolarHBondContact CE1-CD 3.36Å; H5-R31 PolarHBondContact ND1-NE 3.06Å; H5-Y298 HydrophobicContact CB-CE2 4.46Å; H5-Y298 WeakPolarHBondContact CB-OH 3.19Å
6	F	81.4	Confident	76.4	Confident	145 Å²	145	70.1 Å²	70.1	64%	0.636	40%	0.403	S	S	*	.	S	Bend	trans	-109.1	6.6	177.9	63.9	-96.5	0	0	0	113.3	D27	F6-D27 HydrophobicContact CD1-CB 3.87Å; F6-D27 HydrophobicContact CD2-CB 3.88Å; F6-D27 HydrophobicContact CE1-CB 3.62Å; F6-D27 HydrophobicContact CE2-CB 3.61Å; F6-D27 HydrophobicContact CG-CB 4.01Å; F6-D27 HydrophobicContact CZ-CB 3.5Å; F6-D27 VanDerWaalsContact CZ-CB 3.5Å; F6-D27 PolarHBondContact N-OD2 2.76Å
7	S	84.3	Confident	76.2	Confident	42 Å²	42	71.1 Å²	71.1	29%	0.294	40%	0.403	S	S	.	.	S	Bend	trans	-136.3	-177.3	172.8	-162.9	0	0	0	0	110.1	V9 S25 A26 Y298	S7-V9 PolarHBondContact O-N 3.02Å; S7-S25 PolarHBondContact O-OG 3.46Å; S7-A26 WeakPolarHBondContact OG-CB 2.96Å; S7-Y298 PolarHBondContact O-OH 2.73Å; S7-Y298 VanDerWaalsContact O-OH 3.06Å
8	A	86.7	Confident	76.1	Confident	34 Å²	34	67.4 Å²	67.4	28%	0.281	38%	0.383	S	S	.	.			trans	-62.5	131	179	0	0	0	0	0	111.5	S25 A26 T271	A8-S25 WeakPolarHBondContact O-CA 2.97Å; A8-S25 PolarHBondContact O-OG 3.01Å; A8-A26 PolarHBondContact O-N 3.11Å; A8-T271 HydrophobicContact CB-CG2 4.19Å
9	V	88.1	Confident	76.1	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	126.7	167.5	168.9	0	0	0	0	108.4	H5 S7 D11 L12 C24 T271 A272 Y298	H5-V9 HydrophobicContact CB-CG2 4.13Å; H5-V9 WeakPolarHBondContact CD2-CG2 3.47Å; S7-V9 PolarHBondContact O-N 3.02Å; V9-D11 VanDerWaalsContact CG1-O 3.31Å; V9-D11 WeakPolarHBondContact CG1-O 3.44Å; V9-L12 HydrophobicContact CG1-CB 4.32Å; V9-L12 HydrophobicContact CG1-CD2 4.02Å; V9-C24 CarbonylContact C-O 3.6Å; V9-C24 WeakPolarHBondContact CA-O 3.3Å; V9-C24 WeakPolarHBondContact CG1-O 3.37Å; V9-T271 WeakPolarHBondContact O-CB 3.42Å; V9-T271 PolarHBondContact O-OG1 3.08Å; V9-A272 HydrophobicContact CG1-CB 3.95Å; V9-Y298 HydrophobicContact CB-CD1 3.77Å; V9-Y298 HydrophobicContact CB-CD2 4.4Å; V9-Y298 HydrophobicContact CB-CE1 3.56Å; V9-Y298 HydrophobicContact CB-CE2 4.24Å; V9-Y298 HydrophobicContact CB-CG 4.19Å; V9-Y298 HydrophobicContact CG2-CD1 3.99Å; V9-Y298 HydrophobicContact CG2-CD2 3.87Å; V9-Y298 HydrophobicContact CG2-CE1 3.5Å; V9-Y298 HydrophobicContact CG2-CE2 3.38Å; V9-Y298 HydrophobicContact CG2-CG 4.16Å; V9-Y298 WeakPolarHBondContact CG2-OH 3.36Å
10	N	89.7	Confident	76.3	Confident	104 Å²	104	69.9 Å²	69.9	56%	0.556	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	-31.5	-176.4	-62.3	-36.9	0	0	0	112	C24 A26	N10-C24 PolarHBondContact N-O 2.88Å; N10-A26 PolarHBondContact ND2-N 3.11Å
11	D	89.1	Confident	76.5	Confident	63 Å²	63	67.2 Å²	67.2	34%	0.337	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	152.3	177.2	-153.9	-7.7	0	0	0	109.6	V9 C24 R172	V9-D11 VanDerWaalsContact CG1-O 3.31Å; V9-D11 WeakPolarHBondContact CG1-O 3.44Å; D11-C24 PolarHBondContact N-O 2.9Å; D11-C24 PolarHBondContact O-N 2.99Å; D11-R172 IonicContact OD1-CZ 3.22Å; D11-R172 IonicContact OD1-NH1 2.81Å; D11-R172 PolarHBondContact OD1-NH1 3.45Å; D11-R172 VanDerWaalsContact OD1-NH1 3.15Å; D11-R172 IonicContact OD1-NH2 3.44Å; D11-R172 PolarHBondContact OD1-NH2 2.92Å; D11-R172 IonicContact OD2-NH1 2.98Å; D11-R172 PolarHBondContact OD2-NH1 2.84Å; D11-R172 VanDerWaalsContact OD2-NH1 3.13Å
12	L	89.1	Confident	79	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.031	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	148.7	173.3	63.5	101.1	0	0	0	110	V9 L21 L22 A272 D274	V9-L12 HydrophobicContact CG1-CB 4.32Å; V9-L12 HydrophobicContact CG1-CD2 4.02Å; L12-L21 HydrophobicContact CB-CD1 4.42Å; L12-L21 HydrophobicContact CD1-CD1 3.98Å; L12-L22 CarbonylContact C-O 3.56Å; L12-L22 WeakPolarHBondContact CA-O 3.39Å; L12-L22 WeakPolarHBondContact CB-O 3.4Å; L12-A272 HydrophobicContact CD2-CB 3.48Å; L12-A272 VanDerWaalsContact CD2-CB 3.48Å; L12-A272 HydrophobicContact CG-CB 4.05Å; L12-D274 HydrophobicContact CD1-CB 3.16Å; L12-D274 HydrophobicContact CG-CB 4.29Å
13	A	88.6	Confident	81	Confident	48 Å²	48	56.1 Å²	56.1	40%	0.397	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	127.5	-178.2	0	0	0	0	0	110.1	L22 D274	A13-L22 PolarHBondContact N-O 3.32Å; A13-L22 PolarHBondContact O-N 2.8Å; A13-D274 WeakPolarHBondContact CA-OD2 3.06Å
14	W	85.5	Confident	82.5	Confident	40 Å²	40	51.5 Å²	51.5	15%	0.152	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	143.7	164.9	-78.4	102.8	0	0	0	110.9	Y20 L21 D274 I276 P277 Y297	W14-Y20 VanDerWaalsContact CE3-O 3.23Å; W14-L21 HydrophobicContact CD2-CB 4.24Å; W14-L21 HydrophobicContact CD2-CD1 3.97Å; W14-L21 HydrophobicContact CE3-CB 3.96Å; W14-L21 HydrophobicContact CG-CD1 4.12Å; W14-L21 HydrophobicContact CH2-CB 4.05Å; W14-L21 HydrophobicContact CZ2-CB 4.32Å; W14-L21 HydrophobicContact CZ2-CD1 4.44Å; W14-L21 HydrophobicContact CZ2-CD2 4.24Å; W14-L21 HydrophobicContact CZ3-CB 3.87Å; W14-D274 VanDerWaalsContact CD1-OD2 3.31Å; W14-D274 PolarHBondContact N-OD2 2.57Å; W14-I276 HydrophobicContact CD2-CB 4.28Å; W14-I276 HydrophobicContact CD2-CG1 4.05Å; W14-I276 HydrophobicContact CE3-CD1 4.45Å; W14-I276 HydrophobicContact CE3-CG1 4.11Å; W14-I276 HydrophobicContact CH2-CD1 3.95Å; W14-I276 HydrophobicContact CH2-CG1 4.3Å; W14-I276 HydrophobicContact CZ2-CB 4.18Å; W14-I276 HydrophobicContact CZ2-CD1 4.21Å; W14-I276 HydrophobicContact CZ2-CG1 4.22Å; W14-I276 HydrophobicContact CZ3-CD1 4.07Å; W14-I276 HydrophobicContact CZ3-CG1 4.24Å; W14-P277 HydrophobicContact CB-CG 4.44Å; W14-Y297 HydrophobicContact CH2-CD2 4.35Å; W14-Y297 HydrophobicContact CH2-CE2 4.15Å; W14-Y297 AromaticContact CZ2-CD2 3.57Å; W14-Y297 HydrophobicContact CZ2-CD2 3.57Å; W14-Y297 AromaticContact CZ2-CE2 3.73Å; W14-Y297 HydrophobicContact CZ2-CE2 3.73Å
15	D	80.1	Confident	83.3	Confident	34 Å²	34	51 Å²	51	18%	0.182	28%	0.275	C	S	.	.			trans	-62.8	145.6	161.5	117.3	-101.6	0	0	0	109.3	H17 G18 M19 Y20	D15-H17 PolarHBondContact O-N 3.17Å; D15-H17 WeakPolarHBondContact OD2-CB 3.46Å; D15-H17 IonicContact OD2-CG 3.26Å; D15-H17 PolarHBondContact OD2-N 3.14Å; D15-H17 IonicContact OD2-ND1 2.83Å; D15-H17 PolarHBondContact OD2-ND1 3.45Å; D15-G18 PolarHBondContact O-N 3.17Å; D15-G18 PolarHBondContact OD1-N 2.78Å; D15-M19 WeakPolarHBondContact OD1-CA 3.42Å; D15-M19 WeakPolarHBondContact OD1-CB 3.4Å; D15-M19 PolarHBondContact OD1-N 3.05Å; D15-Y20 PolarHBondContact N-O 2.79Å; D15-Y20 PolarHBondContact OD1-N 3.41Å
16	P	77.5	Confident	83.8	Confident	104 Å²	104	52.5 Å²	52.5	68%	0.675	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-24.8	-179.5	-28.6	35.9	0	0	0	115.1
17	H	74.4	Confident	84.1	Confident	88 Å²	88	46.1 Å²	46.1	41%	0.407	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-3.7	178.7	-50.5	89.6	0	0	0	114	D15 M19 V46	D15-H17 PolarHBondContact O-N 3.17Å; D15-H17 WeakPolarHBondContact OD2-CB 3.46Å; D15-H17 IonicContact OD2-CG 3.26Å; D15-H17 PolarHBondContact OD2-N 3.14Å; D15-H17 IonicContact OD2-ND1 2.83Å; D15-H17 PolarHBondContact OD2-ND1 3.45Å; H17-M19 VanDerWaalsContact C-N 3.26Å; H17-M19 HydrophobicContact CB-CG 4.06Å; H17-M19 PolarHBondContact O-N 2.96Å; H17-V46 WeakPolarHBondContact NE2-CG1 3.41Å
18	G	74.2	Confident	84.4	Confident	5 Å²	5	55.7 Å²	55.7	5%	0.052	29%	0.293	C	S	.	.	S	Bend	trans	71	13	178.8	0	0	0	0	0	115.5	D15	D15-G18 PolarHBondContact O-N 3.17Å; D15-G18 PolarHBondContact OD1-N 2.78Å
19	M	76	Confident	84.3	Confident	69 Å²	69	56.2 Å²	56.2	34%	0.34	29%	0.293	S	S	.	.	S	Bend	trans	-80	-34.7	177.9	-60	-57.2	-64.6	0	0	112.8	D15 H17 L280	D15-M19 WeakPolarHBondContact OD1-CA 3.42Å; D15-M19 WeakPolarHBondContact OD1-CB 3.4Å; D15-M19 PolarHBondContact OD1-N 3.05Å; H17-M19 VanDerWaalsContact C-N 3.26Å; H17-M19 HydrophobicContact CB-CG 4.06Å; H17-M19 PolarHBondContact O-N 2.96Å; M19-L280 HydrophobicContact SD-CD1 4.44Å
20	Y	80.4	Confident	84.2	Confident	114 Å²	114	60.3 Å²	60.3	45%	0.447	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148.6	-178.5	-55.6	-83.8	0	0	0	112.7	W14 D15 L32 F33 A34	W14-Y20 VanDerWaalsContact CE3-O 3.23Å; D15-Y20 PolarHBondContact N-O 2.79Å; D15-Y20 PolarHBondContact OD1-N 3.41Å; Y20-L32 HydrophobicContact CD1-CD1 4.44Å; Y20-L32 HydrophobicContact CD1-CD2 4.17Å; Y20-L32 HydrophobicContact CD1-CG 4.18Å; Y20-L32 HydrophobicContact CG-CD1 4.38Å; Y20-F33 CarbonylContact C-O 3.55Å; Y20-F33 WeakPolarHBondContact CA-O 3.47Å; Y20-A34 HydrophobicContact CD1-CB 3.72Å; Y20-A34 HydrophobicContact CE1-CB 3.73Å
21	L	80.4	Confident	83.8	Confident	15 Å²	15	58.8 Å²	58.8	8%	0.079	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	123.9	170.3	174.6	66	0	0	0	109	L12 W14 L32 F33 Y297	L12-L21 HydrophobicContact CB-CD1 4.42Å; L12-L21 HydrophobicContact CD1-CD1 3.98Å; W14-L21 HydrophobicContact CD2-CB 4.24Å; W14-L21 HydrophobicContact CD2-CD1 3.97Å; W14-L21 HydrophobicContact CE3-CB 3.96Å; W14-L21 HydrophobicContact CG-CD1 4.12Å; W14-L21 HydrophobicContact CH2-CB 4.05Å; W14-L21 HydrophobicContact CZ2-CB 4.32Å; W14-L21 HydrophobicContact CZ2-CD1 4.44Å; W14-L21 HydrophobicContact CZ2-CD2 4.24Å; W14-L21 HydrophobicContact CZ3-CB 3.87Å; L21-L32 CarbonylContact O-C 3.53Å; L21-L32 WeakPolarHBondContact O-CA 3.27Å; L21-F33 HydrophobicContact CB-CB 4.32Å; L21-F33 PolarHBondContact N-O 3.39Å; L21-F33 PolarHBondContact O-N 3.34Å; L21-Y297 HydrophobicContact CD2-CG 4.33Å
22	L	86.4	Confident	83.4	Confident	80 Å²	80	61.3 Å²	61.3	42%	0.419	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.3	171.2	-178.6	65.3	0	0	0	109.4	L12 A13 R31 L32	L12-L22 CarbonylContact C-O 3.56Å; L12-L22 WeakPolarHBondContact CA-O 3.39Å; L12-L22 WeakPolarHBondContact CB-O 3.4Å; A13-L22 PolarHBondContact N-O 3.32Å; A13-L22 PolarHBondContact O-N 2.8Å; L22-R31 CarbonylContact C-O 3.6Å; L22-R31 WeakPolarHBondContact CA-O 3.17Å; L22-L32 HydrophobicContact CB-CD1 4.39Å
23	S	84.3	Confident	82.7	Confident	5 Å²	5	64.8 Å²	64.8	4%	0.035	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.9	171.3	67.2	0	0	0	0	112.3	H5 S30 R31 F33	H5-S23 PolarHBondContact CD2-OG 2.81Å; H5-S23 VanDerWaalsContact CD2-OG 3.24Å; H5-S23 PolarHBondContact NE2-OG 2.91Å; S23-S30 CarbonylContact O-C 3.5Å; S23-S30 WeakPolarHBondContact O-CA 3.25Å; S23-R31 PolarHBondContact N-O 3.45Å; S23-R31 PolarHBondContact O-N 3.48Å; S23-F33 WeakPolarHBondContact OG-CE2 3.09Å
24	C	89.1	Confident	81.9	Confident	44 Å²	44	65.8 Å²	65.8	30%	0.297	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.8	179.9	-67.7	0	0	0	0	110.1	V9 N10 D11 S30	V9-C24 CarbonylContact C-O 3.6Å; V9-C24 WeakPolarHBondContact CA-O 3.3Å; V9-C24 WeakPolarHBondContact CG1-O 3.37Å; N10-C24 PolarHBondContact N-O 2.88Å; D11-C24 PolarHBondContact N-O 2.9Å; D11-C24 PolarHBondContact O-N 2.99Å; C24-S30 PolarHBondContact SG-OG 3.22Å
25	S	86.7	Confident	80.9	Confident	11 Å²	11	70.3 Å²	70.3	8%	0.077	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.4	-171.9	172.4	0	0	0	0	113.8	H5 S7 A8 D27 R28 T29	H5-S25 WeakPolarHBondContact CE1-CB 3.4Å; H5-S25 VanDerWaalsContact CG-CB 3.42Å; H5-S25 WeakPolarHBondContact ND1-CB 3.44Å; S7-S25 PolarHBondContact O-OG 3.46Å; A8-S25 WeakPolarHBondContact O-CA 2.97Å; A8-S25 PolarHBondContact O-OG 3.01Å; S25-D27 VanDerWaalsContact CB-OD1 3.22Å; S25-D27 WeakPolarHBondContact CB-OD1 3.21Å; S25-D27 PolarHBondContact O-N 2.96Å; S25-D27 VanDerWaalsContact O-N 3.09Å; S25-D27 PolarHBondContact OG-N 3.11Å; S25-D27 VanDerWaalsContact OG-N 3.14Å; S25-D27 PolarHBondContact OG-OD1 3.45Å; S25-D27 PolarHBondContact OG-OD2 3.19Å; S25-R28 PolarHBondContact O-N 3.39Å; S25-R28 VanDerWaalsContact O-N 3.1Å; S25-T29 PolarHBondContact N-O 3.23Å
26	A	88.2	Confident	79.6	Confident	51 Å²	51	79.3 Å²	79.3	42%	0.421	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-6.2	170.6	0	0	0	0	0	113.3	S7 A8 N10 R28	S7-A26 WeakPolarHBondContact OG-CB 2.96Å; A8-A26 PolarHBondContact O-N 3.11Å; N10-A26 PolarHBondContact ND2-N 3.11Å; A26-R28 PolarHBondContact O-N 3.16Å
27	D	87.5	Confident	78.1	Confident	11 Å²	11	81.6 Å²	81.6	6%	0.059	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	6.6	169.2	69.6	13.7	0	0	0	113.9	H5 F6 S25 T29	H5-D27 WeakPolarHBondContact CA-OD2 3.47Å; H5-D27 VanDerWaalsContact CB-OD2 3.31Å; H5-D27 WeakPolarHBondContact CB-OD2 3.23Å; H5-D27 IonicContact CE1-OD1 3.85Å; H5-D27 IonicContact CG-OD2 2.99Å; H5-D27 IonicContact ND1-OD1 3.64Å; H5-D27 PolarHBondContact ND1-OD1 2.87Å; H5-D27 IonicContact ND1-OD2 3.13Å; H5-D27 PolarHBondContact ND1-OD2 3.12Å; F6-D27 HydrophobicContact CD1-CB 3.87Å; F6-D27 HydrophobicContact CD2-CB 3.88Å; F6-D27 HydrophobicContact CE1-CB 3.62Å; F6-D27 HydrophobicContact CE2-CB 3.61Å; F6-D27 HydrophobicContact CG-CB 4.01Å; F6-D27 HydrophobicContact CZ-CB 3.5Å; F6-D27 VanDerWaalsContact CZ-CB 3.5Å; F6-D27 PolarHBondContact N-OD2 2.76Å; S25-D27 VanDerWaalsContact CB-OD1 3.22Å; S25-D27 WeakPolarHBondContact CB-OD1 3.21Å; S25-D27 PolarHBondContact O-N 2.96Å; S25-D27 VanDerWaalsContact O-N 3.09Å; S25-D27 PolarHBondContact OG-N 3.11Å; S25-D27 VanDerWaalsContact OG-N 3.14Å; S25-D27 PolarHBondContact OG-OD1 3.45Å; S25-D27 PolarHBondContact OG-OD2 3.19Å; D27-T29 VanDerWaalsContact C-N 3.26Å; D27-T29 VanDerWaalsContact CG-OG1 3.31Å; D27-T29 PolarHBondContact O-N 3.16Å; D27-T29 WeakPolarHBondContact OD1-CB 3.19Å; D27-T29 PolarHBondContact OD1-N 2.98Å; D27-T29 PolarHBondContact OD1-OG1 3.2Å; D27-T29 PolarHBondContact OD2-OG1 3.2Å
28	R	89.9	Confident	76.6	Confident	243 Å²	243	82.8 Å²	82.8	92%	0.917	41%	0.411	S	S	*	.	S	Bend	trans	68.1	22.6	180	-46.5	177.1	-174.8	178.3	0.3	113.5	S25 A26	S25-R28 PolarHBondContact O-N 3.39Å; S25-R28 VanDerWaalsContact O-N 3.1Å; A26-R28 PolarHBondContact O-N 3.16Å
29	T	84.8	Confident	74.7	Confident	46 Å²	46	88.8 Å²	88.8	28%	0.282	45%	0.452	S	S	.	.			trans	-119.9	145.8	174.4	70.5	0	0	0	0	111.2	H5 S25 D27 R31	H5-T29 PolarHBondContact CE1-O 3.27Å; H5-T29 VanDerWaalsContact CE1-O 3.31Å; H5-T29 PolarHBondContact CE1-OG1 2.97Å; H5-T29 PolarHBondContact ND1-OG1 3.32Å; H5-T29 VanDerWaalsContact ND1-OG1 3.11Å; S25-T29 PolarHBondContact N-O 3.23Å; D27-T29 VanDerWaalsContact C-N 3.26Å; D27-T29 VanDerWaalsContact CG-OG1 3.31Å; D27-T29 PolarHBondContact O-N 3.16Å; D27-T29 WeakPolarHBondContact OD1-CB 3.19Å; D27-T29 PolarHBondContact OD1-N 2.98Å; D27-T29 PolarHBondContact OD1-OG1 3.2Å; D27-T29 PolarHBondContact OD2-OG1 3.2Å; T29-R31 PolarHBondContact OG1-NE 3.24Å
30	S	85.8	Confident	72.9	Confident	85 Å²	85	89.1 Å²	89.1	59%	0.594	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.2	159.1	-60.6	0	0	0	0	108.2	S23 C24	S23-S30 CarbonylContact O-C 3.5Å; S23-S30 WeakPolarHBondContact O-CA 3.25Å; C24-S30 PolarHBondContact SG-OG 3.22Å
31	R	81.6	Confident	70.7	Confident	73 Å²	73	88.4 Å²	88.4	28%	0.275	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.2	-175.1	-66.1	-179.9	-175.6	-138.2	9.3	110.3	G4 H5 L22 S23 T29 F33	G4-R31 VanDerWaalsContact C-CZ 3.47Å; G4-R31 VanDerWaalsContact C-NH1 3.32Å; G4-R31 PolarHBondContact O-NH1 3.02Å; G4-R31 PolarHBondContact O-NH2 3.43Å; H5-R31 VanDerWaalsContact CE1-CD 3.47Å; H5-R31 WeakPolarHBondContact CE1-CD 3.36Å; H5-R31 PolarHBondContact ND1-NE 3.06Å; L22-R31 CarbonylContact C-O 3.6Å; L22-R31 WeakPolarHBondContact CA-O 3.17Å; S23-R31 PolarHBondContact N-O 3.45Å; S23-R31 PolarHBondContact O-N 3.48Å; T29-R31 PolarHBondContact OG1-NE 3.24Å; R31-F33 HydrophobicContact CB-CD2 4.37Å; R31-F33 HydrophobicContact CB-CE2 3.55Å; R31-F33 HydrophobicContact CB-CZ 3.69Å; R31-F33 HydrophobicContact CG-CZ 4.44Å
32	L	81.6	Confident	68.5	Low	115 Å²	115	97.8 Å²	97.8	60%	0.602	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.1	171.6	-171	69.7	0	0	0	108.5	Y20 L21 L22	Y20-L32 HydrophobicContact CD1-CD1 4.44Å; Y20-L32 HydrophobicContact CD1-CD2 4.17Å; Y20-L32 HydrophobicContact CD1-CG 4.18Å; Y20-L32 HydrophobicContact CG-CD1 4.38Å; L21-L32 CarbonylContact O-C 3.53Å; L21-L32 WeakPolarHBondContact O-CA 3.27Å; L22-L32 HydrophobicContact CB-CD1 4.39Å
33	F	74.4	Confident	66.2	Low	80 Å²	80	98 Å²	98	35%	0.351	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.5	176	-56.8	-89.4	0	0	0	109.3	Y20 L21 S23 R31	Y20-F33 CarbonylContact C-O 3.55Å; Y20-F33 WeakPolarHBondContact CA-O 3.47Å; L21-F33 HydrophobicContact CB-CB 4.32Å; L21-F33 PolarHBondContact N-O 3.39Å; L21-F33 PolarHBondContact O-N 3.34Å; S23-F33 WeakPolarHBondContact OG-CE2 3.09Å; R31-F33 HydrophobicContact CB-CD2 4.37Å; R31-F33 HydrophobicContact CB-CE2 3.55Å; R31-F33 HydrophobicContact CB-CZ 3.69Å; R31-F33 HydrophobicContact CG-CZ 4.44Å
34	A	71.9	Confident	63.9	Low	68 Å²	68	108.5 Å²	108.5	56%	0.562	57%	0.569	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.2	158.9	172.9	0	0	0	0	0	109	Y20 W36	Y20-A34 HydrophobicContact CD1-CB 3.72Å; Y20-A34 HydrophobicContact CE1-CB 3.73Å; A34-W36 PolarHBondContact O-N 3.37Å
35	E	63.2	Low	61.2	Low	135 Å²	135	114 Å²	114	63%	0.631	60%	0.595	S	S	*	*			trans	-57.6	135.5	174.6	-168.2	-174	176.2	0	0	111.4	K37	E35-K37 PolarHBondContact O-N 3.06Å; E35-K37 VanDerWaalsContact O-N 3.11Å
36	W	52.5	Low	58.7	Low	224 Å²	224	118.1 Å²	118.1	85%	0.848	62%	0.619	S	S	*	*			trans	-69.2	108.6	166.8	-173.8	-26.9	0	0	0	108.3	A34 V38	A34-W36 PolarHBondContact O-N 3.37Å; W36-V38 PolarHBondContact O-N 3.41Å
37	K	47.9	Very low	55.8	Low	151 Å²	151	120 Å²	120	66%	0.657	63%	0.63	S	S	*	*			trans	-60.6	105.1	170.4	-65.7	-177.6	-179.6	176.5	0	111.3	E35	E35-K37 PolarHBondContact O-N 3.06Å; E35-K37 VanDerWaalsContact O-N 3.11Å
38	V	42.8	Very low	53	Low	114 Å²	114	127.2 Å²	127.2	69%	0.691	66%	0.66	S	S	*	*			trans	-71.5	132.8	160.7	-176.7	0	0	0	0	107.2	W36 G40	W36-V38 PolarHBondContact O-N 3.41Å; V38-G40 PolarHBondContact O-N 3.32Å
39	S	32.8	Very low	50.2	Low	130 Å²	130	123.7 Å²	123.7	91%	0.909	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	111	-178.4	-172.6	0	0	0	0	110.4
40	G	38.6	Very low	47.6	Very low	76 Å²	76	130.9 Å²	130.9	78%	0.784	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	142.8	-17.3	177.7	0	0	0	0	0	117.5	V38	V38-G40 PolarHBondContact O-N 3.32Å
41	S	34.2	Very low	44.9	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-93.7	130	-174.4	-70.8	0	0	0	0	114.4
42	K	34.2	Very low	42.5	Very low	211 Å²	211	139.3 Å²	139.3	92%	0.917	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-80.6	124.8	176.5	-75.6	179.7	175.5	178.3	0	111
43	V	38.4	Very low	40.6	Very low	85 Å²	85	140.9 Å²	140.9	52%	0.515	73%	0.731	S	S	.	*	P	Polyproline II helix	trans	-80	138.6	178.8	179.8	0	0	0	0	110.4
44	R	35.5	Very low	39.3	Very low	226 Å²	226	138.5 Å²	138.5	85%	0.853	73%	0.726	S	S	*	*			trans	-106.2	136.1	171.9	-73.1	-177.3	172.9	154.5	-1.9	110.3
45	N	31.7	Very low	38.8	Very low	159 Å²	159	142.4 Å²	142.4	85%	0.85	73%	0.731	S	S	*	*			trans	-81.3	135.2	178	-68.9	-29.9	0	0	0	110.1
46	V	34.7	Very low	38.7	Very low	97 Å²	97	136.2 Å²	136.2	59%	0.588	70%	0.702	S	S	*	*			trans	-133.3	128.1	170.5	-163.4	0	0	0	0	109.6	H17	H17-V46 WeakPolarHBondContact NE2-CG1 3.41Å
47	S	27.9	Very low	39.3	Very low	92 Å²	92	125.6 Å²	125.6	64%	0.643	66%	0.662	S	S	*	*			trans	-141.6	154.1	-177.9	53.8	0	0	0	0	110.5
48	K	29.4	Very low	40.2	Very low	161 Å²	161	121 Å²	121	70%	0.7	65%	0.647	S	S	*	*			trans	94.8	118.6	174.7	-60.1	178.8	176.7	177.8	0	115.9
49	M	29.4	Very low	41.2	Very low	170 Å²	170	119.8 Å²	119.8	84%	0.837	64%	0.639	S	S	*	*				179.4	111.5	118.1	-96.4	-174.6	-170.8	0	0	109.5
50	F	31.5	Very low	42.7	Very low	197 Å²	197	115.2 Å²	115.2	86%	0.864	61%	0.61	S	S	*	*			trans	-153.2	126.9	146.4	-71.4	-66.2	0	0	0	108.1
51	H	29.6	Very low	43.6	Very low	174 Å²	174	118.9 Å²	118.9	81%	0.806	62%	0.617	S	S	*	*			trans	-111.6	144.7	172.3	-87.4	27.5	0	0	0	109.4
52	N	31.1	Very low	45.1	Very low	161 Å²	161	122.7 Å²	122.7	86%	0.861	63%	0.629	S	S	*	*	S	Bend	trans	29.1	90.2	162.2	-70.2	-4.3	0	0	0	117
53	N	40.2	Very low	46	Very low	148 Å²	148	113.9 Å²	113.9	79%	0.791	60%	0.598	S	S	*	*			trans	-151.7	166.6	166	-88.3	-36.2	0	0	0	110.3	K55	N53-K55 PolarHBondContact O-N 3.47Å
54	A	47	Very low	47.4	Very low	30 Å²	30	118.7 Å²	118.7	25%	0.248	62%	0.62	C	S	.	*			trans	-42	134.9	175	0	0	0	0	0	112.2	S56 P68 Y70 P111	A54-S56 PolarHBondContact O-N 2.84Å; A54-P68 HydrophobicContact CB-CB 3.97Å; A54-Y70 HydrophobicContact CB-CD1 4.48Å; A54-Y70 HydrophobicContact CB-CE1 4.14Å; A54-P111 HydrophobicContact CB-CG 3.95Å
55	K	62.1	Low	48.8	Very low	149 Å²	149	110.2 Å²	110.2	65%	0.648	59%	0.593	S	S	*	*	S	Bend	trans	-72.6	-16.7	-172.9	-161.3	-172	177.5	169.1	0	113.3	N53 V69 K107	N53-K55 PolarHBondContact O-N 3.47Å; K55-V69 PolarHBondContact N-O 3.45Å; K55-K107 WeakPolarHBondContact O-CD 3.35Å; K55-K107 PolarHBondContact O-NZ 3.11Å
56	S	60.8	Low	50.7	Low	6 Å²	6	104.7 Å²	104.7	4%	0.042	56%	0.564	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-167.1	165.2	-170	-111.7	0	0	0	0	110.4	A54 V69 Q106 K107	A54-S56 PolarHBondContact O-N 2.84Å; S56-V69 PolarHBondContact O-N 3.23Å; S56-V69 VanDerWaalsContact O-N 3.08Å; S56-Q106 WeakPolarHBondContact CA-O 3.08Å; S56-Q106 WeakPolarHBondContact CB-O 3.24Å; S56-Q106 PolarHBondContact OG-O 3.48Å; S56-K107 WeakPolarHBondContact OG-CD 3.25Å; S56-K107 WeakPolarHBondContact OG-CE 3.49Å; S56-K107 PolarHBondContact OG-NZ 2.84Å
57	A	65	Low	52.4	Low	0 Å²	0	107.8 Å²	107.8	0%	0	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.8	159.7	159.1	0	0	0	0	0	112.2	N66 R67 Q106 L109 P111	A57-N66 HydrophobicContact CB-CB 4.16Å; A57-R67 CarbonylContact C-O 3.59Å; A57-R67 WeakPolarHBondContact CA-O 3.45Å; A57-R67 WeakPolarHBondContact CB-O 3.16Å; A57-Q106 PolarHBondContact N-O 2.88Å; A57-Q106 CarbonylContact O-C 3.51Å; A57-Q106 WeakPolarHBondContact O-CA 3.08Å; A57-L109 HydrophobicContact CB-CB 3.69Å; A57-L109 WeakPolarHBondContact CB-O 3.33Å; A57-L109 PolarHBondContact N-O 3.16Å; A57-P111 HydrophobicContact CB-CB 3.91Å; A57-P111 HydrophobicContact CB-CG 4.5Å
58	T	67.7	Low	54.2	Low	56 Å²	56	105.2 Å²	105.2	34%	0.344	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.5	-178.7	53.9	0	0	0	0	110.6	N66 R67 V69	T58-N66 WeakPolarHBondContact O-CA 3.34Å; T58-R67 PolarHBondContact N-O 2.89Å; T58-R67 PolarHBondContact O-N 3.38Å; T58-V69 HydrophobicContact CG2-CG2 3.91Å
59	V	64.2	Low	55.9	Low	87 Å²	87	100.7 Å²	100.7	53%	0.527	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	129.3	171	-168	0	0	0	0	108.6	L109	V59-L109 HydrophobicContact CG2-CD1 3.37Å; V59-L109 HydrophobicContact CG2-CD2 4.35Å
60	A	62.4	Low	57.6	Low	35 Å²	35	100 Å²	100	29%	0.289	52%	0.521	S	S	.	.			trans	-74.5	146	171.1	0	0	0	0	0	110.9	L62 G63	A60-L62 PolarHBondContact O-N 3.04Å; A60-G63 PolarHBondContact O-N 2.79Å
61	T	58.7	Low	58.9	Low	152 Å²	152	98.8 Å²	98.8	93%	0.933	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-20.2	-174.5	-32	0	0	0	0	115
62	L	65.5	Low	59.7	Low	180 Å²	180	97.1 Å²	97.1	94%	0.942	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	10.8	175.5	-76.5	158.5	0	0	0	112.4	A60	A60-L62 PolarHBondContact O-N 3.04Å
63	G	52.1	Low	59.9	Low	27 Å²	27	94.6 Å²	94.6	28%	0.278	52%	0.516	S	S	.	.			trans	-93.9	140	-171	0	0	0	0	0	113.6	A60	A60-G63 PolarHBondContact O-N 2.79Å
64	L	68.8	Low	59.8	Low	186 Å²	186	93.2 Å²	93.2	97%	0.974	51%	0.513	S	S	*	.	S	Bend	trans	-86.4	12.9	167.6	-66.1	170.7	0	0	0	112.7
65	T	64.9	Low	58.9	Low	47 Å²	47	97 Å²	97	29%	0.288	54%	0.538	S	S	.	.	S	Bend	trans	-138.2	136	-166.5	175.3	0	0	0	0	111.1	E112	T65-E112 WeakPolarHBondContact CA-OE2 3.43Å; T65-E112 WeakPolarHBondContact CB-OE2 3.43Å; T65-E112 PolarHBondContact OG1-OE2 3.16Å
66	N	72.6	Confident	57.2	Low	43 Å²	43	93.2 Å²	93.2	23%	0.23	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	129	177.5	-68.9	-16.2	0	0	0	110.2	A57 T58 W110 E112	A57-N66 HydrophobicContact CB-CB 4.16Å; T58-N66 WeakPolarHBondContact O-CA 3.34Å; N66-W110 WeakPolarHBondContact CB-O 3.34Å; N66-W110 PolarHBondContact ND2-O 3.31Å; N66-E112 WeakPolarHBondContact O-CB 3.27Å; N66-E112 PolarHBondContact O-N 2.87Å
67	R	70	Confident	55.6	Low	162 Å²	162	100.8 Å²	100.8	61%	0.611	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.4	131.9	177.8	-69.8	-175.1	176.1	174.9	-1.3	112.3	A57 T58	A57-R67 CarbonylContact C-O 3.59Å; A57-R67 WeakPolarHBondContact CA-O 3.45Å; A57-R67 WeakPolarHBondContact CB-O 3.16Å; T58-R67 PolarHBondContact N-O 2.89Å; T58-R67 PolarHBondContact O-N 3.38Å
68	P	64.9	Low	53.9	Low	39 Å²	39	106.1 Å²	106.1	25%	0.253	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.6	143.5	171.8	21.2	-25.4	0	0	0	112.3	A54 Y70 P111	A54-P68 HydrophobicContact CB-CB 3.97Å; P68-Y70 HydrophobicContact CB-CD2 4.46Å; P68-Y70 HydrophobicContact CB-CE1 4.36Å; P68-Y70 HydrophobicContact CB-CE2 3.74Å; P68-Y70 HydrophobicContact CG-CE2 3.74Å; P68-P111 HydrophobicContact CB-CB 3.33Å; P68-P111 HydrophobicContact CB-CG 3.86Å; P68-P111 HydrophobicContact CG-CB 3.78Å
69	V	66.1	Low	51.8	Low	65 Å²	65	110.3 Å²	110.3	39%	0.394	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.4	119.9	167.4	-177.9	0	0	0	0	108.6	K55 S56 T58	K55-V69 PolarHBondContact N-O 3.45Å; S56-V69 PolarHBondContact O-N 3.23Å; S56-V69 VanDerWaalsContact O-N 3.08Å; T58-V69 HydrophobicContact CG2-CG2 3.91Å
70	Y	64.6	Low	50.4	Low	155 Å²	155	112 Å²	112	61%	0.608	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-100.7	160.1	176.4	-58.7	-75.3	0	0	0	110.7	A54 P68	A54-Y70 HydrophobicContact CB-CD1 4.48Å; A54-Y70 HydrophobicContact CB-CE1 4.14Å; P68-Y70 HydrophobicContact CB-CD2 4.46Å; P68-Y70 HydrophobicContact CB-CE1 4.36Å; P68-Y70 HydrophobicContact CB-CE2 3.74Å; P68-Y70 HydrophobicContact CG-CE2 3.74Å
71	E	57.8	Low	48.8	Very low	172 Å²	172	114.9 Å²	114.9	80%	0.804	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-77.6	125.9	176.8	-159.5	160.2	-137.1	0	0	109.4	A73	E71-A73 PolarHBondContact O-N 3.07Å
72	D	48.1	Very low	47.4	Very low	140 Å²	140	114.9 Å²	114.9	75%	0.749	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-64.2	122.2	171.5	-72.4	-36.6	0	0	0	107.9	V74	D72-V74 HydrophobicContact CB-CG2 3.76Å; D72-V74 PolarHBondContact O-N 3.41Å
73	A	34.7	Very low	45.9	Very low	107 Å²	107	110.7 Å²	110.7	88%	0.884	67%	0.671	S	S	*	*			trans	-69.1	70.2	170.5	0	0	0	0	0	109.5	E71 S75	E71-A73 PolarHBondContact O-N 3.07Å; A73-S75 PolarHBondContact O-N 3.5Å
74	V	37.9	Very low	44.7	Very low	120 Å²	120	117 Å²	117	73%	0.727	70%	0.698	S	S	*	*			trans	-80.4	107.4	174.3	-173.3	0	0	0	0	108	D72	D72-V74 HydrophobicContact CB-CG2 3.76Å; D72-V74 PolarHBondContact O-N 3.41Å
75	S	28.1	Very low	43.4	Very low	110 Å²	110	112.7 Å²	112.7	77%	0.769	69%	0.689	S	S	*	*			trans	-32.7	135.7	159.5	57.2	0	0	0	0	114.4	A73	A73-S75 PolarHBondContact O-N 3.5Å
76	G	26.6	Very low	41.8	Very low	68 Å²	68	117.8 Å²	117.8	70%	0.701	72%	0.715	S	S	*	*			trans	139.2	85.5	152.4	0	0	0	0	0	115.9
77	N	26.7	Very low	39.7	Very low	165 Å²	165	122.3 Å²	122.3	88%	0.882	74%	0.739	S	S	*	*			trans	38.6	97.5	142	-61	-8.1	0	0	0	118.2
78	S	29.1	Very low	38	Very low	113 Å²	113	121.5 Å²	121.5	79%	0.79	75%	0.745	S	S	*	*			trans	-148.7	109.7	141.9	-66.2	0	0	0	0	107.9	P80	S78-P80 WeakPolarHBondContact O-CD 3.48Å
79	T	24	Very low	36.2	Very low	144 Å²	144	124 Å²	124	88%	0.883	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-59.8	120.1	176.2	35.1	0	0	0	0	110.4	A81	T79-A81 PolarHBondContact O-N 3.35Å
80	P	34.5	Very low	34.7	Very low	123 Å²	123	125.8 Å²	125.8	80%	0.799	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-82.4	117.7	172.7	-0.3	17.4	0	0	0	109.3	S78	S78-P80 WeakPolarHBondContact O-CD 3.48Å
81	A	29.6	Very low	33.3	Very low	95 Å²	95	126.5 Å²	126.5	79%	0.785	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-59.6	138	169.3	0	0	0	0	0	110.7	T79 A83	T79-A81 PolarHBondContact O-N 3.35Å; A81-A83 PolarHBondContact O-N 3.09Å
82	V	29.3	Very low	32.6	Very low	151 Å²	151	126.2 Å²	126.2	92%	0.915	77%	0.769	S	S	*	*			trans	-60.9	113.7	174.3	179.5	0	0	0	0	109.2
83	A	32.7	Very low	32.3	Very low	92 Å²	92	124.5 Å²	124.5	76%	0.76	77%	0.765	S	S	*	*			trans	-129.2	136.3	168.4	0	0	0	0	0	109.5	A81	A81-A83 PolarHBondContact O-N 3.09Å
84	N	28.6	Very low	32.9	Very low	159 Å²	159	125.7 Å²	125.7	85%	0.85	76%	0.761	S	S	*	*			trans	-52.7	146.2	-163.7	-72.2	-50.7	0	0	0	115.7	D86	N84-D86 PolarHBondContact O-N 2.81Å
85	A	40.1	Very low	33.6	Very low	96 Å²	96	125.2 Å²	125.2	79%	0.793	75%	0.751	S	S	*	*	S	Bend	trans	-87.3	17.5	-168.3	0	0	0	0	0	115.8
86	D	31.5	Very low	34.9	Very low	155 Å²	155	126.4 Å²	126.4	83%	0.829	75%	0.754	S	S	*	*	S	Bend	trans	-116.5	119.9	178.7	-71	-35.7	0	0	0	109.8	N84	N84-D86 PolarHBondContact O-N 2.81Å
87	D	28.8	Very low	36.6	Very low	138 Å²	138	130.4 Å²	130.4	74%	0.738	75%	0.754	S	S	*	*			trans	89.9	64.5	176.7	-146.9	28	0	0	0	117.2	T89	D87-T89 VanDerWaalsContact C-N 3.27Å; D87-T89 PolarHBondContact O-N 2.8Å
88	I	34.7	Very low	38.2	Very low	144 Å²	144	128.5 Å²	128.5	74%	0.738	75%	0.751	S	S	*	*			trans	-82.5	80.8	157.1	-52.7	174.2	0	0	0	107.7	L90	I88-L90 HydrophobicContact CG2-CD2 4.41Å; I88-L90 HydrophobicContact CG2-CG 4.18Å; I88-L90 PolarHBondContact O-N 3.34Å; I88-L90 VanDerWaalsContact O-N 3.14Å
89	T	28	Very low	40	Very low	91 Å²	91	126 Å²	126	56%	0.558	73%	0.729	S	S	*	*			trans	-64.4	104.7	154.3	40.8	0	0	0	0	107.3	D87 E91	D87-T89 VanDerWaalsContact C-N 3.27Å; D87-T89 PolarHBondContact O-N 2.8Å; T89-E91 PolarHBondContact O-N 2.63Å
90	L	34	Very low	42.4	Very low	104 Å²	104	125.1 Å²	125.1	55%	0.545	71%	0.714	S	S	.	*			trans	-68	87.9	167.1	-78.6	162.4	0	0	0	107.6	I88 Y92	I88-L90 HydrophobicContact CG2-CD2 4.41Å; I88-L90 HydrophobicContact CG2-CG 4.18Å; I88-L90 PolarHBondContact O-N 3.34Å; I88-L90 VanDerWaalsContact O-N 3.14Å; L90-Y92 VanDerWaalsContact C-N 3.28Å; L90-Y92 HydrophobicContact CB-CE2 4.34Å; L90-Y92 PolarHBondContact O-N 3.2Å
91	E	33.8	Very low	44.3	Very low	170 Å²	170	125 Å²	125	79%	0.794	71%	0.707	S	S	*	*			trans	-64.7	94.3	161.5	-69.5	-175.8	171	0	0	106.9	T89 P93	T89-E91 PolarHBondContact O-N 2.63Å; E91-P93 WeakPolarHBondContact O-CD 3.42Å
92	Y	44.5	Very low	46.4	Very low	165 Å²	165	125.2 Å²	125.2	65%	0.647	70%	0.695	S	S	*	*			trans	-62.1	121.1	156.1	-65.4	-84.9	0	0	0	105.3	L90 V94	L90-Y92 VanDerWaalsContact C-N 3.28Å; L90-Y92 HydrophobicContact CB-CE2 4.34Å; L90-Y92 PolarHBondContact O-N 3.2Å; Y92-V94 PolarHBondContact O-N 2.92Å
93	P	41.3	Very low	48.5	Very low	105 Å²	105	123.3 Å²	123.3	68%	0.682	67%	0.672	S	S	*	*			trans	-54.7	115.6	165.3	-9.8	21.4	0	0	0	104.9	E91 E95	E91-P93 WeakPolarHBondContact O-CD 3.42Å; P93-E95 HydrophobicContact CB-CG 4.49Å; P93-E95 PolarHBondContact O-N 2.76Å
94	V	47.7	Very low	50.3	Low	131 Å²	131	121.9 Å²	121.9	79%	0.794	65%	0.651	S	S	*	*			trans	-67.2	87.1	167.2	179.8	0	0	0	0	103.6	Y92 T96	Y92-V94 PolarHBondContact O-N 2.92Å; V94-T96 PolarHBondContact O-N 2.71Å
95	E	51.3	Low	52.4	Low	110 Å²	110	116.6 Å²	116.6	51%	0.514	63%	0.63	S	S	.	*			trans	-57	110.1	177.3	-75.2	174.1	154.7	0	0	106.3	P93 E97 L99	P93-E95 HydrophobicContact CB-CG 4.49Å; P93-E95 PolarHBondContact O-N 2.76Å; E95-E97 PolarHBondContact O-N 3.42Å; E95-L99 WeakPolarHBondContact OE2-CD1 3.47Å; E95-L99 WeakPolarHBondContact OE2-CD2 3.31Å; E95-L99 WeakPolarHBondContact OE2-CG 3.32Å
96	T	57.1	Low	53.9	Low	135 Å²	135	117 Å²	117	83%	0.828	62%	0.615	S	S	*	*	S	Bend	trans	-69.5	-12.1	-173.4	47.5	0	0	0	0	112.3	V94	V94-T96 PolarHBondContact O-N 2.71Å
97	E	61.9	Low	55.8	Low	152 Å²	152	113 Å²	113	71%	0.71	59%	0.59	S	S	*	*	S	Bend	trans	-119	136.8	177.2	-63.4	-174.6	179	0	0	109.3	E95 L99	E95-E97 PolarHBondContact O-N 3.42Å; E97-L99 PolarHBondContact O-N 2.91Å
98	P	60.5	Low	57.9	Low	126 Å²	126	110.7 Å²	110.7	82%	0.818	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-57.4	128	176.2	24.2	-32	0	0	0	109.3	H100	P98-H100 PolarHBondContact O-N 3.07Å
99	L	65.8	Low	59.9	Low	61 Å²	61	106 Å²	106	32%	0.319	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-48.6	130.7	177.1	-77.1	169.3	0	0	0	111	E95 E97 Y103 L104	E95-L99 WeakPolarHBondContact OE2-CD1 3.47Å; E95-L99 WeakPolarHBondContact OE2-CD2 3.31Å; E95-L99 WeakPolarHBondContact OE2-CG 3.32Å; E97-L99 PolarHBondContact O-N 2.91Å; L99-Y103 HydrophobicContact CB-CD1 4.26Å; L99-Y103 HydrophobicContact CD1-CD1 4Å; L99-Y103 HydrophobicContact CD1-CE1 3.9Å; L99-Y103 HydrophobicContact CD2-CD1 3.59Å; L99-Y103 HydrophobicContact CD2-CE1 3.69Å; L99-Y103 HydrophobicContact CD2-CG 4.21Å; L99-Y103 HydrophobicContact CG-CD1 4.17Å; L99-Y103 HydrophobicContact CG-CE1 4.36Å; L99-L104 HydrophobicContact CB-CD1 4.32Å; L99-L104 HydrophobicContact CB-CD2 3.81Å; L99-L104 HydrophobicContact CB-CG 3.83Å; L99-L104 HydrophobicContact CD1-CD2 3.94Å; L99-L104 WeakPolarHBondContact O-CD1 3.49Å
100	H	74.6	Confident	62.1	Low	125 Å²	125	110.4 Å²	110.4	58%	0.579	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-59.8	145	-179.6	-179.1	59.5	0	0	0	111.4	P98 D102 Y103 L104	P98-H100 PolarHBondContact O-N 3.07Å; H100-D102 VanDerWaalsContact C-N 3.26Å; H100-D102 IonicContact CD2-OD2 3.16Å; H100-D102 PolarHBondContact CD2-OD2 2.84Å; H100-D102 IonicContact CE1-OD2 3.29Å; H100-D102 IonicContact NE2-OD2 3.87Å; H100-D102 PolarHBondContact NE2-OD2 3.38Å; H100-D102 PolarHBondContact O-N 2.79Å; H100-D102 VanDerWaalsContact O-N 3.16Å; H100-Y103 WeakPolarHBondContact O-CA 3.2Å; H100-Y103 WeakPolarHBondContact O-CB 3.1Å; H100-Y103 PolarHBondContact O-N 2.85Å; H100-L104 PolarHBondContact O-N 2.89Å; H100-L104 VanDerWaalsContact O-N 3.08Å
101	N	74.7	Confident	64.1	Low	120 Å²	120	106.7 Å²	106.7	64%	0.642	55%	0.546	S	S	*	.	H	α-helix	trans	-58.9	-34.7	-169.7	-160.1	29	0	0	0	113.1	Y103 L104 A105	N101-Y103 VanDerWaalsContact C-N 3.34Å; N101-L104 PolarHBondContact O-N 2.8Å; N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.38Å; N101-A105 PolarHBondContact O-N 2.8Å
102	D	74.6	Confident	66.3	Low	100 Å²	100	101.9 Å²	101.9	54%	0.535	52%	0.524	S	S	.	.	H	α-helix	trans	-68.9	-34.1	177.2	-59.2	-35.7	0	0	0	112.2	H100 Q106	H100-D102 VanDerWaalsContact C-N 3.26Å; H100-D102 IonicContact CD2-OD2 3.16Å; H100-D102 PolarHBondContact CD2-OD2 2.84Å; H100-D102 IonicContact CE1-OD2 3.29Å; H100-D102 IonicContact NE2-OD2 3.87Å; H100-D102 PolarHBondContact NE2-OD2 3.38Å; H100-D102 PolarHBondContact O-N 2.79Å; H100-D102 VanDerWaalsContact O-N 3.16Å; D102-Q106 WeakPolarHBondContact O-CG 3.2Å; D102-Q106 PolarHBondContact O-N 3.45Å; D102-Q106 VanDerWaalsContact O-N 3.13Å
103	Y	73.1	Confident	68.1	Low	110 Å²	110	100.7 Å²	100.7	43%	0.431	53%	0.527	S	S	.	.	H	α-helix	trans	-68.5	-47.4	175.7	-176.5	-84.4	0	0	0	110.6	L99 H100 N101 A105 Q106 K107	L99-Y103 HydrophobicContact CB-CD1 4.26Å; L99-Y103 HydrophobicContact CD1-CD1 4Å; L99-Y103 HydrophobicContact CD1-CE1 3.9Å; L99-Y103 HydrophobicContact CD2-CD1 3.59Å; L99-Y103 HydrophobicContact CD2-CE1 3.69Å; L99-Y103 HydrophobicContact CD2-CG 4.21Å; L99-Y103 HydrophobicContact CG-CD1 4.17Å; L99-Y103 HydrophobicContact CG-CE1 4.36Å; H100-Y103 WeakPolarHBondContact O-CA 3.2Å; H100-Y103 WeakPolarHBondContact O-CB 3.1Å; H100-Y103 PolarHBondContact O-N 2.85Å; N101-Y103 VanDerWaalsContact C-N 3.34Å; Y103-A105 VanDerWaalsContact C-N 3.34Å; Y103-A105 PolarHBondContact O-N 2.77Å; Y103-Q106 PolarHBondContact O-N 2.9Å; Y103-K107 HydrophobicContact CD1-CB 4.4Å; Y103-K107 HydrophobicContact CD1-CG 4.12Å; Y103-K107 HydrophobicContact CE1-CB 4.14Å; Y103-K107 HydrophobicContact CE1-CG 3.73Å; Y103-K107 HydrophobicContact CE2-CG 4.3Å; Y103-K107 WeakPolarHBondContact O-CB 3.41Å; Y103-K107 PolarHBondContact O-N 2.73Å
104	L	70.2	Confident	70.2	Confident	63 Å²	63	99.6 Å²	99.6	33%	0.33	51%	0.513	S	S	.	.	H	α-helix	trans	-57.8	-48.7	174.8	-71.3	174.6	0	0	0	110.6	L99 H100 N101 Q106 K107 T108	L99-L104 HydrophobicContact CB-CD1 4.32Å; L99-L104 HydrophobicContact CB-CD2 3.81Å; L99-L104 HydrophobicContact CB-CG 3.83Å; L99-L104 HydrophobicContact CD1-CD2 3.94Å; L99-L104 WeakPolarHBondContact O-CD1 3.49Å; H100-L104 PolarHBondContact O-N 2.89Å; H100-L104 VanDerWaalsContact O-N 3.08Å; N101-L104 PolarHBondContact O-N 2.8Å; L104-Q106 VanDerWaalsContact C-N 3.25Å; L104-Q106 PolarHBondContact O-N 3.39Å; L104-K107 PolarHBondContact O-N 3.41Å; L104-K107 VanDerWaalsContact O-N 3.12Å; L104-T108 HydrophobicContact CD2-CG2 4.04Å; L104-T108 WeakPolarHBondContact O-CB 3.32Å; L104-T108 PolarHBondContact O-N 2.64Å; L104-T108 PolarHBondContact O-OG1 2.83Å
105	A	72.3	Confident	72.1	Confident	48 Å²	48	98.9 Å²	98.9	40%	0.397	50%	0.499	S	S	.	.	H	α-helix	trans	-55	-39.6	177.1	0	0	0	0	0	112.1	N101 Y103 L109	N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.38Å; N101-A105 PolarHBondContact O-N 2.8Å; Y103-A105 VanDerWaalsContact C-N 3.34Å; Y103-A105 PolarHBondContact O-N 2.77Å; A105-L109 WeakPolarHBondContact O-CD1 3.46Å; A105-L109 WeakPolarHBondContact O-CG 2.96Å
106	Q	71.7	Confident	74	Confident	105 Å²	105	97.1 Å²	97.1	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-76.2	-37.3	177.8	-68.2	175.3	18.7	0	0	113.1	S56 A57 D102 Y103 L104	S56-Q106 WeakPolarHBondContact CA-O 3.08Å; S56-Q106 WeakPolarHBondContact CB-O 3.24Å; S56-Q106 PolarHBondContact OG-O 3.48Å; A57-Q106 PolarHBondContact N-O 2.88Å; A57-Q106 CarbonylContact O-C 3.51Å; A57-Q106 WeakPolarHBondContact O-CA 3.08Å; D102-Q106 WeakPolarHBondContact O-CG 3.2Å; D102-Q106 PolarHBondContact O-N 3.45Å; D102-Q106 VanDerWaalsContact O-N 3.13Å; Y103-Q106 PolarHBondContact O-N 2.9Å; L104-Q106 VanDerWaalsContact C-N 3.25Å; L104-Q106 PolarHBondContact O-N 3.39Å
107	K	72.1	Confident	75.6	Confident	69 Å²	69	98.9 Å²	98.9	30%	0.3	49%	0.486	S	S	.	.	H	α-helix	trans	-93.4	-24.7	-168	-71.7	-80.4	166.6	-134.3	0	114.6	K55 S56 Y103 L104	K55-K107 WeakPolarHBondContact O-CD 3.35Å; K55-K107 PolarHBondContact O-NZ 3.11Å; S56-K107 WeakPolarHBondContact OG-CD 3.25Å; S56-K107 WeakPolarHBondContact OG-CE 3.49Å; S56-K107 PolarHBondContact OG-NZ 2.84Å; Y103-K107 HydrophobicContact CD1-CB 4.4Å; Y103-K107 HydrophobicContact CD1-CG 4.12Å; Y103-K107 HydrophobicContact CE1-CB 4.14Å; Y103-K107 HydrophobicContact CE1-CG 3.73Å; Y103-K107 HydrophobicContact CE2-CG 4.3Å; Y103-K107 WeakPolarHBondContact O-CB 3.41Å; Y103-K107 PolarHBondContact O-N 2.73Å; L104-K107 PolarHBondContact O-N 3.41Å; L104-K107 VanDerWaalsContact O-N 3.12Å
108	T	71.9	Confident	76.9	Confident	90 Å²	90	94.2 Å²	94.2	55%	0.552	48%	0.478	S	S	*	.	S	Bend	trans	-97.6	-5.2	179.8	69.7	0	0	0	0	113.2	L104	L104-T108 HydrophobicContact CD2-CG2 4.04Å; L104-T108 WeakPolarHBondContact O-CB 3.32Å; L104-T108 PolarHBondContact O-N 2.64Å; L104-T108 PolarHBondContact O-OG1 2.83Å
109	L	76.4	Confident	78.5	Confident	46 Å²	46	90 Å²	90	24%	0.241	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-75.6	133.7	173.4	-71.8	171.2	0	0	0	110.3	A57 V59 A105	A57-L109 HydrophobicContact CB-CB 3.69Å; A57-L109 WeakPolarHBondContact CB-O 3.33Å; A57-L109 PolarHBondContact N-O 3.16Å; V59-L109 HydrophobicContact CG2-CD1 3.37Å; V59-L109 HydrophobicContact CG2-CD2 4.35Å; A105-L109 WeakPolarHBondContact O-CD1 3.46Å; A105-L109 WeakPolarHBondContact O-CG 2.96Å
110	W	74.4	Confident	79.7	Confident	183 Å²	183	90.3 Å²	90.3	69%	0.693	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-85.8	130.2	170.8	-63	84.2	0	0	0	109.1	N66	N66-W110 WeakPolarHBondContact CB-O 3.34Å; N66-W110 PolarHBondContact ND2-O 3.31Å
111	P	75.8	Confident	80.7	Confident	27 Å²	27	89 Å²	89	18%	0.175	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-70.3	141.1	175	29.4	-33.8	0	0	0	110.9	A54 A57 P68 I113	A54-P111 HydrophobicContact CB-CG 3.95Å; A57-P111 HydrophobicContact CB-CB 3.91Å; A57-P111 HydrophobicContact CB-CG 4.5Å; P68-P111 HydrophobicContact CB-CB 3.33Å; P68-P111 HydrophobicContact CB-CG 3.86Å; P68-P111 HydrophobicContact CG-CB 3.78Å; P111-I113 PolarHBondContact O-N 3.4Å
112	E	81.4	Confident	81.7	Confident	69 Å²	69	89.1 Å²	89.1	32%	0.322	46%	0.455	S	S	.	.			trans	-75.8	112.4	170	-170	-172.8	146	0	0	108.7	T65 N66 K115	T65-E112 WeakPolarHBondContact CA-OE2 3.43Å; T65-E112 WeakPolarHBondContact CB-OE2 3.43Å; T65-E112 PolarHBondContact OG1-OE2 3.16Å; N66-E112 WeakPolarHBondContact O-CB 3.27Å; N66-E112 PolarHBondContact O-N 2.87Å; E112-K115 WeakPolarHBondContact OE1-CE 3.29Å; E112-K115 WeakPolarHBondContact OE1-CG 3.24Å; E112-K115 IonicContact OE1-NZ 2.79Å
113	I	82	Confident	82.8	Confident	139 Å²	139	88.7 Å²	88.7	71%	0.713	45%	0.452	S	S	*	.			trans	-94.1	-31.2	-179.1	55.1	167	0	0	0	112.7	P111	P111-I113 PolarHBondContact O-N 3.4Å
114	Q	84.6	Confident	83.9	Confident	82 Å²	82	88.1 Å²	88.1	38%	0.383	45%	0.452	S	S	.	.			trans	-157.7	148.6	-172.2	-164.6	170	40.7	0	0	112.1	L116 V154 G157	Q114-L116 HydrophobicContact CG-CD2 4.3Å; Q114-V154 PolarHBondContact OE1-O 2.86Å; Q114-G157 VanDerWaalsContact NE2-CA 3.29Å
115	K	88.5	Confident	85.2	Confident	117 Å²	117	85.6 Å²	85.6	51%	0.509	44%	0.439	S	S	.	.			trans	-111	125.1	171.1	-65.5	-177.8	-178.6	179.3	0	109.8	E112 Y117	E112-K115 WeakPolarHBondContact OE1-CE 3.29Å; E112-K115 WeakPolarHBondContact OE1-CG 3.24Å; E112-K115 IonicContact OE1-NZ 2.79Å; K115-Y117 HydrophobicContact CB-CD2 4.24Å; K115-Y117 HydrophobicContact CB-CE2 3.54Å; K115-Y117 HydrophobicContact CD-CE2 4.38Å; K115-Y117 WeakPolarHBondContact CD-OH 3.21Å
116	L	90.3	Very high	86.3	Confident	73 Å²	73	87.7 Å²	87.7	38%	0.382	45%	0.447	S	S	.	.			trans	-96.1	110.7	178.4	-55.8	-180	0	0	0	109.5	Q114 W152 G157	Q114-L116 HydrophobicContact CG-CD2 4.3Å; L116-W152 HydrophobicContact CB-CD2 4.2Å; L116-W152 HydrophobicContact CB-CE3 3.91Å; L116-W152 HydrophobicContact CB-CH2 4.35Å; L116-W152 HydrophobicContact CB-CZ3 3.97Å; L116-W152 HydrophobicContact CD1-CB 4.09Å; L116-W152 HydrophobicContact CD1-CD2 4.04Å; L116-W152 HydrophobicContact CD1-CE3 4.36Å; L116-W152 HydrophobicContact CD1-CG 3.89Å; L116-W152 HydrophobicContact CD2-CE3 4.19Å; L116-W152 HydrophobicContact CG-CE3 4.37Å; L116-G157 VanDerWaalsContact CD2-CA 3.46Å
117	Y	90.9	Very high	87.5	Confident	172 Å²	172	83.5 Å²	83.5	68%	0.675	43%	0.431	S	S	*	.			trans	-102.7	130	179.5	-62.5	-82.7	0	0	0	110.5	K115 W152	K115-Y117 HydrophobicContact CB-CD2 4.24Å; K115-Y117 HydrophobicContact CB-CE2 3.54Å; K115-Y117 HydrophobicContact CD-CE2 4.38Å; K115-Y117 WeakPolarHBondContact CD-OH 3.21Å; Y117-W152 WeakPolarHBondContact O-CH2 3.14Å; Y117-W152 WeakPolarHBondContact O-CZ3 3.47Å
118	G	89.6	Confident	88.6	Confident	54 Å²	54	84.1 Å²	84.1	56%	0.557	44%	0.443	S	S	*	.			trans	167.5	-26.1	172.9	0	0	0	0	0	114.5
119	H	93.5	Very high	89.7	Confident	36 Å²	36	80 Å²	80	17%	0.167	42%	0.418	C	S	.	.			trans	-73	133.6	170.7	-77.4	-69.7	0	0	0	111.5	F121 I123 S137 C139 W152	H119-F121 VanDerWaalsContact C-N 3.31Å; H119-I123 HydrophobicContact CB-CD1 3.58Å; H119-I123 WeakPolarHBondContact CD2-CD1 3.26Å; H119-S137 PolarHBondContact CD2-OG 3.14Å; H119-S137 VanDerWaalsContact CD2-OG 3.31Å; H119-S137 PolarHBondContact CE1-O 2.98Å; H119-S137 VanDerWaalsContact CE1-O 3.29Å; H119-S137 PolarHBondContact NE2-O 3.05Å; H119-S137 VanDerWaalsContact NE2-O 3.11Å; H119-S137 PolarHBondContact NE2-OG 3.1Å; H119-C139 HydrophobicContact CB-CB 3.87Å; H119-C139 WeakPolarHBondContact ND1-CB 3.48Å; H119-C139 PolarHBondContact ND1-SG 3.23Å; H119-C139 VanDerWaalsContact ND1-SG 3.42Å; H119-W152 AromaticContact CD2-CZ2 3.86Å
120	G	91.2	Very high	90.5	Very high	68 Å²	68	84 Å²	84	70%	0.701	44%	0.435	S	S	*	.	S	Bend	trans	-80.2	-8.8	177.2	0	0	0	0	0	114.7
121	F	96.1	Very high	91.4	Very high	97 Å²	97	78.6 Å²	78.6	43%	0.425	43%	0.429	S	S	.	.	S	Bend	trans	-137.6	173.6	-176.9	-62.3	-84.6	0	0	0	111.5	H119 I123 C139 K140 H146	H119-F121 VanDerWaalsContact C-N 3.31Å; F121-I123 PolarHBondContact O-N 3.05Å; F121-C139 HydrophobicContact CB-CB 4.12Å; F121-C139 WeakPolarHBondContact O-CB 3.41Å; F121-K140 WeakPolarHBondContact CB-O 3.39Å; F121-H146 HydrophobicContact CD2-CB 4.08Å; F121-H146 AromaticContact CD2-CG 3.95Å; F121-H146 AromaticContact CD2-ND1 3.92Å; F121-H146 HydrophobicContact CE2-CB 4.06Å; F121-H146 AromaticContact CE2-CD2 3.78Å; F121-H146 AromaticContact CE2-CE1 3.31Å; F121-H146 WeakPolarHBondContact CE2-CE1 3.34Å; F121-H146 AromaticContact CE2-CG 3.41Å; F121-H146 VanDerWaalsContact CE2-CG 3.41Å; F121-H146 AromaticContact CE2-ND1 3.1Å; F121-H146 WeakPolarHBondContact CE2-ND1 3.2Å; F121-H146 AromaticContact CE2-NE2 3.73Å; F121-H146 AromaticContact CZ-CE1 3.55Å; F121-H146 AromaticContact CZ-ND1 3.6Å
122	E	96.2	Very high	92.1	Very high	124 Å²	124	79.4 Å²	79.4	58%	0.579	44%	0.443	S	S	*	.			trans	-49.3	127.4	174.9	-59.9	147.1	168.3	0	0	111.1	F124 C139 K140	E122-F124 PolarHBondContact O-N 3.09Å; E122-C139 CarbonylContact O-C 3.55Å; E122-C139 VanDerWaalsContact O-CA 3.25Å; E122-C139 WeakPolarHBondContact O-CA 3.37Å; E122-C139 WeakPolarHBondContact O-CB 3.2Å; E122-K140 PolarHBondContact O-N 2.93Å; E122-K140 WeakPolarHBondContact OE2-CD 3.46Å; E122-K140 IonicContact OE2-NZ 3.53Å; E122-K140 PolarHBondContact OE2-NZ 3.09Å
123	I	96.9	Very high	92.6	Very high	91 Å²	91	78 Å²	78	47%	0.467	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	132.5	174.3	-55.7	-57.1	0	0	0	109	H119 F121 V126 C139	H119-I123 HydrophobicContact CB-CD1 3.58Å; H119-I123 WeakPolarHBondContact CD2-CD1 3.26Å; F121-I123 PolarHBondContact O-N 3.05Å; I123-V126 HydrophobicContact CG2-CG1 3.6Å; I123-C139 HydrophobicContact CD1-CB 4.48Å
124	F	96.6	Very high	93.2	Very high	98 Å²	98	71.4 Å²	71.4	43%	0.43	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-37.2	-178.1	-165.1	-85.3	0	0	0	112.4	E122 A138 T169 V170 T171	E122-F124 PolarHBondContact O-N 3.09Å; F124-A138 PolarHBondContact N-O 3.04Å; F124-T169 HydrophobicContact CB-CG2 3.66Å; F124-T169 HydrophobicContact CD1-CG2 3.49Å; F124-T169 VanDerWaalsContact CD1-CG2 3.49Å; F124-T169 HydrophobicContact CD2-CG2 3.68Å; F124-T169 HydrophobicContact CE1-CG2 4.05Å; F124-T169 HydrophobicContact CE2-CG2 4.19Å; F124-T169 HydrophobicContact CG-CG2 3.28Å; F124-T169 HydrophobicContact CZ-CG2 4.36Å; F124-V170 WeakPolarHBondContact CD1-O 3.28Å; F124-T171 HydrophobicContact CE1-CG2 4Å
125	S	95.9	Very high	93.7	Very high	10 Å²	10	69.1 Å²	69.1	7%	0.07	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	144	-178.7	-164.7	0	0	0	0	110.6	S137 A138 T171 R172 I173	S125-S137 CarbonylContact O-C 3.59Å; S125-S137 WeakPolarHBondContact O-CA 3.2Å; S125-A138 PolarHBondContact N-O 2.85Å; S125-A138 VanDerWaalsContact N-O 3.17Å; S125-A138 PolarHBondContact O-N 3.25Å; S125-T171 PolarHBondContact OG-O 2.86Å; S125-R172 WeakPolarHBondContact OG-CA 3.13Å; S125-I173 PolarHBondContact OG-N 2.9Å
126	V	96.6	Very high	94.1	Very high	91 Å²	91	63.6 Å²	63.6	55%	0.552	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.2	148.9	176.2	-64.5	0	0	0	0	109.2	I123 A136	I123-V126 HydrophobicContact CG2-CG1 3.6Å; V126-A136 CarbonylContact C-O 3.54Å; V126-A136 VanDerWaalsContact CA-O 3.27Å; V126-A136 WeakPolarHBondContact CA-O 3.44Å
127	A	96.6	Very high	94.5	Very high	18 Å²	18	60.5 Å²	60.5	15%	0.149	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	145.2	171	0	0	0	0	0	109.4	V135 A136 I173 F175	A127-V135 CarbonylContact O-C 3.48Å; A127-V135 WeakPolarHBondContact O-CA 3.46Å; A127-A136 PolarHBondContact N-O 2.97Å; A127-A136 PolarHBondContact O-N 2.58Å; A127-I173 HydrophobicContact CB-CB 3.95Å; A127-I173 HydrophobicContact CB-CG2 3.92Å; A127-I173 WeakPolarHBondContact CB-O 3.17Å; A127-F175 HydrophobicContact CB-CD2 4.14Å; A127-F175 HydrophobicContact CB-CE2 4.14Å
128	S	95.3	Very high	94.8	Very high	81 Å²	81	52.3 Å²	52.3	57%	0.566	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	149.3	166.3	57.7	0	0	0	0	109.4	V134 F175	S128-V134 WeakPolarHBondContact CA-O 3.18Å; S128-F175 VanDerWaalsContact C-CD2 3.44Å; S128-F175 VanDerWaalsContact O-CD2 3.28Å; S128-F175 WeakPolarHBondContact O-CD2 3.23Å
129	N	95.3	Very high	95.2	Very high	4 Å²	4	50 Å²	50	2%	0.021	30%	0.3	C	S	.	.			trans	-70.2	162.6	164.3	76.5	-34.7	0	0	0	110.3	A131 G132 T133 V134 F175 D179	N129-A131 VanDerWaalsContact C-N 3.35Å; N129-G132 PolarHBondContact O-N 3.46Å; N129-G132 PolarHBondContact OD1-N 2.93Å; N129-G132 VanDerWaalsContact OD1-N 3.13Å; N129-T133 PolarHBondContact ND2-OG1 3.33Å; N129-T133 PolarHBondContact OD1-N 2.99Å; N129-V134 HydrophobicContact CB-CB 4.26Å; N129-V134 PolarHBondContact N-O 2.96Å; N129-V134 PolarHBondContact OD1-N 3.08Å; N129-V134 PolarHBondContact OD1-O 3Å; N129-V134 VanDerWaalsContact OD1-O 3.06Å; N129-F175 HydrophobicContact CB-CD1 3.8Å; N129-F175 HydrophobicContact CB-CD2 4.11Å; N129-F175 HydrophobicContact CB-CE1 3.87Å; N129-F175 HydrophobicContact CB-CE2 4.17Å; N129-F175 HydrophobicContact CB-CG 3.92Å; N129-F175 HydrophobicContact CB-CZ 4.06Å; N129-D179 HydrophobicContact CB-CB 4.38Å; N129-D179 WeakPolarHBondContact CB-OD1 3.18Å; N129-D179 PolarHBondContact ND2-OD2 3.44Å
130	H	93.1	Very high	95.4	Very high	129 Å²	129	52.9 Å²	52.9	60%	0.597	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-28.2	-178.1	-63.1	-65.3	0	0	0	112.8	G132 S176 D179	H130-G132 PolarHBondContact O-N 3.03Å; H130-S176 PolarHBondContact CD2-O 3.39Å; H130-S176 VanDerWaalsContact CD2-O 3.26Å; H130-D179 IonicContact CD2-OD1 3.94Å; H130-D179 PolarHBondContact CD2-OD1 3.01Å; H130-D179 VanDerWaalsContact CD2-OD1 3.26Å; H130-D179 IonicContact CG-OD1 2.75Å; H130-D179 VanDerWaalsContact N-CG 3.31Å; H130-D179 PolarHBondContact N-OD1 3.36Å; H130-D179 PolarHBondContact N-OD2 2.84Å
131	A	92.1	Very high	95.6	Very high	70 Å²	70	49.7 Å²	49.7	58%	0.579	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-12.2	173.7	0	0	0	0	0	113.6	N129 T133 D179	N129-A131 VanDerWaalsContact C-N 3.35Å; A131-T133 VanDerWaalsContact C-N 3.31Å; A131-T133 PolarHBondContact O-N 3.04Å; A131-D179 WeakPolarHBondContact CB-OD2 3.17Å; A131-D179 PolarHBondContact N-OD2 3.13Å
132	G	91.4	Very high	95.6	Very high	44 Å²	44	49.5 Å²	49.5	45%	0.454	29%	0.29	S	S	.	.	S	Bend	trans	73.4	17.6	177.3	0	0	0	0	0	114.9	N129 H130 V154	N129-G132 PolarHBondContact O-N 3.46Å; N129-G132 PolarHBondContact OD1-N 2.93Å; N129-G132 VanDerWaalsContact OD1-N 3.13Å; H130-G132 PolarHBondContact O-N 3.03Å; G132-V154 WeakPolarHBondContact O-CG2 3.13Å
133	T	91.6	Very high	95.6	Very high	40 Å²	40	50 Å²	50	25%	0.245	29%	0.287	C	S	.	.	S	Bend	trans	-100.3	-22.4	-177.5	54	0	0	0	0	113.4	N129 A131 V154	N129-T133 PolarHBondContact ND2-OG1 3.33Å; N129-T133 PolarHBondContact OD1-N 2.99Å; A131-T133 VanDerWaalsContact C-N 3.31Å; A131-T133 PolarHBondContact O-N 3.04Å; T133-V154 PolarHBondContact O-N 3.04Å; T133-V154 VanDerWaalsContact O-N 3.13Å
134	V	94.3	Very high	95.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.4	-172.7	-170.8	0	0	0	0	110.5	S128 N129 L151 W152 F175 D200 F201	S128-V134 WeakPolarHBondContact CA-O 3.18Å; N129-V134 HydrophobicContact CB-CB 4.26Å; N129-V134 PolarHBondContact N-O 2.96Å; N129-V134 PolarHBondContact OD1-N 3.08Å; N129-V134 PolarHBondContact OD1-O 3Å; N129-V134 VanDerWaalsContact OD1-O 3.06Å; V134-L151 HydrophobicContact CG1-CB 4.23Å; V134-L151 HydrophobicContact CG1-CD2 4.26Å; V134-W152 WeakPolarHBondContact CA-O 3.41Å; V134-F175 HydrophobicContact CB-CZ 4.48Å; V134-F175 HydrophobicContact CG1-CZ 4.16Å; V134-D200 HydrophobicContact CG2-CB 4.09Å; V134-D200 WeakPolarHBondContact CG2-O 3.01Å; V134-F201 HydrophobicContact CB-CE1 4.48Å; V134-F201 HydrophobicContact CG1-CD1 4.19Å; V134-F201 HydrophobicContact CG1-CE1 4.4Å; V134-F201 HydrophobicContact CG2-CD1 3.95Å; V134-F201 HydrophobicContact CG2-CE1 3.76Å
135	V	95.8	Very high	95.4	Very high	35 Å²	35	50.3 Å²	50.3	21%	0.212	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.4	163.9	176.4	0	0	0	0	108.2	A127 L151 W152 V154	A127-V135 CarbonylContact O-C 3.48Å; A127-V135 WeakPolarHBondContact O-CA 3.46Å; V135-L151 CarbonylContact O-C 3.47Å; V135-L151 WeakPolarHBondContact O-CA 3.47Å; V135-W152 HydrophobicContact CB-CB 4.32Å; V135-W152 PolarHBondContact N-O 2.87Å; V135-W152 VanDerWaalsContact O-CD1 3.24Å; V135-W152 PolarHBondContact O-N 2.81Å; V135-V154 HydrophobicContact CG2-CG2 3.81Å
136	A	97.6	Very high	95.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.1	168	0	0	0	0	0	108.6	V126 A127 V149 I150 L151 I173 F175	V126-A136 CarbonylContact C-O 3.54Å; V126-A136 VanDerWaalsContact CA-O 3.27Å; V126-A136 WeakPolarHBondContact CA-O 3.44Å; A127-A136 PolarHBondContact N-O 2.97Å; A127-A136 PolarHBondContact O-N 2.58Å; A136-V149 HydrophobicContact CB-CG1 4.02Å; A136-I150 CarbonylContact C-O 3.52Å; A136-I150 WeakPolarHBondContact CA-O 3.37Å; A136-L151 HydrophobicContact CB-CD2 3.57Å; A136-I173 HydrophobicContact CB-CD1 4.28Å; A136-I173 HydrophobicContact CB-CG2 3.77Å; A136-F175 HydrophobicContact CB-CE2 3.85Å; A136-F175 HydrophobicContact CB-CZ 3.87Å
137	S	97.6	Very high	95.4	Very high	8 Å²	8	48.4 Å²	48.4	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.3	175.5	68.6	0	0	0	0	112.4	H119 S125 V149 I150 W152	H119-S137 PolarHBondContact CD2-OG 3.14Å; H119-S137 VanDerWaalsContact CD2-OG 3.31Å; H119-S137 PolarHBondContact CE1-O 2.98Å; H119-S137 VanDerWaalsContact CE1-O 3.29Å; H119-S137 PolarHBondContact NE2-O 3.05Å; H119-S137 VanDerWaalsContact NE2-O 3.11Å; H119-S137 PolarHBondContact NE2-OG 3.1Å; S125-S137 CarbonylContact O-C 3.59Å; S125-S137 WeakPolarHBondContact O-CA 3.2Å; S137-V149 WeakPolarHBondContact O-CA 3.36Å; S137-I150 PolarHBondContact N-O 2.88Å; S137-I150 PolarHBondContact O-N 3.05Å; S137-W152 PolarHBondContact OG-NE1 3.34Å
138	A	97.8	Very high	95.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.3	176	0	0	0	0	0	110.5	F124 S125 V149 V170 I173	F124-A138 PolarHBondContact N-O 3.04Å; S125-A138 PolarHBondContact N-O 2.85Å; S125-A138 VanDerWaalsContact N-O 3.17Å; S125-A138 PolarHBondContact O-N 3.25Å; A138-V149 HydrophobicContact CB-CG2 4.23Å; A138-V170 HydrophobicContact CB-CB 3.67Å; A138-V170 HydrophobicContact CB-CG1 4.24Å; A138-V170 HydrophobicContact CB-CG2 4.22Å; A138-I173 HydrophobicContact CB-CD1 3.96Å
139	C	97	Very high	95.5	Very high	4 Å²	4	44 Å²	44	3%	0.027	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	170.8	176.3	69.9	0	0	0	0	112.7	H119 F121 E122 I123 A141 H146	H119-C139 HydrophobicContact CB-CB 3.87Å; H119-C139 WeakPolarHBondContact ND1-CB 3.48Å; H119-C139 PolarHBondContact ND1-SG 3.23Å; H119-C139 VanDerWaalsContact ND1-SG 3.42Å; F121-C139 HydrophobicContact CB-CB 4.12Å; F121-C139 WeakPolarHBondContact O-CB 3.41Å; E122-C139 CarbonylContact O-C 3.55Å; E122-C139 VanDerWaalsContact O-CA 3.25Å; E122-C139 WeakPolarHBondContact O-CA 3.37Å; E122-C139 WeakPolarHBondContact O-CB 3.2Å; I123-C139 HydrophobicContact CD1-CB 4.48Å; C139-A141 PolarHBondContact O-N 3.29Å; C139-H146 PolarHBondContact SG-O 3.32Å
140	K	97.9	Very high	95.6	Very high	98 Å²	98	44.5 Å²	44.5	43%	0.426	25%	0.249	S	C	.	.			trans	-65.3	117.4	172.9	-176.8	-176.1	-179.5	-179.6	0	110	F121 E122	F121-K140 WeakPolarHBondContact CB-O 3.39Å; E122-K140 PolarHBondContact O-N 2.93Å; E122-K140 WeakPolarHBondContact OE2-CD 3.46Å; E122-K140 IonicContact OE2-NZ 3.53Å; E122-K140 PolarHBondContact OE2-NZ 3.09Å
141	A	96.6	Very high	95.8	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	22%	0.221	C	C	.	.			trans	-123.2	131.6	-176.4	0	0	0	0	0	112.4	C139 H146 A147 T169	C139-A141 PolarHBondContact O-N 3.29Å; A141-H146 VanDerWaalsContact CB-C 3.43Å; A141-H146 HydrophobicContact CB-CB 3.89Å; A141-H146 WeakPolarHBondContact CB-O 3.31Å; A141-A147 VanDerWaalsContact CB-CA 3.42Å; A141-A147 HydrophobicContact CB-CB 3.62Å; A141-T169 PolarHBondContact N-OG1 2.94Å; A141-T169 PolarHBondContact O-N 2.88Å; A141-T169 PolarHBondContact O-OG1 2.89Å
142	S	96.4	Very high	95.9	Very high	92 Å²	92	35.1 Å²	35.1	64%	0.643	19%	0.194	S	C	*	.	S	Bend	trans	-105.5	-9.9	168.4	56.2	0	0	0	0	112.9
143	R	96	Very high	96	Very high	136 Å²	136	33.3 Å²	33.3	51%	0.513	17%	0.174	S	C	.	.	S	Bend	trans	-133.6	152.4	-178.6	-65.4	178.3	69.7	125.3	-3.3	109.4	E145 H146 A147 R167	R143-E145 IonicContact CZ-OE1 2.93Å; R143-E145 VanDerWaalsContact CZ-OE1 3.29Å; R143-E145 IonicContact NE-OE1 2.64Å; R143-E145 PolarHBondContact NE-OE1 3.15Å; R143-E145 IonicContact NH2-OE1 3.91Å; R143-E145 PolarHBondContact NH2-OE1 3.22Å; R143-E145 IonicContact NH2-OE2 2.76Å; R143-E145 PolarHBondContact O-N 2.96Å; R143-H146 PolarHBondContact O-N 3.06Å; R143-H146 VanDerWaalsContact O-N 3.11Å; R143-A147 PolarHBondContact O-N 3.23Å; R143-R167 CarbonylContact C-O 3.54Å; R143-R167 VanDerWaalsContact C-O 3.23Å
144	P	95	Very high	95.9	Very high	74 Å²	74	34 Å²	34	48%	0.481	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-59.1	-33.4	178	23.5	-33.9	0	0	0	112.9	H146 A147 R167	P144-H146 PolarHBondContact O-N 3.41Å; P144-H146 VanDerWaalsContact O-N 3.13Å; P144-A147 PolarHBondContact O-N 3.16Å; P144-A147 VanDerWaalsContact O-N 3.1Å; P144-R167 HydrophobicContact CB-CG 4.42Å
145	E	94.5	Very high	95.6	Very high	120 Å²	120	40.6 Å²	40.6	56%	0.561	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-59.9	-21.8	178.2	-59.7	153.6	-112.2	0	0	113.4	R143	R143-E145 IonicContact CZ-OE1 2.93Å; R143-E145 VanDerWaalsContact CZ-OE1 3.29Å; R143-E145 IonicContact NE-OE1 2.64Å; R143-E145 PolarHBondContact NE-OE1 3.15Å; R143-E145 IonicContact NH2-OE1 3.91Å; R143-E145 PolarHBondContact NH2-OE1 3.22Å; R143-E145 IonicContact NH2-OE2 2.76Å; R143-E145 PolarHBondContact O-N 2.96Å
146	H	95.5	Very high	95.2	Very high	59 Å²	59	44 Å²	44	27%	0.273	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-109.9	-4.4	179.7	-49.3	153.9	0	0	0	112.4	F121 C139 A141 R143 P144 A148	F121-H146 HydrophobicContact CD2-CB 4.08Å; F121-H146 AromaticContact CD2-CG 3.95Å; F121-H146 AromaticContact CD2-ND1 3.92Å; F121-H146 HydrophobicContact CE2-CB 4.06Å; F121-H146 AromaticContact CE2-CD2 3.78Å; F121-H146 AromaticContact CE2-CE1 3.31Å; F121-H146 WeakPolarHBondContact CE2-CE1 3.34Å; F121-H146 AromaticContact CE2-CG 3.41Å; F121-H146 VanDerWaalsContact CE2-CG 3.41Å; F121-H146 AromaticContact CE2-ND1 3.1Å; F121-H146 WeakPolarHBondContact CE2-ND1 3.2Å; F121-H146 AromaticContact CE2-NE2 3.73Å; F121-H146 AromaticContact CZ-CE1 3.55Å; F121-H146 AromaticContact CZ-ND1 3.6Å; C139-H146 PolarHBondContact SG-O 3.32Å; A141-H146 VanDerWaalsContact CB-C 3.43Å; A141-H146 HydrophobicContact CB-CB 3.89Å; A141-H146 WeakPolarHBondContact CB-O 3.31Å; R143-H146 PolarHBondContact O-N 3.06Å; R143-H146 VanDerWaalsContact O-N 3.11Å; P144-H146 PolarHBondContact O-N 3.41Å; P144-H146 VanDerWaalsContact O-N 3.13Å; H146-A148 VanDerWaalsContact C-N 3.28Å; H146-A148 PolarHBondContact O-N 3.11Å
147	A	96.2	Very high	94.6	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.017	23%	0.232	C	C	.	.			trans	-90.4	9.9	-171.7	0	0	0	0	0	113.3	A141 R143 P144 H166	A141-A147 VanDerWaalsContact CB-CA 3.42Å; A141-A147 HydrophobicContact CB-CB 3.62Å; R143-A147 PolarHBondContact O-N 3.23Å; P144-A147 PolarHBondContact O-N 3.16Å; P144-A147 VanDerWaalsContact O-N 3.1Å; A147-H166 HydrophobicContact CB-CB 4.19Å; A147-H166 WeakPolarHBondContact CB-O 3.44Å
148	A	96.3	Very high	94.1	Very high	6 Å²	6	47.8 Å²	47.8	5%	0.05	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-73.6	150	-179.1	0	0	0	0	0	112.2	H146 E162 L163 T164	H146-A148 VanDerWaalsContact C-N 3.28Å; H146-A148 PolarHBondContact O-N 3.11Å; A148-E162 HydrophobicContact CB-CG 3.4Å; A148-E162 WeakPolarHBondContact CB-OE1 3.32Å; A148-L163 WeakPolarHBondContact CA-O 3.32Å; A148-T164 HydrophobicContact CB-CG2 4.11Å
149	V	97.7	Very high	93.9	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122	171.7	-179.5	0	0	0	0	108.1	A136 S137 A138 L163 V170 I173 T184	A136-V149 HydrophobicContact CB-CG1 4.02Å; S137-V149 WeakPolarHBondContact O-CA 3.36Å; A138-V149 HydrophobicContact CB-CG2 4.23Å; V149-L163 HydrophobicContact CB-CB 4.23Å; V149-L163 PolarHBondContact N-O 2.82Å; V149-L163 PolarHBondContact O-N 3.29Å; V149-V170 HydrophobicContact CG2-CB 4.4Å; V149-V170 HydrophobicContact CG2-CG1 4.2Å; V149-V170 HydrophobicContact CG2-CG2 3.89Å; V149-I173 HydrophobicContact CG1-CD1 3.78Å; V149-I173 HydrophobicContact CG1-CG1 4.41Å; V149-I173 HydrophobicContact CG2-CD1 4.41Å; V149-T184 HydrophobicContact CG2-CG2 3.95Å
150	I	97	Very high	93.7	Very high	15 Å²	15	54.4 Å²	54.4	8%	0.077	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.4	179.1	-56.9	178.3	0	0	0	108.7	A136 S137 W152 P159 S161	A136-I150 CarbonylContact C-O 3.52Å; A136-I150 WeakPolarHBondContact CA-O 3.37Å; S137-I150 PolarHBondContact N-O 2.88Å; S137-I150 PolarHBondContact O-N 3.05Å; I150-W152 HydrophobicContact CB-CZ2 3.75Å; I150-W152 HydrophobicContact CD1-CH2 4.4Å; I150-W152 HydrophobicContact CD1-CZ2 3.94Å; I150-W152 HydrophobicContact CG1-CZ2 4.44Å; I150-W152 HydrophobicContact CG2-CD2 3.96Å; I150-W152 HydrophobicContact CG2-CE3 4.49Å; I150-W152 HydrophobicContact CG2-CH2 4.03Å; I150-W152 HydrophobicContact CG2-CZ2 3.41Å; I150-W152 VanDerWaalsContact CG2-CZ2 3.41Å; I150-W152 VanDerWaalsContact O-CD1 3.31Å; I150-W152 PolarHBondContact O-NE1 2.84Å; I150-W152 VanDerWaalsContact O-NE1 3.12Å; I150-P159 HydrophobicContact CG2-CB 3.52Å; I150-S161 WeakPolarHBondContact CA-O 3.22Å
151	L	97.2	Very high	93.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133.6	170.7	-58.1	-174.6	0	0	0	110.3	V134 V135 A136 K160 S161 L163 L182 F201 Y203	V134-L151 HydrophobicContact CG1-CB 4.23Å; V134-L151 HydrophobicContact CG1-CD2 4.26Å; V135-L151 CarbonylContact O-C 3.47Å; V135-L151 WeakPolarHBondContact O-CA 3.47Å; A136-L151 HydrophobicContact CB-CD2 3.57Å; L151-K160 PolarHBondContact O-N 3.26Å; L151-S161 PolarHBondContact N-O 3.23Å; L151-L163 HydrophobicContact CD1-CD1 4.1Å; L151-L163 HydrophobicContact CD1-CG 4.43Å; L151-L163 HydrophobicContact CD2-CD1 4.28Å; L151-L163 HydrophobicContact CG-CD1 4.18Å; L151-L163 HydrophobicContact CG-CG 4.4Å; L151-L182 HydrophobicContact CD2-CD2 4.23Å; L151-F201 WeakPolarHBondContact CD1-O 3.21Å; L151-Y203 HydrophobicContact CD1-CD2 3.41Å; L151-Y203 VanDerWaalsContact CD1-CD2 3.41Å; L151-Y203 HydrophobicContact CD1-CE2 3.98Å; L151-Y203 HydrophobicContact CD1-CG 4.17Å
152	W	95.5	Very high	93.5	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.3	-175.8	-47.3	83.1	0	0	0	109.3	L116 Y117 H119 V134 V135 S137 I150 P159	L116-W152 HydrophobicContact CB-CD2 4.2Å; L116-W152 HydrophobicContact CB-CE3 3.91Å; L116-W152 HydrophobicContact CB-CH2 4.35Å; L116-W152 HydrophobicContact CB-CZ3 3.97Å; L116-W152 HydrophobicContact CD1-CB 4.09Å; L116-W152 HydrophobicContact CD1-CD2 4.04Å; L116-W152 HydrophobicContact CD1-CE3 4.36Å; L116-W152 HydrophobicContact CD1-CG 3.89Å; L116-W152 HydrophobicContact CD2-CE3 4.19Å; L116-W152 HydrophobicContact CG-CE3 4.37Å; Y117-W152 WeakPolarHBondContact O-CH2 3.14Å; Y117-W152 WeakPolarHBondContact O-CZ3 3.47Å; H119-W152 AromaticContact CD2-CZ2 3.86Å; V134-W152 WeakPolarHBondContact CA-O 3.41Å; V135-W152 HydrophobicContact CB-CB 4.32Å; V135-W152 PolarHBondContact N-O 2.87Å; V135-W152 VanDerWaalsContact O-CD1 3.24Å; V135-W152 PolarHBondContact O-N 2.81Å; S137-W152 PolarHBondContact OG-NE1 3.34Å; I150-W152 HydrophobicContact CB-CZ2 3.75Å; I150-W152 HydrophobicContact CD1-CH2 4.4Å; I150-W152 HydrophobicContact CD1-CZ2 3.94Å; I150-W152 HydrophobicContact CG1-CZ2 4.44Å; I150-W152 HydrophobicContact CG2-CD2 3.96Å; I150-W152 HydrophobicContact CG2-CE3 4.49Å; I150-W152 HydrophobicContact CG2-CH2 4.03Å; I150-W152 HydrophobicContact CG2-CZ2 3.41Å; I150-W152 VanDerWaalsContact CG2-CZ2 3.41Å; I150-W152 VanDerWaalsContact O-CD1 3.31Å; I150-W152 PolarHBondContact O-NE1 2.84Å; I150-W152 VanDerWaalsContact O-NE1 3.12Å; W152-P159 HydrophobicContact CE3-CB 4.05Å; W152-P159 HydrophobicContact CH2-CB 4.15Å; W152-P159 HydrophobicContact CZ3-CB 3.81Å; W152-P159 HydrophobicContact CZ3-CG 4.1Å
153	S	92.4	Very high	93.5	Very high	6 Å²	6	52.9 Å²	52.9	4%	0.042	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	130	163.1	174.4	0	0	0	0	109.1	D155 E156 G157	S153-D155 PolarHBondContact O-N 3.1Å; S153-D155 PolarHBondContact OG-N 3.22Å; S153-E156 PolarHBondContact OG-N 3.43Å; S153-G157 PolarHBondContact O-N 3.16Å
154	V	88.7	Confident	93.4	Very high	53 Å²	53	50.8 Å²	50.8	32%	0.321	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-34.1	176.2	171.2	0	0	0	0	111.5	Q114 G132 T133 V135	Q114-V154 PolarHBondContact OE1-O 2.86Å; G132-V154 WeakPolarHBondContact O-CG2 3.13Å; T133-V154 PolarHBondContact O-N 3.04Å; T133-V154 VanDerWaalsContact O-N 3.13Å; V135-V154 HydrophobicContact CG2-CG2 3.81Å
155	D	88.5	Confident	93.2	Very high	139 Å²	139	48.5 Å²	48.5	74%	0.743	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-39.9	-177.2	-60.8	-47.4	0	0	0	112.7	S153	S153-D155 PolarHBondContact O-N 3.1Å; S153-D155 PolarHBondContact OG-N 3.22Å
156	E	88.1	Confident	93.3	Very high	106 Å²	106	43.1 Å²	43.1	50%	0.495	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-28.3	-173.4	-61.1	-179.7	-137.7	0	0	113.3	S153 V158 K160	S153-E156 PolarHBondContact OG-N 3.43Å; E156-V158 PolarHBondContact O-N 2.99Å; E156-K160 VanDerWaalsContact CD-CE 3.45Å; E156-K160 VanDerWaalsContact OE1-CE 3.32Å; E156-K160 WeakPolarHBondContact OE1-CE 3.33Å; E156-K160 IonicContact OE1-NZ 2.96Å; E156-K160 PolarHBondContact OE1-NZ 3.3Å; E156-K160 WeakPolarHBondContact OE2-CE 3.39Å; E156-K160 IonicContact OE2-NZ 3.43Å; E156-K160 PolarHBondContact OE2-NZ 2.89Å
157	G	84	Confident	93.3	Very high	12 Å²	12	48.1 Å²	48.1	12%	0.124	26%	0.258	C	S	.	.			trans	64.8	14.2	-176.5	0	0	0	0	0	116.1	Q114 L116 S153	Q114-G157 VanDerWaalsContact NE2-CA 3.29Å; L116-G157 VanDerWaalsContact CD2-CA 3.46Å; S153-G157 PolarHBondContact O-N 3.16Å
158	V	87.9	Confident	93.3	Very high	76 Å²	76	50.8 Å²	50.8	46%	0.461	27%	0.271	S	S	.	.	S	Bend	trans	-99.9	142.4	177.1	-178.5	0	0	0	0	109.2	E156 K160	E156-V158 PolarHBondContact O-N 2.99Å; V158-K160 PolarHBondContact O-N 2.57Å
159	P	93	Very high	93.4	Very high	62 Å²	62	50.5 Å²	50.5	40%	0.403	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	124.4	172.4	28.4	-35.1	0	0	0	110	I150 W152	I150-P159 HydrophobicContact CG2-CB 3.52Å; W152-P159 HydrophobicContact CE3-CB 4.05Å; W152-P159 HydrophobicContact CH2-CB 4.15Å; W152-P159 HydrophobicContact CZ3-CB 3.81Å; W152-P159 HydrophobicContact CZ3-CG 4.1Å
160	K	94.2	Very high	93.4	Very high	83 Å²	83	50.4 Å²	50.4	36%	0.361	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-36.6	-175.8	-71.8	-69.2	-171.8	173.1	0	113.3	L151 E156 V158 F201	L151-K160 PolarHBondContact O-N 3.26Å; E156-K160 VanDerWaalsContact CD-CE 3.45Å; E156-K160 VanDerWaalsContact OE1-CE 3.32Å; E156-K160 WeakPolarHBondContact OE1-CE 3.33Å; E156-K160 IonicContact OE1-NZ 2.96Å; E156-K160 PolarHBondContact OE1-NZ 3.3Å; E156-K160 WeakPolarHBondContact OE2-CE 3.39Å; E156-K160 IonicContact OE2-NZ 3.43Å; E156-K160 PolarHBondContact OE2-NZ 2.89Å; V158-K160 PolarHBondContact O-N 2.57Å; K160-F201 HydrophobicContact CB-CB 3.76Å; K160-F201 HydrophobicContact CB-CD1 3.89Å; K160-F201 HydrophobicContact CB-CD2 4.15Å; K160-F201 HydrophobicContact CB-CG 3.64Å; K160-F201 HydrophobicContact CD-CD2 4.23Å; K160-F201 HydrophobicContact CD-CE2 4.39Å; K160-F201 HydrophobicContact CG-CB 4.47Å; K160-F201 HydrophobicContact CG-CD1 3.92Å; K160-F201 HydrophobicContact CG-CD2 3.95Å; K160-F201 HydrophobicContact CG-CE1 4.14Å; K160-F201 HydrophobicContact CG-CE2 4.17Å; K160-F201 HydrophobicContact CG-CG 3.83Å; K160-F201 HydrophobicContact CG-CZ 4.27Å
161	S	94.3	Very high	93.5	Very high	33 Å²	33	50.3 Å²	50.3	23%	0.231	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	147.5	-176.4	-175.1	0	0	0	0	110.2	I150 L151 F201	I150-S161 WeakPolarHBondContact CA-O 3.22Å; L151-S161 PolarHBondContact N-O 3.23Å; S161-F201 VanDerWaalsContact CB-O 3.27Å; S161-F201 WeakPolarHBondContact CB-O 3.39Å
162	E	94.6	Very high	93.5	Very high	115 Å²	115	53.5 Å²	53.5	54%	0.537	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.6	177.6	-174.8	179.1	149.1	0	0	109.2	A148 T164	A148-E162 HydrophobicContact CB-CG 3.4Å; A148-E162 WeakPolarHBondContact CB-OE1 3.32Å; E162-T164 HydrophobicContact CG-CG2 4.36Å
163	L	96	Very high	93.6	Very high	10 Å²	10	53.6 Å²	53.6	5%	0.052	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	106.2	-178.8	-54.4	-178.6	0	0	0	109.3	A148 V149 L151 L182 F194 Y203	A148-L163 WeakPolarHBondContact CA-O 3.32Å; V149-L163 HydrophobicContact CB-CB 4.23Å; V149-L163 PolarHBondContact N-O 2.82Å; V149-L163 PolarHBondContact O-N 3.29Å; L151-L163 HydrophobicContact CD1-CD1 4.1Å; L151-L163 HydrophobicContact CD1-CG 4.43Å; L151-L163 HydrophobicContact CD2-CD1 4.28Å; L151-L163 HydrophobicContact CG-CD1 4.18Å; L151-L163 HydrophobicContact CG-CG 4.4Å; L163-L182 HydrophobicContact CD1-CD2 3.38Å; L163-F194 HydrophobicContact CB-CD1 4.18Å; L163-F194 HydrophobicContact CB-CE1 3.69Å; L163-F194 HydrophobicContact CB-CE2 4.47Å; L163-F194 HydrophobicContact CB-CZ 3.86Å; L163-F194 HydrophobicContact CD1-CD1 4.06Å; L163-F194 HydrophobicContact CD1-CD2 4.21Å; L163-F194 HydrophobicContact CD1-CE1 4.34Å; L163-F194 HydrophobicContact CD1-CE2 4.47Å; L163-F194 HydrophobicContact CD1-CG 4.02Å; L163-F194 HydrophobicContact CD2-CD1 4.1Å; L163-F194 HydrophobicContact CD2-CE1 4.35Å; L163-F194 HydrophobicContact CG-CD1 4.35Å; L163-F194 HydrophobicContact CG-CE1 4.35Å; L163-Y203 WeakPolarHBondContact CD2-O 3.36Å
164	T	94.7	Very high	93.8	Very high	93 Å²	93	54 Å²	54	57%	0.571	29%	0.285	S	S	*	.			trans	-95.4	144.8	177.5	61.1	0	0	0	0	110.4	A148 E162 M205	A148-T164 HydrophobicContact CB-CG2 4.11Å; E162-T164 HydrophobicContact CG-CG2 4.36Å; T164-M205 WeakPolarHBondContact O-CE 3.24Å
165	G	91.5	Very high	94.2	Very high	25 Å²	25	52 Å²	52	26%	0.258	27%	0.272	S	S	.	.			trans	172	-35.1	-178.9	0	0	0	0	0	114.6
166	H	95.5	Very high	94.5	Very high	7 Å²	7	45.3 Å²	45.3	3%	0.032	24%	0.236	C	C	.	.			trans	-87.5	157.9	177.3	-71	-64.2	0	0	0	112.4	A147 V170 T184 S186 D188 K190 C192	A147-H166 HydrophobicContact CB-CB 4.19Å; A147-H166 WeakPolarHBondContact CB-O 3.44Å; H166-V170 HydrophobicContact CB-CG2 4.05Å; H166-T184 PolarHBondContact CD2-OG1 3.23Å; H166-T184 PolarHBondContact NE2-O 3.37Å; H166-T184 PolarHBondContact NE2-OG1 3.3Å; H166-S186 WeakPolarHBondContact ND1-CB 3.46Å; H166-D188 WeakPolarHBondContact CA-OD2 3.46Å; H166-D188 WeakPolarHBondContact CB-OD2 3.44Å; H166-D188 IonicContact CG-OD2 3.81Å; H166-D188 IonicContact ND1-OD1 2.84Å; H166-D188 PolarHBondContact ND1-OD1 3.39Å; H166-D188 IonicContact ND1-OD2 3.23Å; H166-D188 PolarHBondContact ND1-OD2 2.96Å; H166-D188 VanDerWaalsContact ND1-OD2 3.1Å; H166-K190 PolarHBondContact CE1-O 2.87Å; H166-K190 VanDerWaalsContact CE1-O 3.29Å; H166-C192 PolarHBondContact CE1-SG 2.89Å; H166-C192 PolarHBondContact NE2-SG 3.05Å; H166-C192 VanDerWaalsContact NE2-SG 3.39Å
167	R	95.9	Very high	94.7	Very high	165 Å²	165	42.9 Å²	42.9	62%	0.623	23%	0.23	S	C	*	.	S	Bend	trans	-106.8	-18.2	177.3	-63.7	-175.4	177.8	-173.4	-2.2	113.9	R143 P144 D188	R143-R167 CarbonylContact C-O 3.54Å; R143-R167 VanDerWaalsContact C-O 3.23Å; P144-R167 HydrophobicContact CB-CG 4.42Å; R167-D188 HydrophobicContact CB-CB 4.25Å; R167-D188 PolarHBondContact N-OD2 2.9Å
168	L	97.3	Very high	95.1	Very high	57 Å²	57	47.1 Å²	47.1	30%	0.298	25%	0.249	S	C	.	.	S	Bend	trans	-137.7	172.5	-177.9	-63.2	176.8	0	0	0	109.2	V170 S186 R187 D188	L168-V170 PolarHBondContact O-N 3.26Å; L168-S186 PolarHBondContact O-OG 2.83Å; L168-R187 HydrophobicContact CB-CB 3.91Å; L168-R187 HydrophobicContact CD1-CB 4.22Å; L168-D188 HydrophobicContact CB-CB 4.23Å; L168-D188 HydrophobicContact CD1-CB 4.37Å; L168-D188 HydrophobicContact CG-CB 4.31Å
169	T	98	Very high	95.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.231	C	C	.	.			trans	-41.2	124.8	-179.6	-47.8	0	0	0	0	112.9	F124 A141 T171 S186 R187	F124-T169 HydrophobicContact CB-CG2 3.66Å; F124-T169 HydrophobicContact CD1-CG2 3.49Å; F124-T169 VanDerWaalsContact CD1-CG2 3.49Å; F124-T169 HydrophobicContact CD2-CG2 3.68Å; F124-T169 HydrophobicContact CE1-CG2 4.05Å; F124-T169 HydrophobicContact CE2-CG2 4.19Å; F124-T169 HydrophobicContact CG-CG2 3.28Å; F124-T169 HydrophobicContact CZ-CG2 4.36Å; A141-T169 PolarHBondContact N-OG1 2.94Å; A141-T169 PolarHBondContact O-N 2.88Å; A141-T169 PolarHBondContact O-OG1 2.89Å; T169-T171 PolarHBondContact O-N 2.92Å; T169-S186 WeakPolarHBondContact O-CA 3.36Å; T169-S186 PolarHBondContact O-OG 3.15Å; T169-R187 PolarHBondContact O-N 3.29Å
170	V	98.2	Very high	95.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	119.3	167.3	-179.3	0	0	0	0	107.8	F124 A138 V149 H166 L168 R172 I173 V185	F124-V170 WeakPolarHBondContact CD1-O 3.28Å; A138-V170 HydrophobicContact CB-CB 3.67Å; A138-V170 HydrophobicContact CB-CG1 4.24Å; A138-V170 HydrophobicContact CB-CG2 4.22Å; V149-V170 HydrophobicContact CG2-CB 4.4Å; V149-V170 HydrophobicContact CG2-CG1 4.2Å; V149-V170 HydrophobicContact CG2-CG2 3.89Å; H166-V170 HydrophobicContact CB-CG2 4.05Å; L168-V170 PolarHBondContact O-N 3.26Å; V170-R172 WeakPolarHBondContact CG1-O 3.1Å; V170-I173 HydrophobicContact CG1-CG1 3.81Å; V170-V185 CarbonylContact C-O 3.56Å; V170-V185 VanDerWaalsContact CA-O 3.3Å; V170-V185 WeakPolarHBondContact CA-O 3.41Å; V170-V185 WeakPolarHBondContact CG1-O 3.2Å
171	T	97.3	Very high	95.5	Very high	13 Å²	13	40 Å²	40	8%	0.08	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-33.9	-173.4	58.7	0	0	0	0	112.9	F124 S125 T169 V185 R187 V219 I220 W221	F124-T171 HydrophobicContact CE1-CG2 4Å; S125-T171 PolarHBondContact OG-O 2.86Å; T169-T171 PolarHBondContact O-N 2.92Å; T171-V185 PolarHBondContact N-O 3.16Å; T171-V185 PolarHBondContact OG1-O 3.02Å; T171-R187 HydrophobicContact CG2-CG 3.69Å; T171-V219 HydrophobicContact CG2-CG1 4.45Å; T171-I220 PolarHBondContact OG1-O 2.88Å; T171-W221 VanDerWaalsContact CB-O 3.24Å; T171-W221 WeakPolarHBondContact CB-O 3.48Å; T171-W221 HydrophobicContact CG2-CE3 4.36Å; T171-W221 PolarHBondContact OG1-O 2.86Å
172	R	97.3	Very high	95.7	Very high	66 Å²	66	38.4 Å²	38.4	25%	0.249	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	144.9	174.1	-167.2	79	158.7	-176.3	-11.2	110.4	D11 S125 V170 T184 V185 D222	D11-R172 IonicContact OD1-CZ 3.22Å; D11-R172 IonicContact OD1-NH1 2.81Å; D11-R172 PolarHBondContact OD1-NH1 3.45Å; D11-R172 VanDerWaalsContact OD1-NH1 3.15Å; D11-R172 IonicContact OD1-NH2 3.44Å; D11-R172 PolarHBondContact OD1-NH2 2.92Å; D11-R172 IonicContact OD2-NH1 2.98Å; D11-R172 PolarHBondContact OD2-NH1 2.84Å; D11-R172 VanDerWaalsContact OD2-NH1 3.13Å; S125-R172 WeakPolarHBondContact OG-CA 3.13Å; V170-R172 WeakPolarHBondContact CG1-O 3.1Å; R172-T184 WeakPolarHBondContact O-CA 3.49Å; R172-V185 HydrophobicContact CB-CG2 3.62Å; R172-V185 PolarHBondContact O-N 3.02Å; R172-D222 WeakPolarHBondContact CD-OD1 3.47Å; R172-D222 WeakPolarHBondContact CG-OD1 3.36Å; R172-D222 IonicContact CZ-OD1 3.47Å; R172-D222 IonicContact NE-OD1 3.67Å; R172-D222 PolarHBondContact NE-OD1 3.48Å; R172-D222 VanDerWaalsContact NE-OD1 3.16Å
173	I	98.2	Very high	95.8	Very high	4 Å²	4	33 Å²	33	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.9	171.2	-55.6	164	0	0	0	106.5	S125 A127 A136 A138 V149 V170 L182 L183 T184	S125-I173 PolarHBondContact OG-N 2.9Å; A127-I173 HydrophobicContact CB-CB 3.95Å; A127-I173 HydrophobicContact CB-CG2 3.92Å; A127-I173 WeakPolarHBondContact CB-O 3.17Å; A136-I173 HydrophobicContact CB-CD1 4.28Å; A136-I173 HydrophobicContact CB-CG2 3.77Å; A138-I173 HydrophobicContact CB-CD1 3.96Å; V149-I173 HydrophobicContact CG1-CD1 3.78Å; V149-I173 HydrophobicContact CG1-CG1 4.41Å; V149-I173 HydrophobicContact CG2-CD1 4.41Å; V170-I173 HydrophobicContact CG1-CG1 3.81Å; I173-L182 HydrophobicContact CG2-CD1 3.51Å; I173-L182 HydrophobicContact CG2-CD2 4.42Å; I173-L182 HydrophobicContact CG2-CG 4.16Å; I173-L183 CarbonylContact C-O 3.55Å; I173-L183 WeakPolarHBondContact CA-O 3.17Å; I173-T184 HydrophobicContact CG1-CG2 4.37Å; I173-T184 HydrophobicContact CG2-CG2 4.25Å
174	A	97.3	Very high	95.9	Very high	16 Å²	16	32.5 Å²	32.5	13%	0.132	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	123.7	178.2	0	0	0	0	0	110.8	L183 W225	A174-L183 PolarHBondContact N-O 3.25Å; A174-L183 PolarHBondContact O-N 3.49Å; A174-W225 PolarHBondContact O-NE1 3.08Å
175	F	97.4	Very high	96	Very high	9 Å²	9	28 Å²	28	4%	0.039	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	146.2	169.3	-70.8	-90.3	0	0	0	109.8	A127 S128 N129 V134 A136 L181 L182 Y203 W225	A127-F175 HydrophobicContact CB-CD2 4.14Å; A127-F175 HydrophobicContact CB-CE2 4.14Å; S128-F175 VanDerWaalsContact C-CD2 3.44Å; S128-F175 VanDerWaalsContact O-CD2 3.28Å; S128-F175 WeakPolarHBondContact O-CD2 3.23Å; N129-F175 HydrophobicContact CB-CD1 3.8Å; N129-F175 HydrophobicContact CB-CD2 4.11Å; N129-F175 HydrophobicContact CB-CE1 3.87Å; N129-F175 HydrophobicContact CB-CE2 4.17Å; N129-F175 HydrophobicContact CB-CG 3.92Å; N129-F175 HydrophobicContact CB-CZ 4.06Å; V134-F175 HydrophobicContact CB-CZ 4.48Å; V134-F175 HydrophobicContact CG1-CZ 4.16Å; A136-F175 HydrophobicContact CB-CE2 3.85Å; A136-F175 HydrophobicContact CB-CZ 3.87Å; F175-L181 WeakPolarHBondContact CA-O 3.5Å; F175-L182 HydrophobicContact CD1-CD1 3.69Å; F175-L182 HydrophobicContact CD2-CD1 3.87Å; F175-L182 HydrophobicContact CE1-CD1 3.63Å; F175-L182 HydrophobicContact CE2-CD1 3.81Å; F175-L182 HydrophobicContact CG-CD1 3.83Å; F175-L182 HydrophobicContact CZ-CD1 3.69Å; F175-Y203 HydrophobicContact CE1-CE2 4.5Å; F175-Y203 AromaticContact CE1-CZ 3.97Å; F175-Y203 WeakPolarHBondContact CE1-OH 3.36Å; F175-W225 PolarHBondContact O-NE1 2.94Å
176	S	94.9	Very high	96.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.			trans	-66.4	158.3	168.8	57.4	0	0	0	0	110.5	H130 D178 D179 S180 L181	H130-S176 PolarHBondContact CD2-O 3.39Å; H130-S176 VanDerWaalsContact CD2-O 3.26Å; S176-D178 WeakPolarHBondContact CB-OD1 3.24Å; S176-D178 PolarHBondContact O-N 3.37Å; S176-D178 PolarHBondContact OG-OD1 3.42Å; S176-D179 PolarHBondContact O-N 3.1Å; S176-S180 PolarHBondContact OG-N 2.78Å; S176-L181 PolarHBondContact N-O 2.76Å; S176-L181 WeakPolarHBondContact OG-CB 3.41Å; S176-L181 PolarHBondContact OG-N 3.37Å; S176-L181 PolarHBondContact OG-O 3.38Å
177	P	92.1	Very high	96.3	Very high	54 Å²	54	31.6 Å²	31.6	35%	0.351	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-24	-177.5	-27.4	35.4	0	0	0	115.3	A226	P177-A226 WeakPolarHBondContact CG-O 3.34Å
178	D	92	Very high	96.3	Very high	101 Å²	101	24.8 Å²	24.8	54%	0.54	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	7.9	179.5	67.4	-14.1	0	0	0	113.7	S176 S180	S176-D178 WeakPolarHBondContact CB-OD1 3.24Å; S176-D178 PolarHBondContact O-N 3.37Å; S176-D178 PolarHBondContact OG-OD1 3.42Å; D178-S180 PolarHBondContact O-N 3.2Å; D178-S180 PolarHBondContact OD1-N 2.87Å; D178-S180 VanDerWaalsContact OD1-N 3.12Å; D178-S180 WeakPolarHBondContact OD2-CB 3.45Å; D178-S180 PolarHBondContact OD2-OG 2.79Å
179	D	95	Very high	96.2	Very high	13 Å²	13	28.4 Å²	28.4	7%	0.07	14%	0.138	C	C	.	.	S	Bend	trans	55.1	15.6	-175.3	-64.1	-27	0	0	0	115.2	N129 H130 A131 S176 Y203	N129-D179 HydrophobicContact CB-CB 4.38Å; N129-D179 WeakPolarHBondContact CB-OD1 3.18Å; N129-D179 PolarHBondContact ND2-OD2 3.44Å; H130-D179 IonicContact CD2-OD1 3.94Å; H130-D179 PolarHBondContact CD2-OD1 3.01Å; H130-D179 VanDerWaalsContact CD2-OD1 3.26Å; H130-D179 IonicContact CG-OD1 2.75Å; H130-D179 VanDerWaalsContact N-CG 3.31Å; H130-D179 PolarHBondContact N-OD1 3.36Å; H130-D179 PolarHBondContact N-OD2 2.84Å; A131-D179 WeakPolarHBondContact CB-OD2 3.17Å; A131-D179 PolarHBondContact N-OD2 3.13Å; S176-D179 PolarHBondContact O-N 3.1Å; D179-Y203 PolarHBondContact O-OH 2.77Å
180	S	93.6	Very high	96	Very high	49 Å²	49	31 Å²	31	34%	0.343	15%	0.149	S	C	.	.	S	Bend	trans	-85.1	-19.2	-179.4	-67.2	0	0	0	0	113	S176 D178 K196	S176-S180 PolarHBondContact OG-N 2.78Å; D178-S180 PolarHBondContact O-N 3.2Å; D178-S180 PolarHBondContact OD1-N 2.87Å; D178-S180 VanDerWaalsContact OD1-N 3.12Å; D178-S180 WeakPolarHBondContact OD2-CB 3.45Å; D178-S180 PolarHBondContact OD2-OG 2.79Å; S180-K196 WeakPolarHBondContact O-CB 3.5Å; S180-K196 PolarHBondContact O-N 3.01Å
181	L	95.4	Very high	95.8	Very high	10 Å²	10	31 Å²	31	5%	0.052	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.1	-177.9	-56.1	168.5	0	0	0	110.9	F175 S176 L193 F194 R195 W225 F246 L248	F175-L181 WeakPolarHBondContact CA-O 3.5Å; S176-L181 PolarHBondContact N-O 2.76Å; S176-L181 WeakPolarHBondContact OG-CB 3.41Å; S176-L181 PolarHBondContact OG-N 3.37Å; S176-L181 PolarHBondContact OG-O 3.38Å; L181-L193 HydrophobicContact CB-CD1 4.16Å; L181-F194 CarbonylContact C-O 3.58Å; L181-F194 VanDerWaalsContact CA-O 3.24Å; L181-F194 WeakPolarHBondContact CA-O 3.39Å; L181-R195 HydrophobicContact CD2-CB 3.69Å; L181-R195 HydrophobicContact CD2-CG 3.92Å; L181-W225 HydrophobicContact CB-CH2 3.95Å; L181-W225 HydrophobicContact CB-CZ2 3.94Å; L181-W225 HydrophobicContact CD1-CH2 3.7Å; L181-W225 HydrophobicContact CD1-CZ3 4.27Å; L181-W225 HydrophobicContact CG-CH2 4.48Å; L181-F246 HydrophobicContact CD1-CE2 3.74Å; L181-F246 HydrophobicContact CD1-CZ 3.58Å; L181-L248 HydrophobicContact CD1-CD1 3.99Å; L181-L248 HydrophobicContact CD2-CD1 3.69Å; L181-L248 HydrophobicContact CG-CD1 4.41Å
182	L	96.8	Very high	95.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123	171.8	-174.4	73	0	0	0	109.1	L151 L163 I173 F175 T184 L193 F194 Y203	L151-L182 HydrophobicContact CD2-CD2 4.23Å; L163-L182 HydrophobicContact CD1-CD2 3.38Å; I173-L182 HydrophobicContact CG2-CD1 3.51Å; I173-L182 HydrophobicContact CG2-CD2 4.42Å; I173-L182 HydrophobicContact CG2-CG 4.16Å; F175-L182 HydrophobicContact CD1-CD1 3.69Å; F175-L182 HydrophobicContact CD2-CD1 3.87Å; F175-L182 HydrophobicContact CE1-CD1 3.63Å; F175-L182 HydrophobicContact CE2-CD1 3.81Å; F175-L182 HydrophobicContact CG-CD1 3.83Å; F175-L182 HydrophobicContact CZ-CD1 3.69Å; L182-T184 HydrophobicContact CD2-CG2 4.2Å; L182-T184 HydrophobicContact CG-CG2 4.22Å; L182-L193 WeakPolarHBondContact O-CA 3.39Å; L182-F194 HydrophobicContact CB-CB 4.23Å; L182-F194 HydrophobicContact CB-CD2 4.45Å; L182-F194 HydrophobicContact CD2-CD2 4.35Å; L182-F194 PolarHBondContact N-O 2.96Å; L182-F194 PolarHBondContact O-N 2.98Å; L182-Y203 HydrophobicContact CB-CD1 3.93Å; L182-Y203 HydrophobicContact CB-CE1 4.03Å
183	L	97.2	Very high	95.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.6	173.3	178.7	65.1	0	0	0	109.4	I173 A174 W191 C223 W225 F232	I173-L183 CarbonylContact C-O 3.55Å; I173-L183 WeakPolarHBondContact CA-O 3.17Å; A174-L183 PolarHBondContact N-O 3.25Å; A174-L183 PolarHBondContact O-N 3.49Å; L183-W191 HydrophobicContact CD1-CB 4.24Å; L183-W191 HydrophobicContact CD1-CD2 4.47Å; L183-W191 HydrophobicContact CD1-CE3 4.05Å; L183-C223 HydrophobicContact CD2-CB 3.65Å; L183-C223 HydrophobicContact CG-CB 4.34Å; L183-W225 HydrophobicContact CB-CZ2 3.74Å; L183-F232 HydrophobicContact CD1-CD2 4.04Å; L183-F232 HydrophobicContact CD1-CE1 4.39Å; L183-F232 HydrophobicContact CD1-CE2 3.75Å; L183-F232 HydrophobicContact CD1-CG 4.46Å; L183-F232 HydrophobicContact CD1-CZ 3.96Å; L183-F232 HydrophobicContact CD2-CB 3.81Å; L183-F232 HydrophobicContact CD2-CD1 4.32Å; L183-F232 HydrophobicContact CD2-CD2 3.39Å; L183-F232 HydrophobicContact CD2-CE2 3.99Å; L183-F232 HydrophobicContact CD2-CG 3.58Å; L183-F232 HydrophobicContact CG-CD2 4.38Å
184	T	97.8	Very high	95.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.4	174.5	65.5	0	0	0	0	109.6	V149 H166 R172 I173 L182 W191 C192 F194	V149-T184 HydrophobicContact CG2-CG2 3.95Å; H166-T184 PolarHBondContact CD2-OG1 3.23Å; H166-T184 PolarHBondContact NE2-O 3.37Å; H166-T184 PolarHBondContact NE2-OG1 3.3Å; R172-T184 WeakPolarHBondContact O-CA 3.49Å; I173-T184 HydrophobicContact CG1-CG2 4.37Å; I173-T184 HydrophobicContact CG2-CG2 4.25Å; L182-T184 HydrophobicContact CD2-CG2 4.2Å; L182-T184 HydrophobicContact CG-CG2 4.22Å; T184-W191 CarbonylContact O-C 3.51Å; T184-W191 WeakPolarHBondContact O-CA 3.3Å; T184-W191 WeakPolarHBondContact O-CB 3.5Å; T184-C192 PolarHBondContact N-O 2.81Å; T184-C192 PolarHBondContact O-N 3.26Å; T184-C192 WeakPolarHBondContact OG1-CB 3.46Å; T184-F194 HydrophobicContact CG2-CD2 4.35Å; T184-F194 HydrophobicContact CG2-CE2 3.91Å
185	V	96.9	Very high	95.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.1	178.2	-61.2	0	0	0	0	110.9	V170 T171 R172 W191 I220 C223 T234	V170-V185 CarbonylContact C-O 3.56Å; V170-V185 VanDerWaalsContact CA-O 3.3Å; V170-V185 WeakPolarHBondContact CA-O 3.41Å; V170-V185 WeakPolarHBondContact CG1-O 3.2Å; T171-V185 PolarHBondContact N-O 3.16Å; T171-V185 PolarHBondContact OG1-O 3.02Å; R172-V185 HydrophobicContact CB-CG2 3.62Å; R172-V185 PolarHBondContact O-N 3.02Å; V185-W191 HydrophobicContact CG1-CB 3.73Å; V185-I220 HydrophobicContact CB-CB 4.03Å; V185-I220 HydrophobicContact CB-CG2 3.64Å; V185-I220 HydrophobicContact CG1-CG2 3.91Å; V185-I220 HydrophobicContact CG2-CG2 4.01Å; V185-C223 HydrophobicContact CG1-CB 3.6Å; V185-C223 HydrophobicContact CG2-CB 4.14Å; V185-T234 HydrophobicContact CG1-CG2 4.03Å
186	S	97	Very high	95.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	162.3	-169.9	172.1	0	0	0	0	114.7	H166 L168 T169 D188 R189 K190 I220	H166-S186 WeakPolarHBondContact ND1-CB 3.46Å; L168-S186 PolarHBondContact O-OG 2.83Å; T169-S186 WeakPolarHBondContact O-CA 3.36Å; T169-S186 PolarHBondContact O-OG 3.15Å; S186-D188 VanDerWaalsContact CB-OD1 3.23Å; S186-D188 WeakPolarHBondContact CB-OD1 3.47Å; S186-D188 PolarHBondContact O-N 2.87Å; S186-D188 VanDerWaalsContact OG-CG 3.28Å; S186-D188 PolarHBondContact OG-N 3.12Å; S186-D188 VanDerWaalsContact OG-N 3.11Å; S186-D188 PolarHBondContact OG-OD1 3.01Å; S186-R189 PolarHBondContact O-N 3.14Å; S186-K190 PolarHBondContact N-O 2.85Å; S186-K190 VanDerWaalsContact N-O 3.09Å; S186-I220 PolarHBondContact O-N 3.43Å
187	R	97.1	Very high	94.8	Very high	106 Å²	106	35.4 Å²	35.4	40%	0.4	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.7	167.2	-64.1	179	65.7	-165.4	-1.2	113.9	L168 T169 T171 R189 V219	L168-R187 HydrophobicContact CB-CB 3.91Å; L168-R187 HydrophobicContact CD1-CB 4.22Å; T169-R187 PolarHBondContact O-N 3.29Å; T171-R187 HydrophobicContact CG2-CG 3.69Å; R187-R189 PolarHBondContact O-N 2.85Å; R187-V219 HydrophobicContact CB-CG1 4.3Å; R187-V219 HydrophobicContact CB-CG2 4.13Å; R187-V219 HydrophobicContact CG-CG1 3.89Å; R187-V219 HydrophobicContact CG-CG2 4.34Å
188	D	95.2	Very high	94.6	Very high	22 Å²	22	37.3 Å²	37.3	12%	0.118	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	2.2	172.3	70.8	11.4	0	0	0	113.7	H166 R167 L168 S186 K190	H166-D188 WeakPolarHBondContact CA-OD2 3.46Å; H166-D188 WeakPolarHBondContact CB-OD2 3.44Å; H166-D188 IonicContact CG-OD2 3.81Å; H166-D188 IonicContact ND1-OD1 2.84Å; H166-D188 PolarHBondContact ND1-OD1 3.39Å; H166-D188 IonicContact ND1-OD2 3.23Å; H166-D188 PolarHBondContact ND1-OD2 2.96Å; H166-D188 VanDerWaalsContact ND1-OD2 3.1Å; R167-D188 HydrophobicContact CB-CB 4.25Å; R167-D188 PolarHBondContact N-OD2 2.9Å; L168-D188 HydrophobicContact CB-CB 4.23Å; L168-D188 HydrophobicContact CD1-CB 4.37Å; L168-D188 HydrophobicContact CG-CB 4.31Å; S186-D188 VanDerWaalsContact CB-OD1 3.23Å; S186-D188 WeakPolarHBondContact CB-OD1 3.47Å; S186-D188 PolarHBondContact O-N 2.87Å; S186-D188 VanDerWaalsContact OG-CG 3.28Å; S186-D188 PolarHBondContact OG-N 3.12Å; S186-D188 VanDerWaalsContact OG-N 3.11Å; S186-D188 PolarHBondContact OG-OD1 3.01Å; D188-K190 PolarHBondContact O-N 3.34Å; D188-K190 WeakPolarHBondContact OD1-CA 3.12Å; D188-K190 VanDerWaalsContact OD1-CB 3.28Å; D188-K190 WeakPolarHBondContact OD1-CB 3.35Å; D188-K190 PolarHBondContact OD1-N 2.81Å
189	R	94.7	Very high	94.4	Very high	134 Å²	134	35 Å²	35	51%	0.506	18%	0.18	S	C	.	.	S	Bend	trans	73.2	10.5	176.6	-38.6	174.2	-162.9	174.3	10.8	113.2	S186 R187 T217	S186-R189 PolarHBondContact O-N 3.14Å; R187-R189 PolarHBondContact O-N 2.85Å; R189-T217 WeakPolarHBondContact CD-O 3.43Å; R189-T217 PolarHBondContact NH1-O 2.82Å; R189-T217 VanDerWaalsContact NH1-O 3.11Å
190	K	94.2	Very high	94.1	Very high	53 Å²	53	37.6 Å²	37.6	23%	0.23	19%	0.194	C	C	.	.			trans	-109.4	157.3	178.2	-56.3	-176.7	174.2	-170.3	0	109.8	H166 S186 D188 I208	H166-K190 PolarHBondContact CE1-O 2.87Å; H166-K190 VanDerWaalsContact CE1-O 3.29Å; S186-K190 PolarHBondContact N-O 2.85Å; S186-K190 VanDerWaalsContact N-O 3.09Å; D188-K190 PolarHBondContact O-N 3.34Å; D188-K190 WeakPolarHBondContact OD1-CA 3.12Å; D188-K190 VanDerWaalsContact OD1-CB 3.28Å; D188-K190 WeakPolarHBondContact OD1-CB 3.35Å; D188-K190 PolarHBondContact OD1-N 2.81Å; K190-I208 HydrophobicContact CB-CG2 4.38Å; K190-I208 HydrophobicContact CD-CG2 3.81Å
191	W	95.2	Very high	93.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.3	163.1	58.2	-101.9	0	0	0	108.5	L183 T184 V185 L193 L207 H209 I220 F232 T234 W244 L259	L183-W191 HydrophobicContact CD1-CB 4.24Å; L183-W191 HydrophobicContact CD1-CD2 4.47Å; L183-W191 HydrophobicContact CD1-CE3 4.05Å; T184-W191 CarbonylContact O-C 3.51Å; T184-W191 WeakPolarHBondContact O-CA 3.3Å; T184-W191 WeakPolarHBondContact O-CB 3.5Å; V185-W191 HydrophobicContact CG1-CB 3.73Å; W191-L193 HydrophobicContact CE3-CB 4.31Å; W191-L193 HydrophobicContact CZ3-CB 3.89Å; W191-L207 HydrophobicContact CH2-CD2 3.38Å; W191-L207 HydrophobicContact CH2-CG 4.21Å; W191-L207 HydrophobicContact CZ2-CD2 4.36Å; W191-L207 HydrophobicContact CZ3-CB 4.49Å; W191-L207 HydrophobicContact CZ3-CD2 3.78Å; W191-L207 HydrophobicContact CZ3-CG 4.18Å; W191-H209 HydrophobicContact CD2-CB 3.56Å; W191-H209 AromaticContact CE2-CG 3.56Å; W191-H209 HydrophobicContact CE3-CB 4.08Å; W191-H209 HydrophobicContact CG-CB 4.11Å; W191-H209 HydrophobicContact CH2-CB 3.86Å; W191-H209 HydrophobicContact CZ2-CB 3.31Å; W191-H209 AromaticContact CZ2-CG 3.49Å; W191-H209 VanDerWaalsContact CZ2-CG 3.49Å; W191-H209 AromaticContact CZ2-ND1 3.76Å; W191-H209 HydrophobicContact CZ3-CB 4.19Å; W191-H209 AromaticContact NE1-CD2 3.7Å; W191-H209 AromaticContact NE1-CG 3.6Å; W191-H209 PolarHBondContact O-N 3.12Å; W191-I220 HydrophobicContact CB-CD1 4.31Å; W191-F232 HydrophobicContact CD2-CE2 4.06Å; W191-F232 AromaticContact CD2-CZ 3.92Å; W191-F232 HydrophobicContact CD2-CZ 3.92Å; W191-F232 AromaticContact CE2-CZ 3.85Å; W191-F232 HydrophobicContact CE3-CE2 4.29Å; W191-F232 AromaticContact CE3-CZ 3.78Å; W191-F232 HydrophobicContact CE3-CZ 3.78Å; W191-F232 HydrophobicContact CG-CE2 4.48Å; W191-F232 HydrophobicContact CH2-CE1 4.34Å; W191-F232 AromaticContact CH2-CZ 3.58Å; W191-F232 HydrophobicContact CH2-CZ 3.58Å; W191-F232 HydrophobicContact CZ2-CE2 4.3Å; W191-F232 AromaticContact CZ2-CZ 3.7Å; W191-F232 HydrophobicContact CZ2-CZ 3.7Å; W191-F232 HydrophobicContact CZ3-CE1 4.34Å; W191-F232 AromaticContact CZ3-CZ 3.63Å; W191-F232 HydrophobicContact CZ3-CZ 3.63Å; W191-T234 HydrophobicContact CG-CG2 4.41Å; W191-W244 AromaticContact CD1-CZ2 3.9Å; W191-W244 AromaticContact CE2-CD2 3.92Å; W191-W244 AromaticContact CE2-CE3 3.91Å; W191-W244 AromaticContact CZ2-CD2 3.82Å; W191-W244 HydrophobicContact CZ2-CD2 3.82Å; W191-W244 AromaticContact CZ2-CE3 3.5Å; W191-W244 HydrophobicContact CZ2-CE3 3.5Å; W191-W244 VanDerWaalsContact CZ2-CE3 3.5Å; W191-W244 HydrophobicContact CZ2-CG 4.35Å; W191-W244 AromaticContact CZ2-CZ3 3.89Å; W191-W244 HydrophobicContact CZ2-CZ3 3.89Å; W191-W244 AromaticContact NE1-CD2 3.6Å; W191-W244 AromaticContact NE1-CE2 3.31Å; W191-W244 VanDerWaalsContact NE1-CE2 3.31Å; W191-W244 AromaticContact NE1-CE3 3.74Å; W191-W244 AromaticContact NE1-CH2 3.37Å; W191-W244 AromaticContact NE1-CZ2 3.2Å; W191-W244 AromaticContact NE1-CZ3 3.64Å; W191-W244 AromaticContact NE1-NE1 3.99Å; W191-L259 HydrophobicContact CH2-CD1 4.15Å; W191-L259 HydrophobicContact CH2-CD2 4.35Å; W191-L259 HydrophobicContact CZ2-CD1 4.23Å; W191-L259 HydrophobicContact CZ2-CD2 4.12Å
192	C	95.4	Very high	93.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	141.9	172.1	-57.2	0	0	0	0	108.9	H166 T184 F194 M205 L207	H166-C192 PolarHBondContact CE1-SG 2.89Å; H166-C192 PolarHBondContact NE2-SG 3.05Å; H166-C192 VanDerWaalsContact NE2-SG 3.39Å; T184-C192 PolarHBondContact N-O 2.81Å; T184-C192 PolarHBondContact O-N 3.26Å; T184-C192 WeakPolarHBondContact OG1-CB 3.46Å; C192-F194 HydrophobicContact CB-CD2 4.38Å; C192-F194 HydrophobicContact CB-CE2 3.54Å; C192-F194 HydrophobicContact CB-CZ 3.79Å; C192-M205 HydrophobicContact CB-CE 4.26Å; C192-L207 WeakPolarHBondContact CA-O 3.46Å
193	L	95.4	Very high	93.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	126.9	173	-175.5	70.4	0	0	0	108.4	L181 L182 W191 V206 L207 W225 F246 L248 V256	L181-L193 HydrophobicContact CB-CD1 4.16Å; L182-L193 WeakPolarHBondContact O-CA 3.39Å; W191-L193 HydrophobicContact CE3-CB 4.31Å; W191-L193 HydrophobicContact CZ3-CB 3.89Å; L193-V206 WeakPolarHBondContact O-CB 3.49Å; L193-V206 PolarHBondContact O-N 3.28Å; L193-L207 PolarHBondContact N-O 2.84Å; L193-L207 PolarHBondContact O-N 2.86Å; L193-W225 HydrophobicContact CD1-CH2 3.73Å; L193-W225 HydrophobicContact CD1-CZ2 3.73Å; L193-F246 HydrophobicContact CD2-CD2 4.19Å; L193-F246 HydrophobicContact CD2-CE2 4.05Å; L193-F246 HydrophobicContact CD2-CZ 4.37Å; L193-L248 HydrophobicContact CD2-CD2 4.44Å; L193-V256 HydrophobicContact CD2-CG2 4.26Å
194	F	95.2	Very high	93.2	Very high	3 Å²	3	42.2 Å²	42.2	1%	0.013	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	147.4	176.1	-50.3	-101	0	0	0	109.8	L163 L181 L182 T184 C192 Y203 A204 M205	L163-F194 HydrophobicContact CB-CD1 4.18Å; L163-F194 HydrophobicContact CB-CE1 3.69Å; L163-F194 HydrophobicContact CB-CE2 4.47Å; L163-F194 HydrophobicContact CB-CZ 3.86Å; L163-F194 HydrophobicContact CD1-CD1 4.06Å; L163-F194 HydrophobicContact CD1-CD2 4.21Å; L163-F194 HydrophobicContact CD1-CE1 4.34Å; L163-F194 HydrophobicContact CD1-CE2 4.47Å; L163-F194 HydrophobicContact CD1-CG 4.02Å; L163-F194 HydrophobicContact CD2-CD1 4.1Å; L163-F194 HydrophobicContact CD2-CE1 4.35Å; L163-F194 HydrophobicContact CG-CD1 4.35Å; L163-F194 HydrophobicContact CG-CE1 4.35Å; L181-F194 CarbonylContact C-O 3.58Å; L181-F194 VanDerWaalsContact CA-O 3.24Å; L181-F194 WeakPolarHBondContact CA-O 3.39Å; L182-F194 HydrophobicContact CB-CB 4.23Å; L182-F194 HydrophobicContact CB-CD2 4.45Å; L182-F194 HydrophobicContact CD2-CD2 4.35Å; L182-F194 PolarHBondContact N-O 2.96Å; L182-F194 PolarHBondContact O-N 2.98Å; T184-F194 HydrophobicContact CG2-CD2 4.35Å; T184-F194 HydrophobicContact CG2-CE2 3.91Å; C192-F194 HydrophobicContact CB-CD2 4.38Å; C192-F194 HydrophobicContact CB-CE2 3.54Å; C192-F194 HydrophobicContact CB-CZ 3.79Å; F194-Y203 HydrophobicContact CB-CD1 4.28Å; F194-A204 CarbonylContact C-O 3.59Å; F194-A204 VanDerWaalsContact CA-O 3.23Å; F194-A204 WeakPolarHBondContact CA-O 3.23Å; F194-M205 VanDerWaalsContact CD1-CA 3.5Å; F194-M205 HydrophobicContact CD1-CB 3.71Å; F194-M205 HydrophobicContact CD1-CG 4.33Å; F194-M205 HydrophobicContact CE1-CB 3.73Å; F194-M205 HydrophobicContact CE1-CE 3.59Å; F194-M205 HydrophobicContact CE1-CG 4.14Å; F194-M205 HydrophobicContact CZ-CE 3.71Å
195	R	93.8	Very high	92.9	Very high	66 Å²	66	45.4 Å²	45.4	25%	0.249	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.4	178.8	176.9	-179.1	-177.7	175.7	4.3	110.3	L181 Q197 Y203 A204 V206 S249 P254	L181-R195 HydrophobicContact CD2-CB 3.69Å; L181-R195 HydrophobicContact CD2-CG 3.92Å; R195-Q197 PolarHBondContact O-N 2.89Å; R195-Q197 PolarHBondContact O-NE2 3.13Å; R195-Y203 WeakPolarHBondContact O-CA 3.45Å; R195-A204 PolarHBondContact N-O 3.17Å; R195-A204 PolarHBondContact O-N 2.83Å; R195-V206 HydrophobicContact CB-CG2 3.36Å; R195-S249 PolarHBondContact NH1-O 2.95Å; R195-P254 HydrophobicContact CB-CB 4.4Å
196	K	93.2	Very high	92.5	Very high	54 Å²	54	46.2 Å²	46.2	24%	0.235	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	124.4	172.3	-165.4	175.6	-177.5	175.2	0	109.7	S180 G199 D200 D202 Y203	S180-K196 WeakPolarHBondContact O-CB 3.5Å; S180-K196 PolarHBondContact O-N 3.01Å; K196-G199 WeakPolarHBondContact CE-O 3.48Å; K196-D200 IonicContact NZ-OD1 3.9Å; K196-D200 PolarHBondContact NZ-OD1 2.95Å; K196-D202 CarbonylContact C-O 3.52Å; K196-D202 VanDerWaalsContact CA-O 3.3Å; K196-D202 WeakPolarHBondContact CA-O 3.22Å; K196-Y203 HydrophobicContact CB-CD1 4.15Å; K196-Y203 HydrophobicContact CB-CE1 3.78Å; K196-Y203 HydrophobicContact CB-CE2 4.45Å; K196-Y203 HydrophobicContact CG-CE1 4.42Å; K196-Y203 HydrophobicContact CG-CE2 4.25Å
197	Q	88.3	Confident	91.9	Very high	77 Å²	77	48.2 Å²	48.2	36%	0.36	25%	0.248	S	C	.	.			trans	-101.8	-75.5	-179.5	-58.4	-58	-51.6	0	0	110.2	R195 D202 A204	R195-Q197 PolarHBondContact O-N 2.89Å; R195-Q197 PolarHBondContact O-NE2 3.13Å; Q197-D202 WeakPolarHBondContact CB-OD2 3.35Å; Q197-D202 PolarHBondContact N-O 2.76Å; Q197-A204 HydrophobicContact CG-CB 3.61Å
198	S	87.1	Confident	91	Very high	93 Å²	93	46.2 Å²	46.2	65%	0.65	24%	0.244	S	C	*	.	S	Bend	trans	-131.1	117.9	-176.2	-63.7	0	0	0	0	112.3	D202	S198-D202 PolarHBondContact N-OD2 3.1Å; S198-D202 WeakPolarHBondContact O-CB 3.4Å
199	G	88.5	Confident	90.2	Very high	53 Å²	53	45.7 Å²	45.7	55%	0.546	24%	0.241	S	C	.	.	S	Bend	trans	75.2	-177.7	-178.3	0	0	0	0	0	113.5	K196 F201	K196-G199 WeakPolarHBondContact CE-O 3.48Å; G199-F201 PolarHBondContact O-N 3.45Å
200	D	87.3	Confident	88.7	Confident	68 Å²	68	42.7 Å²	42.7	36%	0.364	24%	0.241	S	C	.	.	S	Bend	trans	-75.7	-20.5	-166.4	-72.5	-29.4	0	0	0	115.6	V134 K196 Y203	V134-D200 HydrophobicContact CG2-CB 4.09Å; V134-D200 WeakPolarHBondContact CG2-O 3.01Å; K196-D200 IonicContact NZ-OD1 3.9Å; K196-D200 PolarHBondContact NZ-OD1 2.95Å; D200-Y203 WeakPolarHBondContact O-CE2 3.43Å
201	F	90	Very high	87.3	Confident	46 Å²	46	43.1 Å²	43.1	20%	0.202	25%	0.25	C	C	.	.	S	Bend	trans	-115.7	-5.1	-171	-46.9	-71.8	0	0	0	114.2	V134 L151 K160 S161 G199 Y203	V134-F201 HydrophobicContact CB-CE1 4.48Å; V134-F201 HydrophobicContact CG1-CD1 4.19Å; V134-F201 HydrophobicContact CG1-CE1 4.4Å; V134-F201 HydrophobicContact CG2-CD1 3.95Å; V134-F201 HydrophobicContact CG2-CE1 3.76Å; L151-F201 WeakPolarHBondContact CD1-O 3.21Å; K160-F201 HydrophobicContact CB-CB 3.76Å; K160-F201 HydrophobicContact CB-CD1 3.89Å; K160-F201 HydrophobicContact CB-CD2 4.15Å; K160-F201 HydrophobicContact CB-CG 3.64Å; K160-F201 HydrophobicContact CD-CD2 4.23Å; K160-F201 HydrophobicContact CD-CE2 4.39Å; K160-F201 HydrophobicContact CG-CB 4.47Å; K160-F201 HydrophobicContact CG-CD1 3.92Å; K160-F201 HydrophobicContact CG-CD2 3.95Å; K160-F201 HydrophobicContact CG-CE1 4.14Å; K160-F201 HydrophobicContact CG-CE2 4.17Å; K160-F201 HydrophobicContact CG-CG 3.83Å; K160-F201 HydrophobicContact CG-CZ 4.27Å; S161-F201 VanDerWaalsContact CB-O 3.27Å; S161-F201 WeakPolarHBondContact CB-O 3.39Å; G199-F201 PolarHBondContact O-N 3.45Å; F201-Y203 PolarHBondContact O-N 3.38Å
202	D	90.8	Very high	85.6	Confident	71 Å²	71	49.8 Å²	49.8	38%	0.38	29%	0.291	S	S	.	.			trans	-90.2	92.6	-176.2	-173.5	14.8	0	0	0	110.5	K196 Q197 S198	K196-D202 CarbonylContact C-O 3.52Å; K196-D202 VanDerWaalsContact CA-O 3.3Å; K196-D202 WeakPolarHBondContact CA-O 3.22Å; Q197-D202 WeakPolarHBondContact CB-OD2 3.35Å; Q197-D202 PolarHBondContact N-O 2.76Å; S198-D202 PolarHBondContact N-OD2 3.1Å; S198-D202 WeakPolarHBondContact O-CB 3.4Å
203	Y	92.8	Very high	84.3	Confident	8 Å²	8	58.9 Å²	58.9	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	117.4	175.3	-76	-101.5	0	0	0	109.5	L151 L163 F175 D179 L182 F194 R195 K196 D200 F201	L151-Y203 HydrophobicContact CD1-CD2 3.41Å; L151-Y203 VanDerWaalsContact CD1-CD2 3.41Å; L151-Y203 HydrophobicContact CD1-CE2 3.98Å; L151-Y203 HydrophobicContact CD1-CG 4.17Å; L163-Y203 WeakPolarHBondContact CD2-O 3.36Å; F175-Y203 HydrophobicContact CE1-CE2 4.5Å; F175-Y203 AromaticContact CE1-CZ 3.97Å; F175-Y203 WeakPolarHBondContact CE1-OH 3.36Å; D179-Y203 PolarHBondContact O-OH 2.77Å; L182-Y203 HydrophobicContact CB-CD1 3.93Å; L182-Y203 HydrophobicContact CB-CE1 4.03Å; F194-Y203 HydrophobicContact CB-CD1 4.28Å; R195-Y203 WeakPolarHBondContact O-CA 3.45Å; K196-Y203 HydrophobicContact CB-CD1 4.15Å; K196-Y203 HydrophobicContact CB-CE1 3.78Å; K196-Y203 HydrophobicContact CB-CE2 4.45Å; K196-Y203 HydrophobicContact CG-CE1 4.42Å; K196-Y203 HydrophobicContact CG-CE2 4.25Å; D200-Y203 WeakPolarHBondContact O-CE2 3.43Å; F201-Y203 PolarHBondContact O-N 3.38Å
204	A	91.5	Very high	83.2	Confident	31 Å²	31	61.4 Å²	61.4	26%	0.256	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.4	174.7	0	0	0	0	0	110.2	F194 R195 Q197 V206 P254	F194-A204 CarbonylContact C-O 3.59Å; F194-A204 VanDerWaalsContact CA-O 3.23Å; F194-A204 WeakPolarHBondContact CA-O 3.23Å; R195-A204 PolarHBondContact N-O 3.17Å; R195-A204 PolarHBondContact O-N 2.83Å; Q197-A204 HydrophobicContact CG-CB 3.61Å; A204-V206 PolarHBondContact O-N 2.87Å; A204-P254 HydrophobicContact CB-CG 4.08Å
205	M	90.8	Very high	82.6	Confident	66 Å²	66	62.5 Å²	62.5	33%	0.325	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	125.9	175.7	-178.9	-176.8	-80.7	0	0	111	T164 C192 F194 I208	T164-M205 WeakPolarHBondContact O-CE 3.24Å; C192-M205 HydrophobicContact CB-CE 4.26Å; F194-M205 VanDerWaalsContact CD1-CA 3.5Å; F194-M205 HydrophobicContact CD1-CB 3.71Å; F194-M205 HydrophobicContact CD1-CG 4.33Å; F194-M205 HydrophobicContact CE1-CB 3.73Å; F194-M205 HydrophobicContact CE1-CE 3.59Å; F194-M205 HydrophobicContact CE1-CG 4.14Å; F194-M205 HydrophobicContact CZ-CE 3.71Å; M205-I208 HydrophobicContact CE-CD1 3.81Å; M205-I208 HydrophobicContact CE-CG1 3.75Å; M205-I208 HydrophobicContact CG-CG1 4.26Å; M205-I208 HydrophobicContact SD-CD1 3.41Å; M205-I208 WeakPolarHBondContact SD-CD1 2.91Å; M205-I208 HydrophobicContact SD-CG1 3.2Å; M205-I208 WeakPolarHBondContact SD-CG1 3.33Å
206	V	88	Confident	82.5	Confident	17 Å²	17	59.7 Å²	59.7	10%	0.103	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-42.2	179	-168.3	0	0	0	0	111.1	L193 R195 A204 L248 P254 V256	L193-V206 WeakPolarHBondContact O-CB 3.49Å; L193-V206 PolarHBondContact O-N 3.28Å; R195-V206 HydrophobicContact CB-CG2 3.36Å; A204-V206 PolarHBondContact O-N 2.87Å; V206-L248 HydrophobicContact CG1-CD2 3.81Å; V206-P254 HydrophobicContact CB-CB 4.36Å; V206-P254 HydrophobicContact CG1-CB 4.16Å; V206-P254 WeakPolarHBondContact CG1-O 3.13Å; V206-P254 HydrophobicContact CG2-CB 3.83Å; V206-V256 HydrophobicContact CG1-CG2 3.81Å
207	L	85.3	Confident	82.5	Confident	43 Å²	43	61 Å²	61	23%	0.225	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	132.3	-171.8	-178.5	63	0	0	0	111.1	W191 C192 L193 V256 L259	W191-L207 HydrophobicContact CH2-CD2 3.38Å; W191-L207 HydrophobicContact CH2-CG 4.21Å; W191-L207 HydrophobicContact CZ2-CD2 4.36Å; W191-L207 HydrophobicContact CZ3-CB 4.49Å; W191-L207 HydrophobicContact CZ3-CD2 3.78Å; W191-L207 HydrophobicContact CZ3-CG 4.18Å; C192-L207 WeakPolarHBondContact CA-O 3.46Å; L193-L207 PolarHBondContact N-O 2.84Å; L193-L207 PolarHBondContact O-N 2.86Å; L207-V256 HydrophobicContact CB-CG2 3.84Å; L207-V256 HydrophobicContact CD2-CB 3.95Å; L207-V256 HydrophobicContact CD2-CG1 4.22Å; L207-V256 HydrophobicContact CD2-CG2 3.72Å; L207-V256 HydrophobicContact CG-CG2 4.37Å; L207-L259 HydrophobicContact CD2-CD2 4.32Å
208	I	79.1	Confident	82.8	Confident	64 Å²	64	63.5 Å²	63.5	33%	0.328	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.3	159.9	-52	179.7	0	0	0	106.9	K190 M205 S210	K190-I208 HydrophobicContact CB-CG2 4.38Å; K190-I208 HydrophobicContact CD-CG2 3.81Å; M205-I208 HydrophobicContact CE-CD1 3.81Å; M205-I208 HydrophobicContact CE-CG1 3.75Å; M205-I208 HydrophobicContact CG-CG1 4.26Å; M205-I208 HydrophobicContact SD-CD1 3.41Å; M205-I208 WeakPolarHBondContact SD-CD1 2.91Å; M205-I208 HydrophobicContact SD-CG1 3.2Å; M205-I208 WeakPolarHBondContact SD-CG1 3.33Å; I208-S210 PolarHBondContact O-N 3.21Å
209	H	77.2	Confident	83.2	Confident	11 Å²	11	60.1 Å²	60.1	5%	0.051	34%	0.339	C	S	.	.			trans	-78.5	116.5	-179.3	-167.7	75	0	0	0	111.5	W191 C211 W244 L259	W191-H209 HydrophobicContact CD2-CB 3.56Å; W191-H209 AromaticContact CE2-CG 3.56Å; W191-H209 HydrophobicContact CE3-CB 4.08Å; W191-H209 HydrophobicContact CG-CB 4.11Å; W191-H209 HydrophobicContact CH2-CB 3.86Å; W191-H209 HydrophobicContact CZ2-CB 3.31Å; W191-H209 AromaticContact CZ2-CG 3.49Å; W191-H209 VanDerWaalsContact CZ2-CG 3.49Å; W191-H209 AromaticContact CZ2-ND1 3.76Å; W191-H209 HydrophobicContact CZ3-CB 4.19Å; W191-H209 AromaticContact NE1-CD2 3.7Å; W191-H209 AromaticContact NE1-CG 3.6Å; W191-H209 PolarHBondContact O-N 3.12Å; H209-C211 WeakPolarHBondContact CE1-CB 3.47Å; H209-C211 WeakPolarHBondContact NE2-CB 3.27Å; H209-W244 AromaticContact CD2-CH2 3.43Å; H209-W244 VanDerWaalsContact CD2-CH2 3.43Å; H209-W244 WeakPolarHBondContact CD2-CH2 3.28Å; H209-W244 AromaticContact CD2-CZ3 3.52Å; H209-W244 AromaticContact CE1-CZ3 3.5Å; H209-W244 AromaticContact CG-CZ3 3.93Å; H209-W244 AromaticContact ND1-CZ3 3.92Å; H209-W244 AromaticContact NE2-CH2 3.43Å; H209-W244 WeakPolarHBondContact NE2-CH2 3.41Å; H209-W244 AromaticContact NE2-CZ3 3.27Å; H209-W244 VanDerWaalsContact NE2-CZ3 3.27Å; H209-W244 WeakPolarHBondContact NE2-CZ3 3.42Å; H209-L259 VanDerWaalsContact CE1-CD2 3.41Å; H209-L259 WeakPolarHBondContact CE1-CD2 2.94Å; H209-L259 VanDerWaalsContact ND1-CD2 3.25Å; H209-L259 WeakPolarHBondContact ND1-CD2 2.85Å
210	S	63.8	Low	83.5	Confident	71 Å²	71	57.6 Å²	57.6	50%	0.497	31%	0.313	S	S	.	.			trans	-130.5	13	177.6	-167	0	0	0	0	113	I208 T212	I208-S210 PolarHBondContact O-N 3.21Å; S210-T212 PolarHBondContact O-N 3.11Å
211	C	65.1	Low	83.9	Confident	62 Å²	62	58.2 Å²	58.2	42%	0.419	31%	0.31	S	S	.	.			trans	-61.3	129	-171.8	-174.2	0	0	0	0	111.6	H209 K213 S215	H209-C211 WeakPolarHBondContact CE1-CB 3.47Å; H209-C211 WeakPolarHBondContact NE2-CB 3.27Å; C211-K213 VanDerWaalsContact C-N 3.34Å; C211-K213 PolarHBondContact O-N 3.26Å; C211-S215 WeakPolarHBondContact O-CB 3.44Å; C211-S215 PolarHBondContact O-N 3.28Å
212	T	59.9	Low	84.1	Confident	142 Å²	142	56.2 Å²	56.2	87%	0.871	30%	0.302	S	S	*	.	S	Bend	trans	-69.6	-24.8	-173.2	46.1	0	0	0	0	114.5	S210	S210-T212 PolarHBondContact O-N 3.11Å
213	K	66.9	Low	84.3	Confident	191 Å²	191	53 Å²	53	83%	0.83	29%	0.285	S	S	*	.	S	Bend	trans	-82.3	-36.6	-174.8	-75.1	-173.7	177.5	179.6	0	114.2	C211	C211-K213 VanDerWaalsContact C-N 3.34Å; C211-K213 PolarHBondContact O-N 3.26Å
214	C	72.2	Confident	84.3	Confident	52 Å²	52	52.9 Å²	52.9	35%	0.351	29%	0.285	S	S	.	.	S	Bend	trans	-130.1	29.4	-172.4	-61.6	0	0	0	0	113.2	W244 T261	C214-W244 WeakPolarHBondContact O-CH2 2.99Å; C214-T261 HydrophobicContact CB-CG2 4.36Å
215	S	83	Confident	84.4	Confident	26 Å²	26	52.4 Å²	52.4	18%	0.182	28%	0.277	C	S	.	.	S	Bend	trans	-93.6	157.6	174.9	177	0	0	0	0	111.8	C211	C211-S215 WeakPolarHBondContact O-CB 3.44Å; C211-S215 PolarHBondContact O-N 3.28Å
216	H	91.6	Very high	84.2	Confident	7 Å²	7	49.2 Å²	49.2	3%	0.032	26%	0.261	C	S	.	.			trans	-66.5	136.8	173.3	-77	-63.2	0	0	0	111.7	I220 T234 S236 D238 R240 I242	H216-I220 HydrophobicContact CB-CD1 4.48Å; H216-I220 HydrophobicContact CB-CG1 4.05Å; H216-T234 PolarHBondContact CD2-OG1 2.8Å; H216-T234 PolarHBondContact NE2-OG1 3.39Å; H216-S236 WeakPolarHBondContact CE1-CB 3.08Å; H216-S236 WeakPolarHBondContact ND1-CB 3.38Å; H216-D238 WeakPolarHBondContact CA-OD2 3.46Å; H216-D238 IonicContact CE1-OD1 3.1Å; H216-D238 IonicContact CG-OD2 3.37Å; H216-D238 IonicContact ND1-OD1 3.69Å; H216-D238 PolarHBondContact ND1-OD1 3.06Å; H216-D238 IonicContact ND1-OD2 3.15Å; H216-D238 PolarHBondContact ND1-OD2 2.99Å; H216-R240 PolarHBondContact CE1-O 3.25Å; H216-I242 VanDerWaalsContact CE1-CD1 3.47Å; H216-I242 WeakPolarHBondContact CE1-CD1 3.08Å
217	T	92.9	Very high	84	Confident	81 Å²	81	50.8 Å²	50.8	50%	0.497	27%	0.272	S	S	.	.	S	Bend	trans	-89.6	-12.5	-178.1	62.7	0	0	0	0	112.9	R189 D238	R189-T217 WeakPolarHBondContact CD-O 3.43Å; R189-T217 PolarHBondContact NH1-O 2.82Å; R189-T217 VanDerWaalsContact NH1-O 3.11Å; T217-D238 PolarHBondContact N-OD2 2.79Å; T217-D238 WeakPolarHBondContact OG1-CB 3.4Å
218	R	95.2	Very high	83.9	Confident	130 Å²	130	51.7 Å²	51.7	49%	0.491	28%	0.281	S	S	.	.	S	Bend	trans	-135.3	177.8	177.4	-61.3	-174.7	172.5	-95.8	1.2	110.5	I220 S236 R237 D238	R218-I220 PolarHBondContact O-N 3.36Å; R218-S236 PolarHBondContact O-OG 3.38Å; R218-S236 VanDerWaalsContact O-OG 3.12Å; R218-R237 HydrophobicContact CB-CB 3.81Å; R218-R237 HydrophobicContact CB-CG 4.44Å; R218-D238 HydrophobicContact CB-CB 4.09Å; R218-D238 HydrophobicContact CG-CB 4.16Å
219	V	95.1	Very high	84.2	Confident	23 Å²	23	49.3 Å²	49.3	14%	0.139	27%	0.272	C	S	.	.			trans	-44.6	131.4	177.6	170.8	0	0	0	0	110.9	T171 R187 W221 S236 R237	T171-V219 HydrophobicContact CG2-CG1 4.45Å; R187-V219 HydrophobicContact CB-CG1 4.3Å; R187-V219 HydrophobicContact CB-CG2 4.13Å; R187-V219 HydrophobicContact CG-CG1 3.89Å; R187-V219 HydrophobicContact CG-CG2 4.34Å; V219-W221 HydrophobicContact CG1-CD2 3.86Å; V219-W221 HydrophobicContact CG1-CE3 3.75Å; V219-W221 HydrophobicContact CG1-CH2 4.02Å; V219-W221 HydrophobicContact CG1-CZ2 4.13Å; V219-W221 HydrophobicContact CG1-CZ3 3.83Å; V219-S236 WeakPolarHBondContact O-CA 3.48Å; V219-S236 WeakPolarHBondContact O-CB 3.5Å; V219-S236 PolarHBondContact O-OG 3.43Å; V219-R237 PolarHBondContact O-N 3.13Å
220	I	95.9	Very high	84.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127	165.6	-50.4	179.5	0	0	0	105.9	T171 V185 S186 W191 H216 R218 T234 A235	T171-I220 PolarHBondContact OG1-O 2.88Å; V185-I220 HydrophobicContact CB-CB 4.03Å; V185-I220 HydrophobicContact CB-CG2 3.64Å; V185-I220 HydrophobicContact CG1-CG2 3.91Å; V185-I220 HydrophobicContact CG2-CG2 4.01Å; S186-I220 PolarHBondContact O-N 3.43Å; W191-I220 HydrophobicContact CB-CD1 4.31Å; H216-I220 HydrophobicContact CB-CD1 4.48Å; H216-I220 HydrophobicContact CB-CG1 4.05Å; R218-I220 PolarHBondContact O-N 3.36Å; I220-T234 HydrophobicContact CG2-CG2 4.49Å; I220-A235 CarbonylContact C-O 3.54Å; I220-A235 WeakPolarHBondContact CA-O 2.87Å; I220-A235 VanDerWaalsContact CG2-O 3.26Å; I220-A235 WeakPolarHBondContact CG2-O 3.3Å
221	W	95	Very high	85.8	Confident	81 Å²	81	51.1 Å²	51.1	31%	0.307	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-46.2	179.7	-70.6	124.7	0	0	0	111.1	T171 V219 A235 S269 T271	T171-W221 VanDerWaalsContact CB-O 3.24Å; T171-W221 WeakPolarHBondContact CB-O 3.48Å; T171-W221 HydrophobicContact CG2-CE3 4.36Å; T171-W221 PolarHBondContact OG1-O 2.86Å; V219-W221 HydrophobicContact CG1-CD2 3.86Å; V219-W221 HydrophobicContact CG1-CE3 3.75Å; V219-W221 HydrophobicContact CG1-CH2 4.02Å; V219-W221 HydrophobicContact CG1-CZ2 4.13Å; V219-W221 HydrophobicContact CG1-CZ3 3.83Å; W221-A235 PolarHBondContact N-O 2.91Å; W221-S269 PolarHBondContact NE1-OG 3.28Å; W221-T271 WeakPolarHBondContact CB-O 3.16Å
222	D	94.9	Very high	87	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	161.1	-167.6	-162.6	13.6	0	0	0	112	R172 A235 A272 I273	R172-D222 WeakPolarHBondContact CD-OD1 3.47Å; R172-D222 WeakPolarHBondContact CG-OD1 3.36Å; R172-D222 IonicContact CZ-OD1 3.47Å; R172-D222 IonicContact NE-OD1 3.67Å; R172-D222 PolarHBondContact NE-OD1 3.48Å; R172-D222 VanDerWaalsContact NE-OD1 3.16Å; D222-A235 HydrophobicContact CB-CB 4.39Å; D222-A235 PolarHBondContact N-O 3.28Å; D222-A235 PolarHBondContact O-N 2.75Å; D222-A272 WeakPolarHBondContact OD2-CA 3.07Å; D222-I273 HydrophobicContact CB-CG2 4Å; D222-I273 PolarHBondContact OD2-N 2.88Å
223	C	94.8	Very high	88.5	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.02	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	148.6	175.4	62.5	0	0	0	0	111.7	L183 V185 F233 T234	L183-C223 HydrophobicContact CD2-CB 3.65Å; L183-C223 HydrophobicContact CG-CB 4.34Å; V185-C223 HydrophobicContact CG1-CB 3.6Å; V185-C223 HydrophobicContact CG2-CB 4.14Å; C223-F233 WeakPolarHBondContact CA-O 3.1Å; C223-F233 VanDerWaalsContact CB-O 3.29Å; C223-F233 WeakPolarHBondContact CB-O 3.42Å; C223-T234 HydrophobicContact CB-CG2 4.33Å
224	A	92.8	Very high	89.8	Confident	5 Å²	5	32.3 Å²	32.3	4%	0.041	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141.1	178.1	0	0	0	0	0	111.2	F232 F233 I273 V275	A224-F232 CarbonylContact O-C 3.53Å; A224-F232 WeakPolarHBondContact O-CA 3.31Å; A224-F232 WeakPolarHBondContact O-CB 3.48Å; A224-F233 PolarHBondContact N-O 3.03Å; A224-F233 VanDerWaalsContact N-O 3.07Å; A224-F233 PolarHBondContact O-N 3.18Å; A224-I273 HydrophobicContact CB-CG2 4.24Å; A224-I273 WeakPolarHBondContact CB-O 2.69Å; A224-V275 HydrophobicContact CB-CG2 3.99Å
225	W	92.3	Very high	90.8	Very high	21 Å²	21	29.9 Å²	29.9	8%	0.08	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	146.6	174.9	-78.9	99	0	0	0	111.1	A174 F175 L181 L183 L193 G229 F232 F246 V275	A174-W225 PolarHBondContact O-NE1 3.08Å; F175-W225 PolarHBondContact O-NE1 2.94Å; L181-W225 HydrophobicContact CB-CH2 3.95Å; L181-W225 HydrophobicContact CB-CZ2 3.94Å; L181-W225 HydrophobicContact CD1-CH2 3.7Å; L181-W225 HydrophobicContact CD1-CZ3 4.27Å; L181-W225 HydrophobicContact CG-CH2 4.48Å; L183-W225 HydrophobicContact CB-CZ2 3.74Å; L193-W225 HydrophobicContact CD1-CH2 3.73Å; L193-W225 HydrophobicContact CD1-CZ2 3.73Å; W225-G229 WeakPolarHBondContact CZ3-O 3.46Å; W225-F232 HydrophobicContact CD2-CB 4.06Å; W225-F232 HydrophobicContact CE3-CB 3.93Å; W225-F232 HydrophobicContact CE3-CD1 4.45Å; W225-F232 HydrophobicContact CH2-CD1 4.06Å; W225-F232 HydrophobicContact CZ3-CB 4.32Å; W225-F232 HydrophobicContact CZ3-CD1 4Å; W225-F246 AromaticContact CH2-CE1 3.93Å; W225-F246 HydrophobicContact CH2-CE1 3.93Å; W225-F246 AromaticContact CH2-CZ 3.72Å; W225-F246 HydrophobicContact CH2-CZ 3.72Å; W225-F246 AromaticContact CZ3-CE1 3.63Å; W225-F246 HydrophobicContact CZ3-CE1 3.63Å; W225-F246 AromaticContact CZ3-CZ 3.63Å; W225-F246 HydrophobicContact CZ3-CZ 3.63Å; W225-V275 WeakPolarHBondContact O-CG2 3.48Å
226	A	87.9	Confident	91.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.149	C	C	.	.			trans	-71.8	145.9	162	0	0	0	0	0	110.2	P177 C228 G229 F231	P177-A226 WeakPolarHBondContact CG-O 3.34Å; A226-C228 PolarHBondContact O-N 3.16Å; A226-G229 PolarHBondContact O-N 2.81Å; A226-F231 HydrophobicContact CB-CD1 3.85Å; A226-F231 HydrophobicContact CB-CD2 3.49Å; A226-F231 VanDerWaalsContact CB-CD2 3.49Å; A226-F231 HydrophobicContact CB-CE1 3.61Å; A226-F231 HydrophobicContact CB-CE2 3.21Å; A226-F231 HydrophobicContact CB-CG 3.78Å; A226-F231 HydrophobicContact CB-CZ 3.24Å; A226-F231 WeakPolarHBondContact CB-O 3.32Å; A226-F231 PolarHBondContact N-O 3.35Å
227	P	84	Confident	91.4	Very high	50 Å²	50	34.6 Å²	34.6	33%	0.325	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.7	176.8	-27.9	34.9	0	0	0	114.5	C278	P227-C278 HydrophobicContact CB-CB 4.23Å; P227-C278 HydrophobicContact CG-CB 4.36Å
228	C	81.6	Confident	91.4	Very high	62 Å²	62	31.5 Å²	31.5	42%	0.419	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-7.7	177.6	70.7	0	0	0	0	114.7	A226 N230 F231	A226-C228 PolarHBondContact O-N 3.16Å; C228-N230 PolarHBondContact O-N 3.47Å; C228-N230 VanDerWaalsContact O-N 3.08Å; C228-F231 WeakPolarHBondContact SG-CE1 3.25Å
229	G	86.8	Confident	91.3	Very high	13 Å²	13	29.4 Å²	29.4	13%	0.134	15%	0.146	C	C	.	.	S	Bend	trans	72.1	-8.1	-180	0	0	0	0	0	116.7	W225 A226	W225-G229 WeakPolarHBondContact CZ3-O 3.46Å; A226-G229 PolarHBondContact O-N 2.81Å
230	N	84.9	Confident	91.1	Very high	100 Å²	100	32.7 Å²	32.7	54%	0.535	16%	0.156	S	C	.	.	S	Bend	trans	-87.9	-7.2	-175.2	-66.7	-35.1	0	0	0	114.8	C228 F246	C228-N230 PolarHBondContact O-N 3.47Å; C228-N230 VanDerWaalsContact O-N 3.08Å; N230-F246 PolarHBondContact O-N 2.9Å
231	F	87.9	Confident	90.8	Very high	20 Å²	20	32.7 Å²	32.7	9%	0.088	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	162.9	175.5	61.1	-84.5	0	0	0	110.6	A226 C228 F233 W244 Q245 Y292	A226-F231 HydrophobicContact CB-CD1 3.85Å; A226-F231 HydrophobicContact CB-CD2 3.49Å; A226-F231 VanDerWaalsContact CB-CD2 3.49Å; A226-F231 HydrophobicContact CB-CE1 3.61Å; A226-F231 HydrophobicContact CB-CE2 3.21Å; A226-F231 HydrophobicContact CB-CG 3.78Å; A226-F231 HydrophobicContact CB-CZ 3.24Å; A226-F231 WeakPolarHBondContact CB-O 3.32Å; A226-F231 PolarHBondContact N-O 3.35Å; C228-F231 WeakPolarHBondContact SG-CE1 3.25Å; F231-F233 AromaticContact CD2-CE2 3.77Å; F231-F233 HydrophobicContact CD2-CE2 3.77Å; F231-F233 AromaticContact CD2-CZ 3.77Å; F231-F233 HydrophobicContact CD2-CZ 3.77Å; F231-F233 AromaticContact CE2-CE2 3.52Å; F231-F233 HydrophobicContact CE2-CE2 3.52Å; F231-F233 AromaticContact CE2-CZ 3.47Å; F231-F233 HydrophobicContact CE2-CZ 3.47Å; F231-F233 VanDerWaalsContact CE2-CZ 3.47Å; F231-W244 CarbonylContact C-O 3.5Å; F231-W244 WeakPolarHBondContact CA-O 3.33Å; F231-W244 WeakPolarHBondContact CB-O 3.45Å; F231-Q245 HydrophobicContact CB-CB 4.17Å; F231-Y292 HydrophobicContact CD2-CE1 4.49Å; F231-Y292 AromaticContact CE1-CE1 3.84Å; F231-Y292 HydrophobicContact CE1-CE1 3.84Å; F231-Y292 AromaticContact CE2-CD1 3.64Å; F231-Y292 HydrophobicContact CE2-CD1 3.64Å; F231-Y292 AromaticContact CE2-CE1 3.5Å; F231-Y292 HydrophobicContact CE2-CE1 3.5Å; F231-Y292 VanDerWaalsContact CE2-CE1 3.5Å; F231-Y292 HydrophobicContact CE2-CG 4.41Å; F231-Y292 AromaticContact CZ-CD1 3.72Å; F231-Y292 HydrophobicContact CZ-CD1 3.72Å; F231-Y292 AromaticContact CZ-CE1 3.12Å; F231-Y292 HydrophobicContact CZ-CE1 3.12Å; F231-Y292 AromaticContact CZ-CZ 3.77Å
232	F	91.8	Very high	90.5	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	169.7	175.5	59.8	-93.3	0	0	0	109.9	L183 W191 A224 W225 T234 W244 F246	L183-F232 HydrophobicContact CD1-CD2 4.04Å; L183-F232 HydrophobicContact CD1-CE1 4.39Å; L183-F232 HydrophobicContact CD1-CE2 3.75Å; L183-F232 HydrophobicContact CD1-CG 4.46Å; L183-F232 HydrophobicContact CD1-CZ 3.96Å; L183-F232 HydrophobicContact CD2-CB 3.81Å; L183-F232 HydrophobicContact CD2-CD1 4.32Å; L183-F232 HydrophobicContact CD2-CD2 3.39Å; L183-F232 HydrophobicContact CD2-CE2 3.99Å; L183-F232 HydrophobicContact CD2-CG 3.58Å; L183-F232 HydrophobicContact CG-CD2 4.38Å; W191-F232 HydrophobicContact CD2-CE2 4.06Å; W191-F232 AromaticContact CD2-CZ 3.92Å; W191-F232 HydrophobicContact CD2-CZ 3.92Å; W191-F232 AromaticContact CE2-CZ 3.85Å; W191-F232 HydrophobicContact CE3-CE2 4.29Å; W191-F232 AromaticContact CE3-CZ 3.78Å; W191-F232 HydrophobicContact CE3-CZ 3.78Å; W191-F232 HydrophobicContact CG-CE2 4.48Å; W191-F232 HydrophobicContact CH2-CE1 4.34Å; W191-F232 AromaticContact CH2-CZ 3.58Å; W191-F232 HydrophobicContact CH2-CZ 3.58Å; W191-F232 HydrophobicContact CZ2-CE2 4.3Å; W191-F232 AromaticContact CZ2-CZ 3.7Å; W191-F232 HydrophobicContact CZ2-CZ 3.7Å; W191-F232 HydrophobicContact CZ3-CE1 4.34Å; W191-F232 AromaticContact CZ3-CZ 3.63Å; W191-F232 HydrophobicContact CZ3-CZ 3.63Å; A224-F232 CarbonylContact O-C 3.53Å; A224-F232 WeakPolarHBondContact O-CA 3.31Å; A224-F232 WeakPolarHBondContact O-CB 3.48Å; W225-F232 HydrophobicContact CD2-CB 4.06Å; W225-F232 HydrophobicContact CE3-CB 3.93Å; W225-F232 HydrophobicContact CE3-CD1 4.45Å; W225-F232 HydrophobicContact CH2-CD1 4.06Å; W225-F232 HydrophobicContact CZ3-CB 4.32Å; W225-F232 HydrophobicContact CZ3-CD1 4Å; F232-T234 HydrophobicContact CD2-CG2 4.09Å; F232-T234 HydrophobicContact CE2-CG2 3.96Å; F232-W244 HydrophobicContact CD1-CB 4.26Å; F232-W244 HydrophobicContact CD2-CB 3.98Å; F232-W244 AromaticContact CD2-CD1 3.54Å; F232-W244 AromaticContact CD2-CG 3.99Å; F232-W244 HydrophobicContact CD2-CG 3.99Å; F232-W244 HydrophobicContact CE1-CB 3.85Å; F232-W244 HydrophobicContact CE2-CB 3.56Å; F232-W244 AromaticContact CE2-CD1 3.26Å; F232-W244 HydrophobicContact CE2-CD2 4.25Å; F232-W244 AromaticContact CE2-CG 3.42Å; F232-W244 HydrophobicContact CE2-CG 3.42Å; F232-W244 VanDerWaalsContact CE2-CG 3.42Å; F232-W244 AromaticContact CE2-NE1 3.98Å; F232-W244 HydrophobicContact CG-CB 4.31Å; F232-W244 HydrophobicContact CZ-CB 3.48Å; F232-W244 VanDerWaalsContact CZ-CB 3.48Å; F232-W244 HydrophobicContact CZ-CD2 4.49Å; F232-W244 AromaticContact CZ-CG 3.74Å; F232-W244 HydrophobicContact CZ-CG 3.74Å; F232-W244 PolarHBondContact N-O 3.29Å; F232-W244 VanDerWaalsContact N-O 3.09Å; F232-W244 PolarHBondContact O-N 3.11Å; F232-F246 AromaticContact CD1-CD1 3.96Å; F232-F246 HydrophobicContact CD1-CD1 3.96Å; F232-F246 AromaticContact CD1-CE1 3.69Å; F232-F246 HydrophobicContact CD1-CE1 3.69Å; F232-F246 AromaticContact CE1-CD1 3.73Å; F232-F246 HydrophobicContact CE1-CD1 3.73Å; F232-F246 AromaticContact CE1-CE1 3.84Å; F232-F246 HydrophobicContact CE1-CE1 3.84Å
233	F	91.7	Very high	90.3	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	147.5	177.6	-57.9	-88.6	0	0	0	110.8	C223 A224 F231 I242 A243 I273 V275 Y292 I296	C223-F233 WeakPolarHBondContact CA-O 3.1Å; C223-F233 VanDerWaalsContact CB-O 3.29Å; C223-F233 WeakPolarHBondContact CB-O 3.42Å; A224-F233 PolarHBondContact N-O 3.03Å; A224-F233 VanDerWaalsContact N-O 3.07Å; A224-F233 PolarHBondContact O-N 3.18Å; F231-F233 AromaticContact CD2-CE2 3.77Å; F231-F233 HydrophobicContact CD2-CE2 3.77Å; F231-F233 AromaticContact CD2-CZ 3.77Å; F231-F233 HydrophobicContact CD2-CZ 3.77Å; F231-F233 AromaticContact CE2-CE2 3.52Å; F231-F233 HydrophobicContact CE2-CE2 3.52Å; F231-F233 AromaticContact CE2-CZ 3.47Å; F231-F233 HydrophobicContact CE2-CZ 3.47Å; F231-F233 VanDerWaalsContact CE2-CZ 3.47Å; F233-I242 CarbonylContact C-O 3.56Å; F233-I242 VanDerWaalsContact CA-O 3.24Å; F233-I242 WeakPolarHBondContact CA-O 3.47Å; F233-A243 HydrophobicContact CD1-CB 3.64Å; F233-A243 HydrophobicContact CE1-CB 3.4Å; F233-A243 HydrophobicContact CZ-CB 4.4Å; F233-I273 HydrophobicContact CB-CD1 3.54Å; F233-I273 HydrophobicContact CB-CG1 4.26Å; F233-I273 HydrophobicContact CG-CD1 4.27Å; F233-V275 HydrophobicContact CD2-CG2 3.39Å; F233-V275 HydrophobicContact CE2-CG1 4.4Å; F233-V275 HydrophobicContact CE2-CG2 3.49Å; F233-V275 VanDerWaalsContact CE2-CG2 3.49Å; F233-Y292 HydrophobicContact CE1-CG 4.4Å; F233-Y292 HydrophobicContact CZ-CD1 4.09Å; F233-Y292 HydrophobicContact CZ-CG 4.04Å; F233-I296 HydrophobicContact CD1-CD1 3.55Å; F233-I296 HydrophobicContact CE1-CD1 3.51Å; F233-I296 HydrophobicContact CE2-CD1 4.5Å; F233-I296 HydrophobicContact CG-CD1 4.07Å; F233-I296 HydrophobicContact CZ-CD1 4.01Å
234	T	93.5	Very high	90	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.3	169.4	59.6	0	0	0	0	110	V185 W191 H216 I220 C223 F232 A241 I242 W244	V185-T234 HydrophobicContact CG1-CG2 4.03Å; W191-T234 HydrophobicContact CG-CG2 4.41Å; H216-T234 PolarHBondContact CD2-OG1 2.8Å; H216-T234 PolarHBondContact NE2-OG1 3.39Å; I220-T234 HydrophobicContact CG2-CG2 4.49Å; C223-T234 HydrophobicContact CB-CG2 4.33Å; F232-T234 HydrophobicContact CD2-CG2 4.09Å; F232-T234 HydrophobicContact CE2-CG2 3.96Å; T234-A241 CarbonylContact O-C 3.49Å; T234-A241 VanDerWaalsContact O-CA 3.23Å; T234-A241 WeakPolarHBondContact O-CA 3.38Å; T234-I242 PolarHBondContact N-O 2.78Å; T234-I242 PolarHBondContact O-N 2.73Å; T234-W244 PolarHBondContact OG1-NE1 2.8Å
235	A	92.5	Very high	89.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.4	-180	0	0	0	0	0	110.4	I220 W221 D222 V270 I273	I220-A235 CarbonylContact C-O 3.54Å; I220-A235 WeakPolarHBondContact CA-O 2.87Å; I220-A235 VanDerWaalsContact CG2-O 3.26Å; I220-A235 WeakPolarHBondContact CG2-O 3.3Å; W221-A235 PolarHBondContact N-O 2.91Å; D222-A235 HydrophobicContact CB-CB 4.39Å; D222-A235 PolarHBondContact N-O 3.28Å; D222-A235 PolarHBondContact O-N 2.75Å; A235-V270 HydrophobicContact CB-CB 3.81Å; A235-V270 HydrophobicContact CB-CG1 3.45Å; A235-V270 VanDerWaalsContact CB-CG1 3.45Å; A235-I273 HydrophobicContact CB-CB 3.87Å; A235-I273 HydrophobicContact CB-CD1 4.41Å; A235-I273 HydrophobicContact CB-CG2 3.73Å
236	S	93.9	Very high	89.5	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	158.3	-173.2	175.8	0	0	0	0	114.2	H216 R218 V219 D238 K239 R240 V270	H216-S236 WeakPolarHBondContact CE1-CB 3.08Å; H216-S236 WeakPolarHBondContact ND1-CB 3.38Å; R218-S236 PolarHBondContact O-OG 3.38Å; R218-S236 VanDerWaalsContact O-OG 3.12Å; V219-S236 WeakPolarHBondContact O-CA 3.48Å; V219-S236 WeakPolarHBondContact O-CB 3.5Å; V219-S236 PolarHBondContact O-OG 3.43Å; S236-D238 WeakPolarHBondContact CB-OD1 3.44Å; S236-D238 PolarHBondContact O-N 3.36Å; S236-D238 VanDerWaalsContact O-N 3.16Å; S236-D238 PolarHBondContact OG-N 2.92Å; S236-D238 PolarHBondContact OG-OD1 2.82Å; S236-K239 PolarHBondContact O-N 2.85Å; S236-K239 VanDerWaalsContact O-N 3.16Å; S236-R240 PolarHBondContact N-O 2.88Å; S236-R240 VanDerWaalsContact N-O 3.11Å; S236-V270 PolarHBondContact O-N 2.8Å
237	R	94.3	Very high	89.4	Confident	133 Å²	133	33.3 Å²	33.3	50%	0.502	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.5	168.5	-166.2	176.1	174.7	-177.9	1	114	R218 V219 K239 S269	R218-R237 HydrophobicContact CB-CB 3.81Å; R218-R237 HydrophobicContact CB-CG 4.44Å; V219-R237 PolarHBondContact O-N 3.13Å; R237-K239 PolarHBondContact O-N 3.12Å; R237-S269 WeakPolarHBondContact CA-OG 3.4Å
238	D	93.3	Very high	89.5	Confident	15 Å²	15	32.7 Å²	32.7	8%	0.08	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	8.4	175.1	70.4	3.4	0	0	0	114.2	H216 T217 R218 S236 R240	H216-D238 WeakPolarHBondContact CA-OD2 3.46Å; H216-D238 IonicContact CE1-OD1 3.1Å; H216-D238 IonicContact CG-OD2 3.37Å; H216-D238 IonicContact ND1-OD1 3.69Å; H216-D238 PolarHBondContact ND1-OD1 3.06Å; H216-D238 IonicContact ND1-OD2 3.15Å; H216-D238 PolarHBondContact ND1-OD2 2.99Å; T217-D238 PolarHBondContact N-OD2 2.79Å; T217-D238 WeakPolarHBondContact OG1-CB 3.4Å; R218-D238 HydrophobicContact CB-CB 4.09Å; R218-D238 HydrophobicContact CG-CB 4.16Å; S236-D238 WeakPolarHBondContact CB-OD1 3.44Å; S236-D238 PolarHBondContact O-N 3.36Å; S236-D238 VanDerWaalsContact O-N 3.16Å; S236-D238 PolarHBondContact OG-N 2.92Å; S236-D238 PolarHBondContact OG-OD1 2.82Å; D238-R240 PolarHBondContact O-N 2.91Å; D238-R240 VanDerWaalsContact OD1-CB 3.25Å; D238-R240 WeakPolarHBondContact OD1-CB 3.14Å; D238-R240 PolarHBondContact OD1-N 2.98Å
239	K	91.9	Very high	89.5	Confident	86 Å²	86	30.4 Å²	30.4	37%	0.374	15%	0.146	S	C	.	.	S	Bend	trans	69.5	20.4	179.7	-42.3	-177.9	170.8	-159.5	0	113	S236 R237 L265 F266 E267 D268	S236-K239 PolarHBondContact O-N 2.85Å; S236-K239 VanDerWaalsContact O-N 3.16Å; R237-K239 PolarHBondContact O-N 3.12Å; K239-L265 HydrophobicContact CB-CD1 4.2Å; K239-L265 CarbonylContact O-C 3.43Å; K239-F266 WeakPolarHBondContact CB-O 3.46Å; K239-F266 PolarHBondContact O-N 3.01Å; K239-E267 WeakPolarHBondContact CD-O 3.42Å; K239-E267 WeakPolarHBondContact CE-O 3.47Å; K239-E267 PolarHBondContact NZ-O 3Å; K239-D268 WeakPolarHBondContact CA-O 3.36Å; K239-D268 WeakPolarHBondContact CB-O 3.39Å; K239-D268 IonicContact NZ-OD1 3.9Å
240	R	90.4	Very high	88.8	Confident	93 Å²	93	37.1 Å²	37.1	35%	0.351	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.4	176.9	-58.2	175.4	176.1	179.4	-4	110.6	H216 S236 D238 I242 K264 L265	H216-R240 PolarHBondContact CE1-O 3.25Å; S236-R240 PolarHBondContact N-O 2.88Å; S236-R240 VanDerWaalsContact N-O 3.11Å; D238-R240 PolarHBondContact O-N 2.91Å; D238-R240 VanDerWaalsContact OD1-CB 3.25Å; D238-R240 WeakPolarHBondContact OD1-CB 3.14Å; D238-R240 PolarHBondContact OD1-N 2.98Å; R240-I242 HydrophobicContact CB-CG1 4.29Å; R240-K264 VanDerWaalsContact CA-O 3.3Å; R240-K264 WeakPolarHBondContact CA-O 3.03Å; R240-L265 HydrophobicContact CG-CD1 4.02Å
241	A	89.8	Confident	88.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129	154.5	0	0	0	0	0	108	T234 A263 K264 F266 I273	T234-A241 CarbonylContact O-C 3.49Å; T234-A241 VanDerWaalsContact O-CA 3.23Å; T234-A241 WeakPolarHBondContact O-CA 3.38Å; A241-A263 WeakPolarHBondContact O-CA 3.31Å; A241-K264 PolarHBondContact N-O 3.31Å; A241-K264 PolarHBondContact O-N 2.81Å; A241-F266 HydrophobicContact CB-CE2 3.56Å; A241-F266 HydrophobicContact CB-CZ 4.18Å; A241-I273 HydrophobicContact CB-CD1 3.99Å
242	I	89.3	Confident	87.3	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.015	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.2	-178.6	-55.8	178.9	0	0	0	108.5	H216 F233 T234 R240 W244 S262 A263	H216-I242 VanDerWaalsContact CE1-CD1 3.47Å; H216-I242 WeakPolarHBondContact CE1-CD1 3.08Å; F233-I242 CarbonylContact C-O 3.56Å; F233-I242 VanDerWaalsContact CA-O 3.24Å; F233-I242 WeakPolarHBondContact CA-O 3.47Å; T234-I242 PolarHBondContact N-O 2.78Å; T234-I242 PolarHBondContact O-N 2.73Å; R240-I242 HydrophobicContact CB-CG1 4.29Å; I242-W244 HydrophobicContact CB-CZ2 3.83Å; I242-W244 HydrophobicContact CD1-CH2 4.39Å; I242-W244 HydrophobicContact CD1-CZ2 3.91Å; I242-W244 HydrophobicContact CG1-CZ2 4.46Å; I242-W244 HydrophobicContact CG2-CD2 3.9Å; I242-W244 HydrophobicContact CG2-CE3 4.42Å; I242-W244 HydrophobicContact CG2-CG 4.41Å; I242-W244 HydrophobicContact CG2-CH2 4.1Å; I242-W244 HydrophobicContact CG2-CZ2 3.53Å; I242-W244 PolarHBondContact O-NE1 3.42Å; I242-S262 CarbonylContact C-O 3.6Å; I242-S262 WeakPolarHBondContact CA-O 3.46Å; I242-A263 HydrophobicContact CG1-CB 3.89Å
243	A	89.7	Confident	86.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	131.6	167.8	0	0	0	0	0	109.2	F233 T261 S262 F288	F233-A243 HydrophobicContact CD1-CB 3.64Å; F233-A243 HydrophobicContact CE1-CB 3.4Å; F233-A243 HydrophobicContact CZ-CB 4.4Å; A243-T261 VanDerWaalsContact O-CA 3.27Å; A243-T261 WeakPolarHBondContact O-CA 3.39Å; A243-S262 PolarHBondContact N-O 3.44Å; A243-S262 PolarHBondContact O-N 3.13Å; A243-F288 HydrophobicContact CB-CZ 4.27Å
244	W	89.6	Confident	85.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	104.9	-177.8	-53.3	87.2	0	0	0	109	W191 H209 C214 F231 F232 T234 I242 L259 T261	W191-W244 AromaticContact CD1-CZ2 3.9Å; W191-W244 AromaticContact CE2-CD2 3.92Å; W191-W244 AromaticContact CE2-CE3 3.91Å; W191-W244 AromaticContact CZ2-CD2 3.82Å; W191-W244 HydrophobicContact CZ2-CD2 3.82Å; W191-W244 AromaticContact CZ2-CE3 3.5Å; W191-W244 HydrophobicContact CZ2-CE3 3.5Å; W191-W244 VanDerWaalsContact CZ2-CE3 3.5Å; W191-W244 HydrophobicContact CZ2-CG 4.35Å; W191-W244 AromaticContact CZ2-CZ3 3.89Å; W191-W244 HydrophobicContact CZ2-CZ3 3.89Å; W191-W244 AromaticContact NE1-CD2 3.6Å; W191-W244 AromaticContact NE1-CE2 3.31Å; W191-W244 VanDerWaalsContact NE1-CE2 3.31Å; W191-W244 AromaticContact NE1-CE3 3.74Å; W191-W244 AromaticContact NE1-CH2 3.37Å; W191-W244 AromaticContact NE1-CZ2 3.2Å; W191-W244 AromaticContact NE1-CZ3 3.64Å; W191-W244 AromaticContact NE1-NE1 3.99Å; H209-W244 AromaticContact CD2-CH2 3.43Å; H209-W244 VanDerWaalsContact CD2-CH2 3.43Å; H209-W244 WeakPolarHBondContact CD2-CH2 3.28Å; H209-W244 AromaticContact CD2-CZ3 3.52Å; H209-W244 AromaticContact CE1-CZ3 3.5Å; H209-W244 AromaticContact CG-CZ3 3.93Å; H209-W244 AromaticContact ND1-CZ3 3.92Å; H209-W244 AromaticContact NE2-CH2 3.43Å; H209-W244 WeakPolarHBondContact NE2-CH2 3.41Å; H209-W244 AromaticContact NE2-CZ3 3.27Å; H209-W244 VanDerWaalsContact NE2-CZ3 3.27Å; H209-W244 WeakPolarHBondContact NE2-CZ3 3.42Å; C214-W244 WeakPolarHBondContact O-CH2 2.99Å; F231-W244 CarbonylContact C-O 3.5Å; F231-W244 WeakPolarHBondContact CA-O 3.33Å; F231-W244 WeakPolarHBondContact CB-O 3.45Å; F232-W244 HydrophobicContact CD1-CB 4.26Å; F232-W244 HydrophobicContact CD2-CB 3.98Å; F232-W244 AromaticContact CD2-CD1 3.54Å; F232-W244 AromaticContact CD2-CG 3.99Å; F232-W244 HydrophobicContact CD2-CG 3.99Å; F232-W244 HydrophobicContact CE1-CB 3.85Å; F232-W244 HydrophobicContact CE2-CB 3.56Å; F232-W244 AromaticContact CE2-CD1 3.26Å; F232-W244 HydrophobicContact CE2-CD2 4.25Å; F232-W244 AromaticContact CE2-CG 3.42Å; F232-W244 HydrophobicContact CE2-CG 3.42Å; F232-W244 VanDerWaalsContact CE2-CG 3.42Å; F232-W244 AromaticContact CE2-NE1 3.98Å; F232-W244 HydrophobicContact CG-CB 4.31Å; F232-W244 HydrophobicContact CZ-CB 3.48Å; F232-W244 VanDerWaalsContact CZ-CB 3.48Å; F232-W244 HydrophobicContact CZ-CD2 4.49Å; F232-W244 AromaticContact CZ-CG 3.74Å; F232-W244 HydrophobicContact CZ-CG 3.74Å; F232-W244 PolarHBondContact N-O 3.29Å; F232-W244 VanDerWaalsContact N-O 3.09Å; F232-W244 PolarHBondContact O-N 3.11Å; T234-W244 PolarHBondContact OG1-NE1 2.8Å; I242-W244 HydrophobicContact CB-CZ2 3.83Å; I242-W244 HydrophobicContact CD1-CH2 4.39Å; I242-W244 HydrophobicContact CD1-CZ2 3.91Å; I242-W244 HydrophobicContact CG1-CZ2 4.46Å; I242-W244 HydrophobicContact CG2-CD2 3.9Å; I242-W244 HydrophobicContact CG2-CE3 4.42Å; I242-W244 HydrophobicContact CG2-CG 4.41Å; I242-W244 HydrophobicContact CG2-CH2 4.1Å; I242-W244 HydrophobicContact CG2-CZ2 3.53Å; I242-W244 PolarHBondContact O-NE1 3.42Å; W244-L259 HydrophobicContact CB-CD1 4.37Å; W244-L259 HydrophobicContact CE3-CD1 4.13Å; W244-L259 HydrophobicContact CE3-CD2 4.09Å; W244-L259 HydrophobicContact CE3-CG 4.3Å; W244-L259 HydrophobicContact CZ3-CD2 4.22Å; W244-T261 HydrophobicContact CD2-CG2 4.2Å; W244-T261 HydrophobicContact CE3-CG2 3.3Å; W244-T261 HydrophobicContact CH2-CG2 4.29Å; W244-T261 HydrophobicContact CZ3-CG2 3.35Å
245	Q	88	Confident	84.7	Confident	40 Å²	40	56.8 Å²	56.8	19%	0.187	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.8	170.1	-174.7	-176.3	34.2	0	0	108.8	F231 L259 R260 F288	F231-Q245 HydrophobicContact CB-CB 4.17Å; Q245-L259 CarbonylContact O-C 3.55Å; Q245-L259 WeakPolarHBondContact O-CA 3.37Å; Q245-R260 HydrophobicContact CB-CB 4.29Å; Q245-R260 PolarHBondContact N-O 3.31Å; Q245-R260 PolarHBondContact O-N 3.43Å; Q245-R260 VanDerWaalsContact OE1-CZ 3.3Å; Q245-F288 HydrophobicContact CB-CD2 4.41Å; Q245-F288 HydrophobicContact CB-CE2 3.58Å; Q245-F288 HydrophobicContact CB-CZ 3.93Å; Q245-F288 HydrophobicContact CG-CE2 4.33Å
246	F	86.6	Confident	84.2	Confident	12 Å²	12	57.7 Å²	57.7	5%	0.053	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	161.4	-178.7	65.4	-80.9	0	0	0	111.5	L181 L193 W225 N230 F232 L248 V256 V258 L259	L181-F246 HydrophobicContact CD1-CE2 3.74Å; L181-F246 HydrophobicContact CD1-CZ 3.58Å; L193-F246 HydrophobicContact CD2-CD2 4.19Å; L193-F246 HydrophobicContact CD2-CE2 4.05Å; L193-F246 HydrophobicContact CD2-CZ 4.37Å; W225-F246 AromaticContact CH2-CE1 3.93Å; W225-F246 HydrophobicContact CH2-CE1 3.93Å; W225-F246 AromaticContact CH2-CZ 3.72Å; W225-F246 HydrophobicContact CH2-CZ 3.72Å; W225-F246 AromaticContact CZ3-CE1 3.63Å; W225-F246 HydrophobicContact CZ3-CE1 3.63Å; W225-F246 AromaticContact CZ3-CZ 3.63Å; W225-F246 HydrophobicContact CZ3-CZ 3.63Å; N230-F246 PolarHBondContact O-N 2.9Å; F232-F246 AromaticContact CD1-CD1 3.96Å; F232-F246 HydrophobicContact CD1-CD1 3.96Å; F232-F246 AromaticContact CD1-CE1 3.69Å; F232-F246 HydrophobicContact CD1-CE1 3.69Å; F232-F246 AromaticContact CE1-CD1 3.73Å; F232-F246 HydrophobicContact CE1-CD1 3.73Å; F232-F246 AromaticContact CE1-CE1 3.84Å; F232-F246 HydrophobicContact CE1-CE1 3.84Å; F246-L248 HydrophobicContact CD2-CD2 3.99Å; F246-L248 HydrophobicContact CD2-CG 3.9Å; F246-L248 HydrophobicContact CE2-CD1 3.99Å; F246-L248 HydrophobicContact CE2-CD2 4.09Å; F246-L248 HydrophobicContact CE2-CG 3.78Å; F246-V256 HydrophobicContact CB-CG1 3.92Å; F246-V258 CarbonylContact C-O 3.55Å; F246-V258 WeakPolarHBondContact CA-O 3.4Å; F246-L259 HydrophobicContact CB-CD1 3.99Å
247	T	86.6	Confident	83.3	Confident	70 Å²	70	62.4 Å²	62.4	43%	0.429	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.2	169.6	-53.8	0	0	0	0	107.4	D257 V258	T247-D257 PolarHBondContact O-N 3.13Å; T247-V258 PolarHBondContact N-O 3.38Å
248	L	85.8	Confident	82.4	Confident	38 Å²	38	59.1 Å²	59.1	20%	0.199	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	141.3	179.9	-64.7	171.3	0	0	0	110.2	L181 L193 V206 F246 K255 V256	L181-L248 HydrophobicContact CD1-CD1 3.99Å; L181-L248 HydrophobicContact CD2-CD1 3.69Å; L181-L248 HydrophobicContact CG-CD1 4.41Å; L193-L248 HydrophobicContact CD2-CD2 4.44Å; V206-L248 HydrophobicContact CG1-CD2 3.81Å; F246-L248 HydrophobicContact CD2-CD2 3.99Å; F246-L248 HydrophobicContact CD2-CG 3.9Å; F246-L248 HydrophobicContact CE2-CD1 3.99Å; F246-L248 HydrophobicContact CE2-CD2 4.09Å; F246-L248 HydrophobicContact CE2-CG 3.78Å; L248-K255 WeakPolarHBondContact CA-O 3.45Å; L248-V256 HydrophobicContact CD2-CG2 3.92Å
249	S	82	Confident	81.8	Confident	14 Å²	14	61.1 Å²	61.1	10%	0.098	32%	0.316	C	S	.	.			trans	-71.5	138.8	169.4	66.6	0	0	0	0	110.2	R195 G251 Q253 K255 D257	R195-S249 PolarHBondContact NH1-O 2.95Å; S249-G251 PolarHBondContact O-N 2.59Å; S249-Q253 PolarHBondContact OG-O 3.02Å; S249-K255 PolarHBondContact N-O 3.36Å; S249-K255 WeakPolarHBondContact OG-CB 3.22Å; S249-K255 PolarHBondContact OG-N 3.18Å; S249-K255 PolarHBondContact OG-O 3.48Å; S249-D257 WeakPolarHBondContact CA-OD2 3.39Å; S249-D257 WeakPolarHBondContact CB-OD1 3.19Å; S249-D257 WeakPolarHBondContact CB-OD2 3.18Å
250	N	72.1	Confident	81.3	Confident	153 Å²	153	63.4 Å²	63.4	82%	0.818	32%	0.322	S	S	*	.			trans	-83.9	8.3	170.6	-71.8	-10.6	0	0	0	113.4
251	G	71.8	Confident	81.1	Confident	48 Å²	48	61.4 Å²	61.4	50%	0.495	32%	0.32	S	S	.	.	S	Bend	trans	-67.8	167.8	176.5	0	0	0	0	0	113.3	S249 Q253	S249-G251 PolarHBondContact O-N 2.59Å; G251-Q253 PolarHBondContact O-N 2.76Å; G251-Q253 VanDerWaalsContact O-N 3.15Å
252	E	69.6	Low	80.8	Confident	189 Å²	189	62.7 Å²	62.7	88%	0.883	33%	0.329	S	S	*	.	S	Bend	trans	-56.8	-27.7	178.5	-68	-179.2	165.9	0	0	113.5
253	Q	72.4	Confident	80.7	Confident	149 Å²	149	65.3 Å²	65.3	70%	0.696	35%	0.351	S	S	*	.	S	Bend	trans	-101.4	129.1	175.7	-66.2	-65.9	-26.2	0	0	109.8	S249 G251 K255	S249-Q253 PolarHBondContact OG-O 3.02Å; G251-Q253 PolarHBondContact O-N 2.76Å; G251-Q253 VanDerWaalsContact O-N 3.15Å; Q253-K255 PolarHBondContact O-N 2.93Å; Q253-K255 VanDerWaalsContact O-N 3.1Å
254	P	70.9	Confident	80.5	Confident	18 Å²	18	69 Å²	69	12%	0.117	37%	0.367	C	S	.	.			trans	-69	113.2	177.8	29.8	-34.6	0	0	0	109.3	R195 A204 V206	R195-P254 HydrophobicContact CB-CB 4.4Å; A204-P254 HydrophobicContact CB-CG 4.08Å; V206-P254 HydrophobicContact CB-CB 4.36Å; V206-P254 HydrophobicContact CG1-CB 4.16Å; V206-P254 WeakPolarHBondContact CG1-O 3.13Å; V206-P254 HydrophobicContact CG2-CB 3.83Å
255	K	79.1	Confident	80.5	Confident	130 Å²	130	75 Å²	75	57%	0.565	40%	0.398	S	S	*	.			trans	-134.5	148.7	176.7	-169.7	-178.4	174.6	-171.3	0	110.7	L248 S249 Q253	L248-K255 WeakPolarHBondContact CA-O 3.45Å; S249-K255 PolarHBondContact N-O 3.36Å; S249-K255 WeakPolarHBondContact OG-CB 3.22Å; S249-K255 PolarHBondContact OG-N 3.18Å; S249-K255 PolarHBondContact OG-O 3.48Å; Q253-K255 PolarHBondContact O-N 2.93Å; Q253-K255 VanDerWaalsContact O-N 3.1Å
256	V	81.6	Confident	80.5	Confident	19 Å²	19	74.4 Å²	74.4	12%	0.115	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	117.5	167	175.9	0	0	0	0	108.4	L193 V206 L207 F246 L248 V258 L259	L193-V256 HydrophobicContact CD2-CG2 4.26Å; V206-V256 HydrophobicContact CG1-CG2 3.81Å; L207-V256 HydrophobicContact CB-CG2 3.84Å; L207-V256 HydrophobicContact CD2-CB 3.95Å; L207-V256 HydrophobicContact CD2-CG1 4.22Å; L207-V256 HydrophobicContact CD2-CG2 3.72Å; L207-V256 HydrophobicContact CG-CG2 4.37Å; F246-V256 HydrophobicContact CB-CG1 3.92Å; L248-V256 HydrophobicContact CD2-CG2 3.92Å; V256-V258 WeakPolarHBondContact CG1-O 3.4Å; V256-L259 HydrophobicContact CG1-CB 4.26Å
257	D	74.7	Confident	80.5	Confident	99 Å²	99	81.6 Å²	81.6	53%	0.529	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-42.7	-179.8	-77.8	-24.7	0	0	0	112.2	T247 S249	T247-D257 PolarHBondContact O-N 3.13Å; S249-D257 WeakPolarHBondContact CA-OD2 3.39Å; S249-D257 WeakPolarHBondContact CB-OD1 3.19Å; S249-D257 WeakPolarHBondContact CB-OD2 3.18Å
258	V	75.6	Confident	80.6	Confident	65 Å²	65	80.9 Å²	80.9	39%	0.394	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.1	-179.5	-179.3	0	0	0	0	108.3	F246 T247 V256 R260	F246-V258 CarbonylContact C-O 3.55Å; F246-V258 WeakPolarHBondContact CA-O 3.4Å; T247-V258 PolarHBondContact N-O 3.38Å; V256-V258 WeakPolarHBondContact CG1-O 3.4Å; V258-R260 HydrophobicContact CG1-CG 4.16Å
259	L	80.8	Confident	80.8	Confident	57 Å²	57	80.3 Å²	80.3	30%	0.298	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	112.9	170.2	-174.1	69.4	0	0	0	109	W191 L207 H209 W244 Q245 F246 V256 T261	W191-L259 HydrophobicContact CH2-CD1 4.15Å; W191-L259 HydrophobicContact CH2-CD2 4.35Å; W191-L259 HydrophobicContact CZ2-CD1 4.23Å; W191-L259 HydrophobicContact CZ2-CD2 4.12Å; L207-L259 HydrophobicContact CD2-CD2 4.32Å; H209-L259 VanDerWaalsContact CE1-CD2 3.41Å; H209-L259 WeakPolarHBondContact CE1-CD2 2.94Å; H209-L259 VanDerWaalsContact ND1-CD2 3.25Å; H209-L259 WeakPolarHBondContact ND1-CD2 2.85Å; W244-L259 HydrophobicContact CB-CD1 4.37Å; W244-L259 HydrophobicContact CE3-CD1 4.13Å; W244-L259 HydrophobicContact CE3-CD2 4.09Å; W244-L259 HydrophobicContact CE3-CG 4.3Å; W244-L259 HydrophobicContact CZ3-CD2 4.22Å; Q245-L259 CarbonylContact O-C 3.55Å; Q245-L259 WeakPolarHBondContact O-CA 3.37Å; F246-L259 HydrophobicContact CB-CD1 3.99Å; V256-L259 HydrophobicContact CG1-CB 4.26Å; L259-T261 HydrophobicContact CG-CG2 4.43Å
260	R	81.1	Confident	81.3	Confident	134 Å²	134	79.8 Å²	79.8	51%	0.506	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.7	173.2	-68	-172	-78.3	-134.1	-3.2	109.4	Q245 V258	Q245-R260 HydrophobicContact CB-CB 4.29Å; Q245-R260 PolarHBondContact N-O 3.31Å; Q245-R260 PolarHBondContact O-N 3.43Å; Q245-R260 VanDerWaalsContact OE1-CZ 3.3Å; V258-R260 HydrophobicContact CG1-CG 4.16Å
261	T	85	Confident	82.3	Confident	50 Å²	50	73.7 Å²	73.7	31%	0.307	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.8	-175.6	62.2	0	0	0	0	110.9	C214 A243 W244 L259	C214-T261 HydrophobicContact CB-CG2 4.36Å; A243-T261 VanDerWaalsContact O-CA 3.27Å; A243-T261 WeakPolarHBondContact O-CA 3.39Å; W244-T261 HydrophobicContact CD2-CG2 4.2Å; W244-T261 HydrophobicContact CE3-CG2 3.3Å; W244-T261 HydrophobicContact CH2-CG2 4.29Å; W244-T261 HydrophobicContact CZ3-CG2 3.35Å; L259-T261 HydrophobicContact CG-CG2 4.43Å
262	S	84.3	Confident	83.2	Confident	27 Å²	27	71.4 Å²	71.4	19%	0.189	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.7	166.7	178.8	0	0	0	0	109.2	I242 A243	I242-S262 CarbonylContact C-O 3.6Å; I242-S262 WeakPolarHBondContact CA-O 3.46Å; A243-S262 PolarHBondContact N-O 3.44Å; A243-S262 PolarHBondContact O-N 3.13Å
263	A	86.6	Confident	84.3	Confident	59 Å²	59	62.4 Å²	62.4	49%	0.488	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.1	-176.5	0	0	0	0	0	110.6	A241 I242	A241-A263 WeakPolarHBondContact O-CA 3.31Å; I242-A263 HydrophobicContact CG1-CB 3.89Å
264	K	86.6	Confident	85.1	Confident	78 Å²	78	57 Å²	57	34%	0.339	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.1	166.5	178.6	170.9	177.5	-179.7	0	109.8	R240 A241 F266 F293	R240-K264 VanDerWaalsContact CA-O 3.3Å; R240-K264 WeakPolarHBondContact CA-O 3.03Å; A241-K264 PolarHBondContact N-O 3.31Å; A241-K264 PolarHBondContact O-N 2.81Å; K264-F266 HydrophobicContact CB-CE2 3.97Å; K264-F266 HydrophobicContact CB-CZ 4.38Å; K264-F266 HydrophobicContact CD-CE1 4.26Å; K264-F266 HydrophobicContact CD-CE2 4.12Å; K264-F266 HydrophobicContact CD-CZ 3.72Å; K264-F266 HydrophobicContact CG-CD2 4.34Å; K264-F266 HydrophobicContact CG-CE2 3.76Å; K264-F266 HydrophobicContact CG-CZ 3.89Å; K264-F266 WeakPolarHBondContact O-CD2 3.27Å; K264-F266 WeakPolarHBondContact O-CE2 3.45Å; K264-F293 HydrophobicContact CB-CD1 3.53Å; K264-F293 HydrophobicContact CB-CD2 4.17Å; K264-F293 HydrophobicContact CB-CE1 3.16Å; K264-F293 HydrophobicContact CB-CE2 3.85Å; K264-F293 HydrophobicContact CB-CG 4.04Å; K264-F293 HydrophobicContact CB-CZ 3.35Å; K264-F293 HydrophobicContact CD-CB 3.6Å; K264-F293 HydrophobicContact CD-CD1 3.3Å; K264-F293 HydrophobicContact CD-CD2 3.96Å; K264-F293 HydrophobicContact CD-CE1 3.93Å; K264-F293 HydrophobicContact CD-CE2 4.48Å; K264-F293 HydrophobicContact CD-CG 3.34Å; K264-F293 HydrophobicContact CD-CZ 4.48Å; K264-F293 HydrophobicContact CG-CD1 4.06Å; K264-F293 HydrophobicContact CG-CE1 4.19Å; K264-F293 HydrophobicContact CG-CG 4.32Å
265	L	89.2	Confident	85.8	Confident	125 Å²	125	56.9 Å²	56.9	65%	0.654	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	138.2	173.9	-172.4	69	0	0	0	109.9	K239 R240	K239-L265 HydrophobicContact CB-CD1 4.2Å; K239-L265 CarbonylContact O-C 3.43Å; R240-L265 HydrophobicContact CG-CD1 4.02Å
266	F	87.8	Confident	85.8	Confident	28 Å²	28	51.7 Å²	51.7	12%	0.123	27%	0.274	C	S	.	.			trans	-116.1	162.4	176.6	-64.6	-97.5	0	0	0	110.1	K239 A241 K264 D268 V270	K239-F266 WeakPolarHBondContact CB-O 3.46Å; K239-F266 PolarHBondContact O-N 3.01Å; A241-F266 HydrophobicContact CB-CE2 3.56Å; A241-F266 HydrophobicContact CB-CZ 4.18Å; K264-F266 HydrophobicContact CB-CE2 3.97Å; K264-F266 HydrophobicContact CB-CZ 4.38Å; K264-F266 HydrophobicContact CD-CE1 4.26Å; K264-F266 HydrophobicContact CD-CE2 4.12Å; K264-F266 HydrophobicContact CD-CZ 3.72Å; K264-F266 HydrophobicContact CG-CD2 4.34Å; K264-F266 HydrophobicContact CG-CE2 3.76Å; K264-F266 HydrophobicContact CG-CZ 3.89Å; K264-F266 WeakPolarHBondContact O-CD2 3.27Å; K264-F266 WeakPolarHBondContact O-CE2 3.45Å; F266-D268 PolarHBondContact O-N 3.27Å; F266-V270 HydrophobicContact CB-CG2 4.17Å; F266-V270 HydrophobicContact CD2-CG2 3.42Å; F266-V270 VanDerWaalsContact CD2-CG2 3.42Å; F266-V270 HydrophobicContact CE2-CG2 3.9Å; F266-V270 HydrophobicContact CG-CG2 3.81Å
267	E	87.7	Confident	85.3	Confident	163 Å²	163	52 Å²	52	76%	0.762	28%	0.276	S	S	*	.	S	Bend	trans	-65.6	-31.3	176.7	-64.4	-174.8	169.7	0	0	111.8	K239	K239-E267 WeakPolarHBondContact CD-O 3.42Å; K239-E267 WeakPolarHBondContact CE-O 3.47Å; K239-E267 PolarHBondContact NZ-O 3Å
268	D	87.7	Confident	84.7	Confident	55 Å²	55	49.6 Å²	49.6	29%	0.294	27%	0.267	S	S	.	.	S	Bend	trans	-135.7	174.1	-176.2	-79.5	-46.5	0	0	0	113.2	K239 F266 V270	K239-D268 WeakPolarHBondContact CA-O 3.36Å; K239-D268 WeakPolarHBondContact CB-O 3.39Å; K239-D268 IonicContact NZ-OD1 3.9Å; F266-D268 PolarHBondContact O-N 3.27Å; D268-V270 PolarHBondContact O-N 3.45Å
269	S	91.3	Very high	83.6	Confident	27 Å²	27	55 Å²	55	19%	0.189	29%	0.287	C	S	.	.			trans	-55.7	132.8	178.5	175.8	0	0	0	0	110.8	W221 R237 T271	W221-S269 PolarHBondContact NE1-OG 3.28Å; R237-S269 WeakPolarHBondContact CA-OG 3.4Å; S269-T271 PolarHBondContact O-N 2.88Å
270	V	91.4	Very high	82	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.018	29%	0.293	C	S	.	.			trans	-89	109.4	171.9	-166.5	0	0	0	0	107.2	A235 S236 F266 D268	A235-V270 HydrophobicContact CB-CB 3.81Å; A235-V270 HydrophobicContact CB-CG1 3.45Å; A235-V270 VanDerWaalsContact CB-CG1 3.45Å; S236-V270 PolarHBondContact O-N 2.8Å; F266-V270 HydrophobicContact CB-CG2 4.17Å; F266-V270 HydrophobicContact CD2-CG2 3.42Å; F266-V270 VanDerWaalsContact CD2-CG2 3.42Å; F266-V270 HydrophobicContact CE2-CG2 3.9Å; F266-V270 HydrophobicContact CG-CG2 3.81Å; D268-V270 PolarHBondContact O-N 3.45Å
271	T	92.4	Very high	80.4	Confident	24 Å²	24	52.9 Å²	52.9	15%	0.147	28%	0.284	C	S	.	.			trans	-98.3	-24.6	-171.5	51.9	0	0	0	0	113.7	A8 V9 W221 S269	A8-T271 HydrophobicContact CB-CG2 4.19Å; V9-T271 WeakPolarHBondContact O-CB 3.42Å; V9-T271 PolarHBondContact O-OG1 3.08Å; W221-T271 WeakPolarHBondContact CB-O 3.16Å; S269-T271 PolarHBondContact O-N 2.88Å
272	A	91.9	Very high	78.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.312	C	S	.	.			trans	-146.3	150.8	176.8	0	0	0	0	0	109.6	V9 L12 D222	V9-A272 HydrophobicContact CG1-CB 3.95Å; L12-A272 HydrophobicContact CD2-CB 3.48Å; L12-A272 VanDerWaalsContact CD2-CB 3.48Å; L12-A272 HydrophobicContact CG-CB 4.05Å; D222-A272 WeakPolarHBondContact OD2-CA 3.07Å
273	I	91.5	Very high	76.3	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.317	C	S	.	.			trans	-149.4	138.7	-178.1	-171.3	156.6	0	0	0	110.3	D222 A224 F233 A235 A241 I296	D222-I273 HydrophobicContact CB-CG2 4Å; D222-I273 PolarHBondContact OD2-N 2.88Å; A224-I273 HydrophobicContact CB-CG2 4.24Å; A224-I273 WeakPolarHBondContact CB-O 2.69Å; F233-I273 HydrophobicContact CB-CD1 3.54Å; F233-I273 HydrophobicContact CB-CG1 4.26Å; F233-I273 HydrophobicContact CG-CD1 4.27Å; A235-I273 HydrophobicContact CB-CB 3.87Å; A235-I273 HydrophobicContact CB-CD1 4.41Å; A235-I273 HydrophobicContact CB-CG2 3.73Å; A241-I273 HydrophobicContact CB-CD1 3.99Å; I273-I296 HydrophobicContact CD1-CD1 4.24Å; I273-I296 HydrophobicContact CD1-CG1 4.35Å; I273-I296 HydrophobicContact CD1-CG2 3.71Å; I273-I296 HydrophobicContact CG1-CG2 3.78Å
274	D	90	Very high	74.3	Confident	36 Å²	36	59.9 Å²	59.9	19%	0.193	33%	0.326	C	S	.	.			trans	-149.4	163.1	171.5	-163.6	14.5	0	0	0	109.6	L12 A13 W14	L12-D274 HydrophobicContact CD1-CB 3.16Å; L12-D274 HydrophobicContact CG-CB 4.29Å; A13-D274 WeakPolarHBondContact CA-OD2 3.06Å; W14-D274 VanDerWaalsContact CD1-OD2 3.31Å; W14-D274 PolarHBondContact N-OD2 2.57Å
275	V	85.9	Confident	72.2	Confident	15 Å²	15	63.6 Å²	63.6	9%	0.091	35%	0.35	C	S	.	.			trans	-119.3	126.8	-174.4	-173.3	0	0	0	0	109.2	A224 W225 F233	A224-V275 HydrophobicContact CB-CG2 3.99Å; W225-V275 WeakPolarHBondContact O-CG2 3.48Å; F233-V275 HydrophobicContact CD2-CG2 3.39Å; F233-V275 HydrophobicContact CE2-CG1 4.4Å; F233-V275 HydrophobicContact CE2-CG2 3.49Å; F233-V275 VanDerWaalsContact CE2-CG2 3.49Å
276	I	78	Confident	69.9	Low	21 Å²	21	63.1 Å²	63.1	11%	0.108	34%	0.344	C	S	.	.			trans	-58.9	133.3	175.7	-162.7	172.8	0	0	0	110.7	W14 C278 L280 C295	W14-I276 HydrophobicContact CD2-CB 4.28Å; W14-I276 HydrophobicContact CD2-CG1 4.05Å; W14-I276 HydrophobicContact CE3-CD1 4.45Å; W14-I276 HydrophobicContact CE3-CG1 4.11Å; W14-I276 HydrophobicContact CH2-CD1 3.95Å; W14-I276 HydrophobicContact CH2-CG1 4.3Å; W14-I276 HydrophobicContact CZ2-CB 4.18Å; W14-I276 HydrophobicContact CZ2-CD1 4.21Å; W14-I276 HydrophobicContact CZ2-CG1 4.22Å; W14-I276 HydrophobicContact CZ3-CD1 4.07Å; W14-I276 HydrophobicContact CZ3-CG1 4.24Å; I276-C278 PolarHBondContact O-N 2.87Å; I276-L280 HydrophobicContact CD1-CD2 3.83Å; I276-C295 HydrophobicContact CG2-CB 3.67Å
277	P	72.3	Confident	67.8	Low	26 Å²	26	65.8 Å²	65.8	17%	0.169	36%	0.364	C	S	.	.			trans	-57.1	133.7	173.1	-27	35.7	0	0	0	111.7	W14 H279 L280	W14-P277 HydrophobicContact CB-CG 4.44Å; P277-H279 PolarHBondContact O-N 2.91Å; P277-H279 VanDerWaalsContact O-N 3.07Å; P277-L280 PolarHBondContact O-N 2.91Å
278	C	62.4	Low	65.8	Low	48 Å²	48	60 Å²	60	32%	0.324	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-68	-9	-171.5	60.1	0	0	0	0	114.9	P227 I276 L280 M281	P227-C278 HydrophobicContact CB-CB 4.23Å; P227-C278 HydrophobicContact CG-CB 4.36Å; I276-C278 PolarHBondContact O-N 2.87Å; C278-L280 PolarHBondContact O-N 2.9Å; C278-M281 CarbonylContact O-C 3.23Å; C278-M281 PolarHBondContact O-N 3.24Å
279	H	51.6	Low	63.8	Low	177 Å²	177	64.9 Å²	64.9	82%	0.819	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-61.2	-19.4	179	-71	62.1	0	0	0	112.3	P277	P277-H279 PolarHBondContact O-N 2.91Å; P277-H279 VanDerWaalsContact O-N 3.07Å
280	L	48.1	Very low	61.4	Low	82 Å²	82	73.9 Å²	73.9	43%	0.429	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-86.4	-10.5	173.3	-144.9	80	0	0	0	114	M19 I276 P277 C278	M19-L280 HydrophobicContact SD-CD1 4.44Å; I276-L280 HydrophobicContact CD1-CD2 3.83Å; P277-L280 PolarHBondContact O-N 2.91Å; C278-L280 PolarHBondContact O-N 2.9Å
281	M	47	Very low	58.9	Low	65 Å²	65	78.6 Å²	78.6	32%	0.32	41%	0.406	S	S	.	.			trans	-132.7	107.3	-167.5	-68.3	-132.7	99.7	0	0	111.1	C278 L283	C278-M281 CarbonylContact O-C 3.23Å; C278-M281 PolarHBondContact O-N 3.24Å; M281-L283 HydrophobicContact CB-CB 4.25Å; M281-L283 HydrophobicContact CB-CD1 3.86Å; M281-L283 HydrophobicContact CE-CD1 3.08Å; M281-L283 HydrophobicContact CG-CD1 4.18Å; M281-L283 PolarHBondContact O-N 2.64Å; M281-L283 HydrophobicContact SD-CD1 3.58Å; M281-L283 VanDerWaalsContact SD-CD1 3.58Å
282	S	41	Very low	56.8	Low	128 Å²	128	80 Å²	80	90%	0.895	41%	0.409	S	S	*	.			trans	-69.7	32.6	174.7	84.3	0	0	0	0	113.9
283	L	42.5	Very low	54.7	Low	55 Å²	55	81.9 Å²	81.9	29%	0.288	42%	0.417	S	S	.	.			trans	-111.3	17.7	-156.6	-79.8	150	0	0	0	114.3	M281 D285 Y291	M281-L283 HydrophobicContact CB-CB 4.25Å; M281-L283 HydrophobicContact CB-CD1 3.86Å; M281-L283 HydrophobicContact CE-CD1 3.08Å; M281-L283 HydrophobicContact CG-CD1 4.18Å; M281-L283 PolarHBondContact O-N 2.64Å; M281-L283 HydrophobicContact SD-CD1 3.58Å; M281-L283 VanDerWaalsContact SD-CD1 3.58Å; L283-D285 PolarHBondContact O-N 2.79Å; L283-D285 VanDerWaalsContact O-N 3.17Å; L283-Y291 HydrophobicContact CD2-CD1 4.15Å; L283-Y291 HydrophobicContact CD2-CD2 4.36Å; L283-Y291 HydrophobicContact CD2-CE1 4.04Å; L283-Y291 HydrophobicContact CD2-CE2 4.28Å; L283-Y291 HydrophobicContact CD2-CG 4.31Å
284	C	43.4	Very low	52.3	Low	100 Å²	100	85.1 Å²	85.1	68%	0.676	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.9	177.7	-67.3	0	0	0	0	114.3
285	D	42.7	Very low	50.2	Low	157 Å²	157	84.3 Å²	84.3	84%	0.84	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	5.7	-172.1	-69.6	-29.9	0	0	0	115.9	L283	L283-D285 PolarHBondContact O-N 2.79Å; L283-D285 VanDerWaalsContact O-N 3.17Å
286	E	42.4	Very low	48.4	Very low	115 Å²	115	84.3 Å²	84.3	54%	0.537	44%	0.436	S	S	.	.	S	Bend	trans	-107.8	154.5	-177	-74.8	-65.6	150.1	0	0	113.9	Y291	E286-Y291 HydrophobicContact CB-CD2 4.15Å; E286-Y291 HydrophobicContact CB-CE2 4.02Å; E286-Y291 HydrophobicContact CG-CE2 4.48Å
287	P	43.2	Very low	46.9	Very low	84 Å²	84	89.4 Å²	89.4	55%	0.545	46%	0.455	S	S	.	.			trans	-69.4	148.4	-162.9	24.4	-31.4	0	0	0	114.9	E289 R290	P287-E289 PolarHBondContact O-N 3.35Å; P287-R290 PolarHBondContact O-N 3.43Å
288	F	44.8	Very low	46.1	Very low	41 Å²	41	90.2 Å²	90.2	18%	0.18	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-15.2	-166.1	-173.9	-102.8	0	0	0	117.5	A243 Q245 Y292	A243-F288 HydrophobicContact CB-CZ 4.27Å; Q245-F288 HydrophobicContact CB-CD2 4.41Å; Q245-F288 HydrophobicContact CB-CE2 3.58Å; Q245-F288 HydrophobicContact CB-CZ 3.93Å; Q245-F288 HydrophobicContact CG-CE2 4.33Å; F288-Y292 HydrophobicContact CB-CE2 4.26Å; F288-Y292 HydrophobicContact CD2-CD2 4.37Å; F288-Y292 AromaticContact CD2-CE2 3.41Å; F288-Y292 HydrophobicContact CD2-CE2 3.41Å; F288-Y292 VanDerWaalsContact CD2-CE2 3.41Å; F288-Y292 HydrophobicContact CE2-CD2 4.47Å; F288-Y292 AromaticContact CE2-CE2 3.79Å; F288-Y292 HydrophobicContact CE2-CE2 3.79Å; F288-Y292 AromaticContact CG-CE2 3.91Å; F288-Y292 HydrophobicContact CG-CE2 3.91Å; F288-Y292 WeakPolarHBondContact O-CD2 3.47Å; F288-Y292 WeakPolarHBondContact O-CE2 3.45Å
289	E	45.9	Very low	45.1	Very low	157 Å²	157	93.4 Å²	93.4	73%	0.734	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-25.6	-169.2	-64.9	-172.9	171.1	0	0	114.7	P287	P287-E289 PolarHBondContact O-N 3.35Å
290	R	40.5	Very low	44.4	Very low	216 Å²	216	85.3 Å²	85.3	82%	0.815	43%	0.432	S	S	*	.	S	Bend	trans	-92.9	-25.3	-164.3	-85.8	-175	176	-177.1	-0.1	116.4	P287	P287-R290 PolarHBondContact O-N 3.43Å
291	Y	39.9	Very low	43.7	Very low	103 Å²	103	82.6 Å²	82.6	40%	0.404	42%	0.423	S	S	.	.	S	Bend	trans	-115.7	-16.8	-167.3	-69.5	-79.3	0	0	0	116.2	L283 E286 F293 S294	L283-Y291 HydrophobicContact CD2-CD1 4.15Å; L283-Y291 HydrophobicContact CD2-CD2 4.36Å; L283-Y291 HydrophobicContact CD2-CE1 4.04Å; L283-Y291 HydrophobicContact CD2-CE2 4.28Å; L283-Y291 HydrophobicContact CD2-CG 4.31Å; E286-Y291 HydrophobicContact CB-CD2 4.15Å; E286-Y291 HydrophobicContact CB-CE2 4.02Å; E286-Y291 HydrophobicContact CG-CE2 4.48Å; Y291-F293 VanDerWaalsContact C-N 3.32Å; Y291-F293 PolarHBondContact O-N 3.42Å; Y291-S294 PolarHBondContact O-N 3.22Å; Y291-S294 PolarHBondContact O-OG 3.39Å
292	Y	48.6	Very low	42.8	Very low	53 Å²	53	89.1 Å²	89.1	21%	0.208	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-67.3	-32.6	-171.4	-65.4	-53	0	0	0	114.2	F231 F233 F288 S294 C295 I296	F231-Y292 HydrophobicContact CD2-CE1 4.49Å; F231-Y292 AromaticContact CE1-CE1 3.84Å; F231-Y292 HydrophobicContact CE1-CE1 3.84Å; F231-Y292 AromaticContact CE2-CD1 3.64Å; F231-Y292 HydrophobicContact CE2-CD1 3.64Å; F231-Y292 AromaticContact CE2-CE1 3.5Å; F231-Y292 HydrophobicContact CE2-CE1 3.5Å; F231-Y292 VanDerWaalsContact CE2-CE1 3.5Å; F231-Y292 HydrophobicContact CE2-CG 4.41Å; F231-Y292 AromaticContact CZ-CD1 3.72Å; F231-Y292 HydrophobicContact CZ-CD1 3.72Å; F231-Y292 AromaticContact CZ-CE1 3.12Å; F231-Y292 HydrophobicContact CZ-CE1 3.12Å; F231-Y292 AromaticContact CZ-CZ 3.77Å; F233-Y292 HydrophobicContact CE1-CG 4.4Å; F233-Y292 HydrophobicContact CZ-CD1 4.09Å; F233-Y292 HydrophobicContact CZ-CG 4.04Å; F288-Y292 HydrophobicContact CB-CE2 4.26Å; F288-Y292 HydrophobicContact CD2-CD2 4.37Å; F288-Y292 AromaticContact CD2-CE2 3.41Å; F288-Y292 HydrophobicContact CD2-CE2 3.41Å; F288-Y292 VanDerWaalsContact CD2-CE2 3.41Å; F288-Y292 HydrophobicContact CE2-CD2 4.47Å; F288-Y292 AromaticContact CE2-CE2 3.79Å; F288-Y292 HydrophobicContact CE2-CE2 3.79Å; F288-Y292 AromaticContact CG-CE2 3.91Å; F288-Y292 HydrophobicContact CG-CE2 3.91Å; F288-Y292 WeakPolarHBondContact O-CD2 3.47Å; F288-Y292 WeakPolarHBondContact O-CE2 3.45Å; Y292-S294 VanDerWaalsContact C-N 3.34Å; Y292-S294 PolarHBondContact O-N 3.43Å; Y292-C295 PolarHBondContact O-N 3.26Å; Y292-I296 WeakPolarHBondContact O-CD1 3.32Å; Y292-I296 WeakPolarHBondContact O-CG1 3.14Å
293	F	46.2	Very low	42.1	Very low	40 Å²	40	90.1 Å²	90.1	18%	0.175	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-83.7	-4.5	-177.1	-60.4	-68.5	0	0	0	114.8	K264 Y291 I296	K264-F293 HydrophobicContact CB-CD1 3.53Å; K264-F293 HydrophobicContact CB-CD2 4.17Å; K264-F293 HydrophobicContact CB-CE1 3.16Å; K264-F293 HydrophobicContact CB-CE2 3.85Å; K264-F293 HydrophobicContact CB-CG 4.04Å; K264-F293 HydrophobicContact CB-CZ 3.35Å; K264-F293 HydrophobicContact CD-CB 3.6Å; K264-F293 HydrophobicContact CD-CD1 3.3Å; K264-F293 HydrophobicContact CD-CD2 3.96Å; K264-F293 HydrophobicContact CD-CE1 3.93Å; K264-F293 HydrophobicContact CD-CE2 4.48Å; K264-F293 HydrophobicContact CD-CG 3.34Å; K264-F293 HydrophobicContact CD-CZ 4.48Å; K264-F293 HydrophobicContact CG-CD1 4.06Å; K264-F293 HydrophobicContact CG-CE1 4.19Å; K264-F293 HydrophobicContact CG-CG 4.32Å; Y291-F293 VanDerWaalsContact C-N 3.32Å; Y291-F293 PolarHBondContact O-N 3.42Å; F293-I296 HydrophobicContact CD1-CD1 3.81Å; F293-I296 HydrophobicContact CE1-CD1 4.24Å
294	S	42	Very low	41.3	Very low	69 Å²	69	98.4 Å²	98.4	48%	0.483	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-82.6	-21.3	168.5	61.1	0	0	0	0	112.3	Y291 Y292	Y291-S294 PolarHBondContact O-N 3.22Å; Y291-S294 PolarHBondContact O-OG 3.39Å; Y292-S294 VanDerWaalsContact C-N 3.34Å; Y292-S294 PolarHBondContact O-N 3.43Å
295	C	44.8	Very low	40.3	Very low	19 Å²	19	103.7 Å²	103.7	13%	0.128	48%	0.479	C	S	.	.	S	Bend	trans	-90.9	-9.3	179.8	-60.7	0	0	0	0	113.5	I276 Y292	I276-C295 HydrophobicContact CG2-CB 3.67Å; Y292-C295 PolarHBondContact O-N 3.26Å
296	I	48.5	Very low	39.4	Very low	15 Å²	15	104.6 Å²	104.6	8%	0.077	50%	0.498	C	S	.	.			trans	-100.4	108.2	-178.8	-65.1	163	0	0	0	108.6	F233 I273 Y292 F293	F233-I296 HydrophobicContact CD1-CD1 3.55Å; F233-I296 HydrophobicContact CE1-CD1 3.51Å; F233-I296 HydrophobicContact CE2-CD1 4.5Å; F233-I296 HydrophobicContact CG-CD1 4.07Å; F233-I296 HydrophobicContact CZ-CD1 4.01Å; I273-I296 HydrophobicContact CD1-CD1 4.24Å; I273-I296 HydrophobicContact CD1-CG1 4.35Å; I273-I296 HydrophobicContact CD1-CG2 3.71Å; I273-I296 HydrophobicContact CG1-CG2 3.78Å; Y292-I296 WeakPolarHBondContact O-CD1 3.32Å; Y292-I296 WeakPolarHBondContact O-CG1 3.14Å; F293-I296 HydrophobicContact CD1-CD1 3.81Å; F293-I296 HydrophobicContact CE1-CD1 4.24Å
297	Y	47.4	Very low	39.2	Very low	128 Å²	128	104.1 Å²	104.1	50%	0.502	50%	0.496	S	S	.	.			trans	-99.8	112.9	169.4	-70.9	-93.9	0	0	0	109.8	W14 L21	W14-Y297 HydrophobicContact CH2-CD2 4.35Å; W14-Y297 HydrophobicContact CH2-CE2 4.15Å; W14-Y297 AromaticContact CZ2-CD2 3.57Å; W14-Y297 HydrophobicContact CZ2-CD2 3.57Å; W14-Y297 AromaticContact CZ2-CE2 3.73Å; W14-Y297 HydrophobicContact CZ2-CE2 3.73Å; L21-Y297 HydrophobicContact CD2-CG 4.33Å
298	Y	55	Low	39	Very low	42 Å²	42	105.2 Å²	105.2	17%	0.165	49%	0.493	C	S	.	.				176.4	144.2	120.3	-170.7	-108.4	0	0	0	112.5	H5 S7 V9	H5-Y298 HydrophobicContact CB-CE2 4.46Å; H5-Y298 WeakPolarHBondContact CB-OH 3.19Å; S7-Y298 PolarHBondContact O-OH 2.73Å; S7-Y298 VanDerWaalsContact O-OH 3.06Å; V9-Y298 HydrophobicContact CB-CD1 3.77Å; V9-Y298 HydrophobicContact CB-CD2 4.4Å; V9-Y298 HydrophobicContact CB-CE1 3.56Å; V9-Y298 HydrophobicContact CB-CE2 4.24Å; V9-Y298 HydrophobicContact CB-CG 4.19Å; V9-Y298 HydrophobicContact CG2-CD1 3.99Å; V9-Y298 HydrophobicContact CG2-CD2 3.87Å; V9-Y298 HydrophobicContact CG2-CE1 3.5Å; V9-Y298 HydrophobicContact CG2-CE2 3.38Å; V9-Y298 HydrophobicContact CG2-CG 4.16Å; V9-Y298 WeakPolarHBondContact CG2-OH 3.36Å
299	I	41.1	Very low	38.7	Very low	116 Å²	116	108.7 Å²	108.7	60%	0.595	51%	0.511	S	S	*	.			trans	-111.8	120.8	178.6	-68.7	166	0	0	0	108
300	G	38.1	Very low	38.3	Very low	7 Å²	7	105.9 Å²	105.9	7%	0.072	50%	0.497	C	S	.	.			trans	-50.5	144.1	174.1	0	0	0	0	0	113.2
301	G	33.2	Very low	38.1	Very low	24 Å²	24	99 Å²	99	25%	0.247	48%	0.478	C	S	.	.			trans	-60.1	137.5	-168.5	0	0	0	0	0	115	N303	G301-N303 PolarHBondContact O-N 3.25Å; G301-N303 VanDerWaalsContact O-N 3.14Å
302	R	28.3	Very low	38	Very low	203 Å²	203	98.7 Å²	98.7	77%	0.766	48%	0.482	S	S	*	.			trans	-55.8	113.4	169.2	-76.1	-176.3	175.4	-175.7	-1.5	110.6
303	N	25.8	Very low	37.3	Very low	148 Å²	148	102 Å²	102	79%	0.791	50%	0.502	S	S	*	.			trans	-115.4	88.4	152	-92.3	-24.3	0	0	0	109	G301	G301-N303 PolarHBondContact O-N 3.25Å; G301-N303 VanDerWaalsContact O-N 3.14Å
304	R	24.4	Very low	36.6	Very low	230 Å²	230	106.8 Å²	106.8	87%	0.868	53%	0.527	S	S	*	.			trans	-138	88.9	150.9	-76	-161.4	-173.6	-172.3	4.1	109.2
305	F	23.8	Very low	36.1	Very low	210 Å²	210	109.9 Å²	109.9	92%	0.921	53%	0.531	S	S	*	.			trans	-87	95.9	143.2	-79.4	-83	0	0	0	106.7
306	S	23.1	Very low	35.3	Very low	177 Å²	177	118.2 Å²	118.2	100%	1.238	57%	0.567	S	S	*	*			trans	-178.5	0	150.3	64.9	0	0	0	0	108.1

Retrieved 306 of 306 residues in 158.5 ms (Link to these results)

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