A0A093HS71_STRCA Loading...

F-box/WD repeat-containing protein 2

Substrate-recognition component of the SCF (SKP1-CUL1-F-box protein)-type E3 ubiquitin ligase complex.

AlphaFold DB , UniProt , Accession A0A093HS71, Species STRCA (Struthio camelus australis), Gene n/a, Length 454 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	50.5	Low	57.2	Low	155 Å²	155	117.3 Å²	117.3	76%	0.764	56%	0.564	S	S	*	*				0	121.8	0	-115.2	169.4	129.1	0	0	107.3	D5 F6 W9	M1-D5 HydrophobicContact CE-CB 4.23Å; M1-D5 VanDerWaalsContact CE-O 3.3Å; M1-D5 WeakPolarHBondContact CE-O 3.49Å; M1-D5 HydrophobicContact CG-CB 4.33Å; M1-F6 VanDerWaalsContact CE-CA 3.48Å; M1-F6 HydrophobicContact CE-CB 4.13Å; M1-F6 HydrophobicContact CE-CD2 4.21Å; M1-F6 HydrophobicContact SD-CB 4.31Å; M1-F6 HydrophobicContact SD-CD2 3.94Å; M1-W9 HydrophobicContact CE-CB 3.71Å; M1-W9 HydrophobicContact CE-CG 4.06Å
2	E	53.2	Low	58.2	Low	151 Å²	151	116.3 Å²	116.3	71%	0.706	56%	0.564	S	S	*	*			trans	-62.5	146.1	167.8	-71.1	-172.6	167.4	0	0	108.7	K4 D5 F6	E2-K4 PolarHBondContact O-N 3.27Å; E2-K4 VanDerWaalsContact O-N 3.07Å; E2-D5 PolarHBondContact O-N 3.32Å; E2-F6 PolarHBondContact O-N 2.87Å
3	K	52.3	Low	59	Low	166 Å²	166	112.2 Å²	112.2	72%	0.722	55%	0.546	S	S	*	.	H	α-helix	trans	-55.7	-32.6	-170	-160.8	179.6	177.8	-172.2	0	113	F6 E7	K3-F6 PolarHBondContact O-N 3.41Å; K3-E7 WeakPolarHBondContact O-CG 3.27Å; K3-E7 PolarHBondContact O-N 2.96Å; K3-E7 VanDerWaalsContact O-N 3.12Å
4	K	54.9	Low	59.7	Low	167 Å²	167	105.6 Å²	105.6	73%	0.726	52%	0.517	S	S	*	.	H	α-helix	trans	-67.7	-40.6	176.2	-93.3	-175.3	170.1	-178	0	113.7	E2 F6 E7 A8	E2-K4 PolarHBondContact O-N 3.27Å; E2-K4 VanDerWaalsContact O-N 3.07Å; K4-F6 VanDerWaalsContact C-N 3.26Å; K4-F6 PolarHBondContact O-N 2.97Å; K4-E7 PolarHBondContact O-N 2.98Å; K4-A8 WeakPolarHBondContact O-CB 3.39Å; K4-A8 PolarHBondContact O-N 3.26Å
5	D	50.3	Low	60.6	Low	90 Å²	90	106.2 Å²	106.2	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-69	-33.3	179.5	-60	-28.5	0	0	0	110.6	M1 E2 W9	M1-D5 HydrophobicContact CE-CB 4.23Å; M1-D5 VanDerWaalsContact CE-O 3.3Å; M1-D5 WeakPolarHBondContact CE-O 3.49Å; M1-D5 HydrophobicContact CG-CB 4.33Å; E2-D5 PolarHBondContact O-N 3.32Å; D5-W9 VanDerWaalsContact O-CB 3.25Å; D5-W9 WeakPolarHBondContact O-CB 3.38Å; D5-W9 PolarHBondContact O-N 2.78Å
6	F	54	Low	61.1	Low	97 Å²	97	104.5 Å²	104.5	43%	0.425	52%	0.519	S	S	.	.	H	α-helix	trans	-69.5	-42.8	176.2	-174.2	-101.1	0	0	0	112	M1 E2 K3 K4 W9 L10	M1-F6 VanDerWaalsContact CE-CA 3.48Å; M1-F6 HydrophobicContact CE-CB 4.13Å; M1-F6 HydrophobicContact CE-CD2 4.21Å; M1-F6 HydrophobicContact SD-CB 4.31Å; M1-F6 HydrophobicContact SD-CD2 3.94Å; E2-F6 PolarHBondContact O-N 2.87Å; K3-F6 PolarHBondContact O-N 3.41Å; K4-F6 VanDerWaalsContact C-N 3.26Å; K4-F6 PolarHBondContact O-N 2.97Å; F6-W9 HydrophobicContact CD2-CE3 4.17Å; F6-W9 HydrophobicContact CD2-CZ3 4.5Å; F6-W9 AromaticContact CE2-CE3 3.96Å; F6-W9 HydrophobicContact CE2-CE3 3.96Å; F6-W9 AromaticContact CE2-CZ3 3.84Å; F6-W9 HydrophobicContact CE2-CZ3 3.84Å; F6-W9 HydrophobicContact CZ-CZ3 4.39Å; F6-W9 PolarHBondContact O-N 2.99Å; F6-L10 HydrophobicContact CE1-CD1 4.14Å; F6-L10 HydrophobicContact CZ-CD1 4.06Å; F6-L10 WeakPolarHBondContact O-CB 3.28Å; F6-L10 PolarHBondContact O-N 3.43Å
7	E	57.5	Low	61.5	Low	103 Å²	103	99.7 Å²	99.7	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-43.7	175.2	-74.3	169.3	-179	0	0	111.3	K3 K4 W9 L10 D11	K3-E7 WeakPolarHBondContact O-CG 3.27Å; K3-E7 PolarHBondContact O-N 2.96Å; K3-E7 VanDerWaalsContact O-N 3.12Å; K4-E7 PolarHBondContact O-N 2.98Å; E7-W9 PolarHBondContact O-N 3.07Å; E7-L10 PolarHBondContact O-N 2.8Å; E7-D11 PolarHBondContact O-N 2.97Å
8	A	62.7	Low	61.5	Low	60 Å²	60	99.7 Å²	99.7	50%	0.496	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-37.4	176.2	0	0	0	0	0	113.2	K4 N12	K4-A8 WeakPolarHBondContact O-CB 3.39Å; K4-A8 PolarHBondContact O-N 3.26Å; A8-N12 WeakPolarHBondContact O-CB 3.06Å; A8-N12 PolarHBondContact O-N 2.89Å; A8-N12 VanDerWaalsContact O-N 3.16Å
9	W	67.6	Low	62.2	Low	127 Å²	127	99.5 Å²	99.5	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-66.5	-39.9	173.8	176.3	83.1	0	0	0	112	M1 D5 F6 E7 N12 I13	M1-W9 HydrophobicContact CE-CB 3.71Å; M1-W9 HydrophobicContact CE-CG 4.06Å; D5-W9 VanDerWaalsContact O-CB 3.25Å; D5-W9 WeakPolarHBondContact O-CB 3.38Å; D5-W9 PolarHBondContact O-N 2.78Å; F6-W9 HydrophobicContact CD2-CE3 4.17Å; F6-W9 HydrophobicContact CD2-CZ3 4.5Å; F6-W9 AromaticContact CE2-CE3 3.96Å; F6-W9 HydrophobicContact CE2-CE3 3.96Å; F6-W9 AromaticContact CE2-CZ3 3.84Å; F6-W9 HydrophobicContact CE2-CZ3 3.84Å; F6-W9 HydrophobicContact CZ-CZ3 4.39Å; F6-W9 PolarHBondContact O-N 2.99Å; E7-W9 PolarHBondContact O-N 3.07Å; W9-N12 PolarHBondContact O-N 3.44Å; W9-I13 HydrophobicContact CD2-CD1 3.7Å; W9-I13 HydrophobicContact CE3-CD1 3.93Å; W9-I13 HydrophobicContact CH2-CD1 3.37Å; W9-I13 HydrophobicContact CZ2-CD1 3.1Å; W9-I13 HydrophobicContact CZ2-CG1 4.45Å; W9-I13 HydrophobicContact CZ3-CD1 3.77Å; W9-I13 WeakPolarHBondContact O-CG1 3.37Å; W9-I13 PolarHBondContact O-N 3.25Å
10	L	60	Low	62.7	Low	65 Å²	65	97.1 Å²	97.1	34%	0.34	49%	0.493	S	S	.	.	H	α-helix	trans	-64.4	-43.4	177.9	-152.5	90.2	0	0	0	111.7	F6 E7 N12 I13 S14 P61	F6-L10 HydrophobicContact CE1-CD1 4.14Å; F6-L10 HydrophobicContact CZ-CD1 4.06Å; F6-L10 WeakPolarHBondContact O-CB 3.28Å; F6-L10 PolarHBondContact O-N 3.43Å; E7-L10 PolarHBondContact O-N 2.8Å; L10-N12 VanDerWaalsContact C-N 3.32Å; L10-N12 PolarHBondContact O-N 2.74Å; L10-I13 PolarHBondContact O-N 2.87Å; L10-S14 PolarHBondContact O-N 3.41Å; L10-P61 HydrophobicContact CD2-CG 4.43Å
11	D	66.4	Low	63.1	Low	109 Å²	109	96.4 Å²	96.4	58%	0.583	49%	0.494	S	S	*	.	H	α-helix	trans	-61.7	-41.4	175.9	-82.4	-13.6	0	0	0	111.5	E7 I13 S14 I15	E7-D11 PolarHBondContact O-N 2.97Å; D11-I13 VanDerWaalsContact C-N 3.34Å; D11-I13 PolarHBondContact O-N 3.48Å; D11-S14 PolarHBondContact O-N 3.39Å; D11-I15 WeakPolarHBondContact O-CG1 3.3Å; D11-I15 PolarHBondContact O-N 3.26Å; D11-I15 VanDerWaalsContact O-N 3.12Å
12	N	68.8	Low	63.4	Low	106 Å²	106	92.9 Å²	92.9	57%	0.567	48%	0.478	S	S	*	.	H	α-helix	trans	-67.6	-36	179.6	-148.1	-2.7	0	0	0	112	A8 W9 L10 T16	A8-N12 WeakPolarHBondContact O-CB 3.06Å; A8-N12 PolarHBondContact O-N 2.89Å; A8-N12 VanDerWaalsContact O-N 3.16Å; W9-N12 PolarHBondContact O-N 3.44Å; L10-N12 VanDerWaalsContact C-N 3.32Å; L10-N12 PolarHBondContact O-N 2.74Å; N12-T16 PolarHBondContact O-N 3.49Å; N12-T16 VanDerWaalsContact O-N 3.07Å; N12-T16 PolarHBondContact O-OG1 3.47Å
13	I	68.9	Low	63.5	Low	63 Å²	63	91.6 Å²	91.6	32%	0.323	48%	0.475	S	S	.	.	H	α-helix	trans	-66.2	-41.5	172.8	-76.8	-179.8	0	0	0	111.9	W9 L10 D11 I15 T16 F17	W9-I13 HydrophobicContact CD2-CD1 3.7Å; W9-I13 HydrophobicContact CE3-CD1 3.93Å; W9-I13 HydrophobicContact CH2-CD1 3.37Å; W9-I13 HydrophobicContact CZ2-CD1 3.1Å; W9-I13 HydrophobicContact CZ2-CG1 4.45Å; W9-I13 HydrophobicContact CZ3-CD1 3.77Å; W9-I13 WeakPolarHBondContact O-CG1 3.37Å; W9-I13 PolarHBondContact O-N 3.25Å; L10-I13 PolarHBondContact O-N 2.87Å; D11-I13 VanDerWaalsContact C-N 3.34Å; D11-I13 PolarHBondContact O-N 3.48Å; I13-I15 VanDerWaalsContact C-N 3.31Å; I13-I15 PolarHBondContact O-N 2.66Å; I13-T16 WeakPolarHBondContact CA-OG1 3.14Å; I13-T16 PolarHBondContact O-N 3.33Å; I13-T16 PolarHBondContact O-OG1 2.89Å; I13-F17 VanDerWaalsContact O-CB 3.26Å; I13-F17 WeakPolarHBondContact O-CB 3.41Å; I13-F17 PolarHBondContact O-N 3.39Å
14	S	68.9	Low	63.8	Low	20 Å²	20	87.7 Å²	87.7	14%	0.14	46%	0.46	C	S	.	.	H	α-helix	trans	-60.7	-43.7	178.2	-168.5	0	0	0	0	111.2	L10 D11 F17 L18 E63	L10-S14 PolarHBondContact O-N 3.41Å; D11-S14 PolarHBondContact O-N 3.39Å; S14-F17 PolarHBondContact O-N 3.26Å; S14-L18 WeakPolarHBondContact O-CG 3.25Å; S14-L18 PolarHBondContact O-N 3.18Å; S14-L18 VanDerWaalsContact O-N 3.1Å; S14-E63 PolarHBondContact OG-OE2 2.94Å
15	I	72.4	Confident	64.1	Low	114 Å²	114	81.1 Å²	81.1	59%	0.585	43%	0.431	S	S	*	.	H	α-helix	trans	-63.4	-44.5	177.3	-65	166.4	0	0	0	111.3	D11 I13 L18	D11-I15 WeakPolarHBondContact O-CG1 3.3Å; D11-I15 PolarHBondContact O-N 3.26Å; D11-I15 VanDerWaalsContact O-N 3.12Å; I13-I15 VanDerWaalsContact C-N 3.31Å; I13-I15 PolarHBondContact O-N 2.66Å; I15-L18 PolarHBondContact O-N 3.18Å
16	T	68.5	Low	64.3	Low	79 Å²	79	79.7 Å²	79.7	49%	0.485	42%	0.423	S	S	.	.	H	α-helix	trans	-69.6	-37.1	178.9	22.6	0	0	0	0	112.4	N12 I13 L18 S19	N12-T16 PolarHBondContact O-N 3.49Å; N12-T16 VanDerWaalsContact O-N 3.07Å; N12-T16 PolarHBondContact O-OG1 3.47Å; I13-T16 WeakPolarHBondContact CA-OG1 3.14Å; I13-T16 PolarHBondContact O-N 3.33Å; I13-T16 PolarHBondContact O-OG1 2.89Å; T16-L18 VanDerWaalsContact C-N 3.32Å; T16-L18 PolarHBondContact O-N 3.38Å; T16-S19 PolarHBondContact O-N 3.44Å; T16-S19 PolarHBondContact O-OG 2.87Å
17	F	68	Low	64.6	Low	23 Å²	23	80.7 Å²	80.7	10%	0.101	43%	0.429	C	S	.	.	H	α-helix	trans	-64.2	-36.9	177.4	-171.1	-96	0	0	0	112.2	I13 S14 S19 L20 K25 L29 L64	I13-F17 VanDerWaalsContact O-CB 3.26Å; I13-F17 WeakPolarHBondContact O-CB 3.41Å; I13-F17 PolarHBondContact O-N 3.39Å; S14-F17 PolarHBondContact O-N 3.26Å; F17-S19 PolarHBondContact O-N 2.81Å; F17-L20 HydrophobicContact CD2-CD1 4.41Å; F17-L20 PolarHBondContact O-N 2.68Å; F17-K25 HydrophobicContact CD1-CD 4.32Å; F17-K25 HydrophobicContact CD1-CG 4.32Å; F17-K25 HydrophobicContact CD2-CG 4.34Å; F17-K25 HydrophobicContact CE1-CB 4.23Å; F17-K25 HydrophobicContact CE1-CD 3.73Å; F17-K25 HydrophobicContact CE1-CG 3.79Å; F17-K25 HydrophobicContact CE2-CB 3.86Å; F17-K25 HydrophobicContact CE2-CG 3.82Å; F17-K25 HydrophobicContact CZ-CB 3.53Å; F17-K25 HydrophobicContact CZ-CD 3.93Å; F17-K25 HydrophobicContact CZ-CG 3.52Å; F17-K25 WeakPolarHBondContact O-CE 3.27Å; F17-L29 HydrophobicContact CE2-CG 4.46Å; F17-L29 HydrophobicContact CZ-CD1 4.18Å; F17-L64 HydrophobicContact CD1-CD2 3.97Å; F17-L64 HydrophobicContact CE1-CD2 3.37Å; F17-L64 HydrophobicContact CE1-CG 4.37Å; F17-L64 HydrophobicContact CE2-CD2 4.01Å; F17-L64 HydrophobicContact CZ-CD2 3.38Å
18	L	62.8	Low	64.8	Low	100 Å²	100	78.3 Å²	78.3	52%	0.524	42%	0.422	S	S	.	.	H	α-helix	trans	-61.6	-29	176.6	-79.2	162.1	0	0	0	113.2	S14 I15 T16 L20 E63	S14-L18 WeakPolarHBondContact O-CG 3.25Å; S14-L18 PolarHBondContact O-N 3.18Å; S14-L18 VanDerWaalsContact O-N 3.1Å; I15-L18 PolarHBondContact O-N 3.18Å; T16-L18 VanDerWaalsContact C-N 3.32Å; T16-L18 PolarHBondContact O-N 3.38Å; L18-L20 VanDerWaalsContact C-N 3.29Å; L18-L20 PolarHBondContact O-N 3.31Å; L18-E63 HydrophobicContact CD1-CG 4.27Å; L18-E63 HydrophobicContact CD2-CG 4.09Å; L18-E63 HydrophobicContact CG-CG 4.35Å
19	S	73.4	Confident	64.7	Low	96 Å²	96	77.8 Å²	77.8	67%	0.671	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-7.7	179.9	73.8	0	0	0	0	114.8	T16 F17	T16-S19 PolarHBondContact O-N 3.44Å; T16-S19 PolarHBondContact O-OG 2.87Å; F17-S19 PolarHBondContact O-N 2.81Å
20	L	72.3	Confident	64.1	Low	51 Å²	51	77 Å²	77	27%	0.267	42%	0.416	S	S	.	.	S	Bend	trans	-88.7	152.6	-175.9	-64.2	174.8	0	0	0	112.8	F17 L18 Q24 K25	F17-L20 HydrophobicContact CD2-CD1 4.41Å; F17-L20 PolarHBondContact O-N 2.68Å; L18-L20 VanDerWaalsContact C-N 3.29Å; L18-L20 PolarHBondContact O-N 3.31Å; L20-Q24 HydrophobicContact CB-CB 4.2Å; L20-Q24 HydrophobicContact CD2-CB 4.4Å; L20-K25 HydrophobicContact CB-CG 3.82Å; L20-K25 WeakPolarHBondContact O-CE 3.37Å; L20-K25 PolarHBondContact O-NZ 3.07Å
21	T	71.1	Confident	63.7	Low	82 Å²	82	79.1 Å²	79.1	50%	0.503	42%	0.424	S	S	.	.			trans	-73.3	157.2	170.6	60.3	0	0	0	0	111.7	L23 Q24 K25	T21-L23 VanDerWaalsContact C-N 3.28Å; T21-L23 PolarHBondContact O-N 3.34Å; T21-Q24 WeakPolarHBondContact O-CB 3.39Å; T21-Q24 PolarHBondContact O-N 3.24Å; T21-Q24 VanDerWaalsContact OG1-CG 3.27Å; T21-Q24 WeakPolarHBondContact OG1-CG 3.47Å; T21-Q24 PolarHBondContact OG1-OE1 3.39Å; T21-K25 WeakPolarHBondContact O-CG 3.48Å; T21-K25 PolarHBondContact O-N 3.02Å
22	D	56.9	Low	63.3	Low	82 Å²	82	78.1 Å²	78.1	44%	0.439	42%	0.418	S	S	.	.	H	α-helix	trans	-59.4	-34.2	-175.3	-75.3	-8.4	0	0	0	113.7	N26	D22-N26 PolarHBondContact O-N 3.46Å; D22-N26 PolarHBondContact O-ND2 3.31Å
23	L	54.8	Low	62.7	Low	123 Å²	123	78.6 Å²	78.6	64%	0.644	42%	0.419	S	S	*	.	H	α-helix	trans	-66.1	-46.3	174.3	-164.8	92.2	0	0	0	111.1	T21 K25 N26 E27	T21-L23 VanDerWaalsContact C-N 3.28Å; T21-L23 PolarHBondContact O-N 3.34Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 2.99Å; L23-N26 PolarHBondContact O-N 3.16Å; L23-E27 PolarHBondContact O-N 3.47Å
24	Q	59.7	Low	61.9	Low	84 Å²	84	79.7 Å²	79.7	39%	0.393	43%	0.433	S	S	.	.	H	α-helix	trans	-64.9	-39.5	178.5	-71.5	170.1	-33.9	0	0	111.1	L20 T21 N26 E27 T28	L20-Q24 HydrophobicContact CB-CB 4.2Å; L20-Q24 HydrophobicContact CD2-CB 4.4Å; T21-Q24 WeakPolarHBondContact O-CB 3.39Å; T21-Q24 PolarHBondContact O-N 3.24Å; T21-Q24 VanDerWaalsContact OG1-CG 3.27Å; T21-Q24 WeakPolarHBondContact OG1-CG 3.47Å; T21-Q24 PolarHBondContact OG1-OE1 3.39Å; Q24-N26 VanDerWaalsContact C-N 3.3Å; Q24-N26 PolarHBondContact O-N 2.93Å; Q24-E27 PolarHBondContact O-N 3.46Å; Q24-T28 PolarHBondContact O-N 3.45Å; Q24-T28 PolarHBondContact O-OG1 2.71Å
25	K	62.1	Low	60.9	Low	30 Å²	30	84.2 Å²	84.2	13%	0.13	46%	0.455	C	S	.	.	H	α-helix	trans	-57.6	-42.6	175.5	-75.9	175.9	176.2	157	0	112.3	F17 L20 T21 L23 L29	F17-K25 HydrophobicContact CD1-CD 4.32Å; F17-K25 HydrophobicContact CD1-CG 4.32Å; F17-K25 HydrophobicContact CD2-CG 4.34Å; F17-K25 HydrophobicContact CE1-CB 4.23Å; F17-K25 HydrophobicContact CE1-CD 3.73Å; F17-K25 HydrophobicContact CE1-CG 3.79Å; F17-K25 HydrophobicContact CE2-CB 3.86Å; F17-K25 HydrophobicContact CE2-CG 3.82Å; F17-K25 HydrophobicContact CZ-CB 3.53Å; F17-K25 HydrophobicContact CZ-CD 3.93Å; F17-K25 HydrophobicContact CZ-CG 3.52Å; F17-K25 WeakPolarHBondContact O-CE 3.27Å; L20-K25 HydrophobicContact CB-CG 3.82Å; L20-K25 WeakPolarHBondContact O-CE 3.37Å; L20-K25 PolarHBondContact O-NZ 3.07Å; T21-K25 WeakPolarHBondContact O-CG 3.48Å; T21-K25 PolarHBondContact O-N 3.02Å; L23-K25 VanDerWaalsContact C-N 3.34Å; L23-K25 PolarHBondContact O-N 2.99Å; K25-L29 PolarHBondContact O-N 3.01Å; K25-L29 VanDerWaalsContact O-N 3.09Å
26	N	53.5	Low	59.8	Low	59 Å²	59	80.8 Å²	80.8	32%	0.316	44%	0.441	S	S	.	.	H	α-helix	trans	-65.7	-45.6	175.8	-72.4	-20.2	0	0	0	111.4	D22 L23 Q24 T28 L29 D30 Y67	D22-N26 PolarHBondContact O-N 3.46Å; D22-N26 PolarHBondContact O-ND2 3.31Å; L23-N26 PolarHBondContact O-N 3.16Å; Q24-N26 VanDerWaalsContact C-N 3.3Å; Q24-N26 PolarHBondContact O-N 2.93Å; N26-T28 VanDerWaalsContact C-N 3.34Å; N26-T28 PolarHBondContact O-N 3.5Å; N26-L29 WeakPolarHBondContact O-CB 3.47Å; N26-L29 PolarHBondContact O-N 2.82Å; N26-D30 PolarHBondContact O-N 3.38Å; N26-Y67 VanDerWaalsContact CG-OH 3.24Å; N26-Y67 PolarHBondContact ND2-OH 3.41Å; N26-Y67 VanDerWaalsContact OD1-CE1 3.24Å; N26-Y67 WeakPolarHBondContact OD1-CE1 3.45Å; N26-Y67 PolarHBondContact OD1-OH 3.12Å
27	E	61.1	Low	58.8	Low	118 Å²	118	78.7 Å²	78.7	55%	0.551	44%	0.435	S	S	*	.	H	α-helix	trans	-61.9	-39.5	176.4	-71.9	179.8	163.3	0	0	112.2	L23 Q24 L29 D30 H31	L23-E27 PolarHBondContact O-N 3.47Å; Q24-E27 PolarHBondContact O-N 3.46Å; E27-L29 VanDerWaalsContact C-N 3.33Å; E27-L29 PolarHBondContact O-N 3.42Å; E27-D30 PolarHBondContact O-N 3.21Å; E27-H31 WeakPolarHBondContact O-CB 3.41Å; E27-H31 PolarHBondContact O-N 2.83Å
28	T	61.9	Low	57.9	Low	53 Å²	53	81.4 Å²	81.4	33%	0.325	46%	0.462	S	S	.	.	H	α-helix	trans	-66.8	-35.5	177	-35	0	0	0	0	111.7	Q24 N26 L32	Q24-T28 PolarHBondContact O-N 3.45Å; Q24-T28 PolarHBondContact O-OG1 2.71Å; N26-T28 VanDerWaalsContact C-N 3.34Å; N26-T28 PolarHBondContact O-N 3.5Å; T28-L32 VanDerWaalsContact O-CB 3.3Å; T28-L32 WeakPolarHBondContact O-CB 3.41Å; T28-L32 PolarHBondContact O-N 2.77Å
29	L	59	Low	57	Low	49 Å²	49	81.6 Å²	81.6	26%	0.257	47%	0.467	S	S	.	.	H	α-helix	trans	-67.8	-47.6	175.1	-88.2	161.6	0	0	0	111.3	F17 K25 N26 E27 H31 L32 I33 L64	F17-L29 HydrophobicContact CE2-CG 4.46Å; F17-L29 HydrophobicContact CZ-CD1 4.18Å; K25-L29 PolarHBondContact O-N 3.01Å; K25-L29 VanDerWaalsContact O-N 3.09Å; N26-L29 WeakPolarHBondContact O-CB 3.47Å; N26-L29 PolarHBondContact O-N 2.82Å; E27-L29 VanDerWaalsContact C-N 3.33Å; E27-L29 PolarHBondContact O-N 3.42Å; L29-H31 VanDerWaalsContact C-N 3.25Å; L29-H31 PolarHBondContact O-N 3.28Å; L29-L32 PolarHBondContact O-N 3.44Å; L29-I33 WeakPolarHBondContact O-CD1 3.45Å; L29-I33 VanDerWaalsContact O-CG1 3.23Å; L29-I33 WeakPolarHBondContact O-CG1 3.41Å; L29-I33 PolarHBondContact O-N 2.92Å; L29-L64 HydrophobicContact CD1-CD2 4.37Å; L29-L64 HydrophobicContact CD2-CD2 4.47Å
30	D	54.7	Low	55.8	Low	110 Å²	110	82.6 Å²	82.6	59%	0.588	46%	0.461	S	S	*	.	H	α-helix	trans	-61.5	-38.2	174.7	-75.4	-24.4	0	0	0	111.1	N26 E27 I33 S34	N26-D30 PolarHBondContact O-N 3.38Å; E27-D30 PolarHBondContact O-N 3.21Å; D30-I33 PolarHBondContact O-N 3.47Å; D30-S34 WeakPolarHBondContact O-CB 3.49Å; D30-S34 PolarHBondContact O-N 3.12Å; D30-S34 PolarHBondContact O-OG 2.94Å
31	H	52	Low	54.7	Low	110 Å²	110	84.8 Å²	84.8	51%	0.509	47%	0.473	S	S	.	.	H	α-helix	trans	-69	-41.2	176.8	-160.6	-16.6	0	0	0	111.9	E27 L29 I33 S34 L35	E27-H31 WeakPolarHBondContact O-CB 3.41Å; E27-H31 PolarHBondContact O-N 2.83Å; L29-H31 VanDerWaalsContact C-N 3.25Å; L29-H31 PolarHBondContact O-N 3.28Å; H31-I33 VanDerWaalsContact C-N 3.33Å; H31-I33 PolarHBondContact O-N 3.21Å; H31-S34 WeakPolarHBondContact CA-OG 3.27Å; H31-S34 PolarHBondContact ND1-OG 3.06Å; H31-S34 PolarHBondContact O-N 3.08Å; H31-S34 PolarHBondContact O-OG 3.42Å; H31-L35 VanDerWaalsContact CE1-CD1 3.49Å; H31-L35 WeakPolarHBondContact CE1-CD1 3.46Å; H31-L35 VanDerWaalsContact ND1-CD1 3.27Å; H31-L35 WeakPolarHBondContact ND1-CD1 3.23Å; H31-L35 WeakPolarHBondContact ND1-CG 3.5Å; H31-L35 WeakPolarHBondContact O-CB 3.48Å; H31-L35 VanDerWaalsContact O-CG 3.28Å; H31-L35 WeakPolarHBondContact O-CG 3.3Å; H31-L35 PolarHBondContact O-N 2.69Å
32	L	58.8	Low	53.3	Low	88 Å²	88	89.1 Å²	89.1	46%	0.461	48%	0.479	S	S	.	.	H	α-helix	trans	-60.4	-42.6	173.3	-100.8	156.9	0	0	0	111.6	T28 L29 L35 S36	T28-L32 VanDerWaalsContact O-CB 3.3Å; T28-L32 WeakPolarHBondContact O-CB 3.41Å; T28-L32 PolarHBondContact O-N 2.77Å; L29-L32 PolarHBondContact O-N 3.44Å; L32-L35 PolarHBondContact O-N 3.28Å; L32-S36 WeakPolarHBondContact O-CB 3.13Å; L32-S36 PolarHBondContact O-N 3.48Å; L32-S36 PolarHBondContact O-OG 3.43Å
33	I	56	Low	52.7	Low	116 Å²	116	91 Å²	91	60%	0.595	49%	0.485	S	S	*	.	H	α-helix	trans	-65.7	-41.5	176.7	-67.5	164.3	0	0	0	110.2	L29 D30 H31 S36	L29-I33 WeakPolarHBondContact O-CD1 3.45Å; L29-I33 VanDerWaalsContact O-CG1 3.23Å; L29-I33 WeakPolarHBondContact O-CG1 3.41Å; L29-I33 PolarHBondContact O-N 2.92Å; D30-I33 PolarHBondContact O-N 3.47Å; H31-I33 VanDerWaalsContact C-N 3.33Å; H31-I33 PolarHBondContact O-N 3.21Å; I33-S36 PolarHBondContact O-N 3.31Å
34	S	52.4	Low	52.3	Low	87 Å²	87	90.3 Å²	90.3	61%	0.608	48%	0.482	S	S	*	.	H	α-helix	trans	-68.6	-31.7	177.9	77.3	0	0	0	0	114	D30 H31 S36	D30-S34 WeakPolarHBondContact O-CB 3.49Å; D30-S34 PolarHBondContact O-N 3.12Å; D30-S34 PolarHBondContact O-OG 2.94Å; H31-S34 WeakPolarHBondContact CA-OG 3.27Å; H31-S34 PolarHBondContact ND1-OG 3.06Å; H31-S34 PolarHBondContact O-N 3.08Å; H31-S34 PolarHBondContact O-OG 3.42Å; S34-S36 VanDerWaalsContact C-N 3.31Å
35	L	47.4	Very low	51.5	Low	114 Å²	114	88.7 Å²	88.7	60%	0.597	48%	0.48	S	S	*	.	H	α-helix	trans	-78.8	-17.3	177.6	-75.5	166.9	0	0	0	112.6	H31 L32 G37 Q40	H31-L35 VanDerWaalsContact CE1-CD1 3.49Å; H31-L35 WeakPolarHBondContact CE1-CD1 3.46Å; H31-L35 VanDerWaalsContact ND1-CD1 3.27Å; H31-L35 WeakPolarHBondContact ND1-CD1 3.23Å; H31-L35 WeakPolarHBondContact ND1-CG 3.5Å; H31-L35 WeakPolarHBondContact O-CB 3.48Å; H31-L35 VanDerWaalsContact O-CG 3.28Å; H31-L35 WeakPolarHBondContact O-CG 3.3Å; H31-L35 PolarHBondContact O-N 2.69Å; L32-L35 PolarHBondContact O-N 3.28Å; L35-G37 PolarHBondContact O-N 3.12Å; L35-Q40 PolarHBondContact O-OE1 3.21Å
36	S	49.6	Very low	50.4	Low	42 Å²	42	91.1 Å²	91.1	29%	0.294	49%	0.494	S	S	.	.	S	Bend	trans	-82.9	96.1	179.6	-59	0	0	0	0	110.2	L32 I33 S34	L32-S36 WeakPolarHBondContact O-CB 3.13Å; L32-S36 PolarHBondContact O-N 3.48Å; L32-S36 PolarHBondContact O-OG 3.43Å; I33-S36 PolarHBondContact O-N 3.31Å; S34-S36 VanDerWaalsContact C-N 3.31Å
37	G	48.2	Very low	50	Low	35 Å²	35	94.3 Å²	94.3	36%	0.361	51%	0.511	S	S	.	.			trans	-67.3	156.9	177.5	0	0	0	0	0	112.8	L35 V39 Q40 L41	L35-G37 PolarHBondContact O-N 3.12Å; G37-V39 PolarHBondContact O-N 3.21Å; G37-Q40 PolarHBondContact O-N 3.1Å; G37-L41 PolarHBondContact O-N 3.27Å
38	A	48	Very low	49	Very low	80 Å²	80	91.1 Å²	91.1	66%	0.661	50%	0.498	S	S	*	.	H	α-helix	trans	-52	-29	179.5	0	0	0	0	0	113.6	R42	A38-R42 WeakPolarHBondContact O-CB 3Å; A38-R42 PolarHBondContact O-N 3.22Å
39	V	43.4	Very low	47.8	Very low	105 Å²	105	94.9 Å²	94.9	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-76.4	-35.4	176.5	-179.7	0	0	0	0	112.5	G37 R42 H43	G37-V39 PolarHBondContact O-N 3.21Å; V39-R42 PolarHBondContact O-N 3.44Å; V39-H43 WeakPolarHBondContact O-CB 3.19Å; V39-H43 PolarHBondContact O-N 3.43Å
40	Q	48.8	Very low	47	Very low	116 Å²	116	100.3 Å²	100.3	54%	0.542	54%	0.539	S	S	.	.	H	α-helix	trans	-72.7	-39.3	174.3	-75.8	156.5	-22.6	0	0	110.9	L35 G37 R42 H43 L44	L35-Q40 PolarHBondContact O-OE1 3.21Å; G37-Q40 PolarHBondContact O-N 3.1Å; Q40-R42 VanDerWaalsContact C-N 3.3Å; Q40-R42 PolarHBondContact O-N 3.39Å; Q40-H43 PolarHBondContact O-N 2.84Å; Q40-L44 WeakPolarHBondContact O-CB 3.46Å; Q40-L44 PolarHBondContact O-N 3.29Å
41	L	49.7	Very low	46.4	Very low	98 Å²	98	98.4 Å²	98.4	51%	0.513	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-36.8	170.1	-74.4	166	0	0	0	112	G37 L44 S45	G37-L41 PolarHBondContact O-N 3.27Å; L41-L44 WeakPolarHBondContact O-CB 3.1Å; L41-S45 WeakPolarHBondContact O-CB 3.35Å; L41-S45 PolarHBondContact O-N 2.98Å
42	R	40.9	Very low	45.7	Very low	172 Å²	172	100.7 Å²	100.7	65%	0.649	54%	0.544	S	S	*	.	H	α-helix	trans	-79.6	-28.3	177.4	-161	177.8	-153.4	168	4.7	113.5	A38 V39 Q40 S45 N46	A38-R42 WeakPolarHBondContact O-CB 3Å; A38-R42 PolarHBondContact O-N 3.22Å; V39-R42 PolarHBondContact O-N 3.44Å; Q40-R42 VanDerWaalsContact C-N 3.3Å; Q40-R42 PolarHBondContact O-N 3.39Å; R42-S45 PolarHBondContact O-N 3.06Å; R42-S45 PolarHBondContact O-OG 3.09Å; R42-N46 VanDerWaalsContact O-CB 3.27Å; R42-N46 WeakPolarHBondContact O-CB 3.4Å; R42-N46 VanDerWaalsContact O-CG 3.27Å; R42-N46 PolarHBondContact O-N 3.24Å; R42-N46 PolarHBondContact O-OD1 3.5Å
43	H	44.1	Very low	44.9	Very low	121 Å²	121	106 Å²	106	56%	0.56	56%	0.563	S	S	*	*	H	α-helix	trans	-73.6	-36	169.5	-110.3	-66.2	0	0	0	111.8	V39 Q40 N47	V39-H43 WeakPolarHBondContact O-CB 3.19Å; V39-H43 PolarHBondContact O-N 3.43Å; Q40-H43 PolarHBondContact O-N 2.84Å; H43-N47 WeakPolarHBondContact O-CB 3.34Å; H43-N47 PolarHBondContact O-N 3.24Å
44	L	46.1	Very low	44.6	Very low	110 Å²	110	105.8 Å²	105.8	58%	0.576	56%	0.555	S	S	*	*	H	α-helix	trans	-58.3	-50.5	163.9	-106.7	136.7	0	0	0	109.6	Q40 L41 L48	Q40-L44 WeakPolarHBondContact O-CB 3.46Å; Q40-L44 PolarHBondContact O-N 3.29Å; L41-L44 WeakPolarHBondContact O-CB 3.1Å; L44-L48 HydrophobicContact CD2-CD1 4.06Å; L44-L48 WeakPolarHBondContact O-CB 2.97Å; L44-L48 WeakPolarHBondContact O-CD1 3.24Å; L44-L48 WeakPolarHBondContact O-CG 3.43Å; L44-L48 PolarHBondContact O-N 2.86Å; L44-L48 VanDerWaalsContact O-N 3.12Å
45	S	42.8	Very low	44.7	Very low	49 Å²	49	103.7 Å²	103.7	34%	0.343	54%	0.537	S	S	.	.	H	α-helix	trans	-66.8	-40.9	-177.3	87.9	0	0	0	0	114.4	L41 R42 L48 E49	L41-S45 WeakPolarHBondContact O-CB 3.35Å; L41-S45 PolarHBondContact O-N 2.98Å; R42-S45 PolarHBondContact O-N 3.06Å; R42-S45 PolarHBondContact O-OG 3.09Å; S45-L48 CarbonylContact O-C 3.54Å; S45-L48 WeakPolarHBondContact O-CA 3.26Å; S45-L48 WeakPolarHBondContact O-CB 3.39Å; S45-L48 PolarHBondContact O-N 3.47Å; S45-L48 VanDerWaalsContact O-N 3.08Å; S45-E49 PolarHBondContact O-N 3.21Å
46	N	39.2	Very low	45.3	Very low	81 Å²	81	105.4 Å²	105.4	43%	0.433	54%	0.54	S	S	.	.	H	α-helix	trans	-75.6	-31.8	-176.2	-74.8	7.6	0	0	0	112.7	R42	R42-N46 VanDerWaalsContact O-CB 3.27Å; R42-N46 WeakPolarHBondContact O-CB 3.4Å; R42-N46 VanDerWaalsContact O-CG 3.27Å; R42-N46 PolarHBondContact O-N 3.24Å; R42-N46 PolarHBondContact O-OD1 3.5Å
47	N	45.3	Very low	45.7	Very low	126 Å²	126	104.3 Å²	104.3	67%	0.674	53%	0.53	S	S	*	.	H	α-helix	trans	-77.3	-11.6	167.9	-74	-21.1	0	0	0	112.4	H43	H43-N47 WeakPolarHBondContact O-CB 3.34Å; H43-N47 PolarHBondContact O-N 3.24Å
48	L	39.8	Very low	46.2	Very low	52 Å²	52	108.5 Å²	108.5	27%	0.272	54%	0.539	S	S	.	.	H	α-helix	trans	-92.3	-14.4	172.8	-77.1	166.4	0	0	0	113.4	L44 S45 I50 L51 L59	L44-L48 HydrophobicContact CD2-CD1 4.06Å; L44-L48 WeakPolarHBondContact O-CB 2.97Å; L44-L48 WeakPolarHBondContact O-CD1 3.24Å; L44-L48 WeakPolarHBondContact O-CG 3.43Å; L44-L48 PolarHBondContact O-N 2.86Å; L44-L48 VanDerWaalsContact O-N 3.12Å; S45-L48 CarbonylContact O-C 3.54Å; S45-L48 WeakPolarHBondContact O-CA 3.26Å; S45-L48 WeakPolarHBondContact O-CB 3.39Å; S45-L48 PolarHBondContact O-N 3.47Å; S45-L48 VanDerWaalsContact O-N 3.08Å; L48-I50 PolarHBondContact O-N 2.64Å; L48-L51 CarbonylContact O-C 3.44Å; L48-L51 WeakPolarHBondContact O-CA 3.38Å; L48-L51 WeakPolarHBondContact O-CB 3.41Å; L48-L51 PolarHBondContact O-N 3.24Å; L48-L59 HydrophobicContact CD2-CD1 4.13Å
49	E	37.2	Very low	46.7	Very low	131 Å²	131	108.8 Å²	108.8	61%	0.612	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-27.1	-175.6	-106	179	167.3	0	0	114	S45 L51	S45-E49 PolarHBondContact O-N 3.21Å; E49-L51 PolarHBondContact O-N 2.99Å
50	I	43.1	Very low	47.7	Very low	164 Å²	164	105.7 Å²	105.7	84%	0.841	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-9.3	171.9	-57.7	172.5	0	0	0	111.1	L48	L48-I50 PolarHBondContact O-N 2.64Å
51	L	41.8	Very low	48.9	Very low	69 Å²	69	101.8 Å²	101.8	36%	0.361	49%	0.493	S	S	.	.	S	Bend	trans	-114.5	57.6	-178.5	-77.2	159	0	0	0	111	L48 E49 K53 R54	L48-L51 CarbonylContact O-C 3.44Å; L48-L51 WeakPolarHBondContact O-CA 3.38Å; L48-L51 WeakPolarHBondContact O-CB 3.41Å; L48-L51 PolarHBondContact O-N 3.24Å; E49-L51 PolarHBondContact O-N 2.99Å; L51-K53 CarbonylContact O-C 3.4Å; L51-K53 PolarHBondContact O-N 2.68Å; L51-R54 HydrophobicContact CB-CG 4.42Å; L51-R54 VanDerWaalsContact CD1-CZ 3.49Å; L51-R54 VanDerWaalsContact CD2-NH2 3.31Å
52	L	36.2	Very low	49.8	Very low	158 Å²	158	101.6 Å²	101.6	83%	0.827	49%	0.492	S	S	*	.			trans	-51.9	6	-169.2	-137.9	125.1	0	0	0	118.7
53	K	43.8	Very low	51.2	Low	199 Å²	199	96.9 Å²	96.9	87%	0.865	48%	0.477	S	S	*	.			trans	-150.1	98.3	163.5	-66.6	-168.3	179.8	-176.9	0	109.7	L51	L51-K53 CarbonylContact O-C 3.4Å; L51-K53 PolarHBondContact O-N 2.68Å
54	R	48.2	Very low	52.4	Low	112 Å²	112	92.6 Å²	92.6	42%	0.423	46%	0.459	S	S	.	.			trans	-133.7	87	164.9	-74.5	-166.2	175.1	176.9	2.1	112.1	L51 F56	L51-R54 HydrophobicContact CB-CG 4.42Å; L51-R54 VanDerWaalsContact CD1-CZ 3.49Å; L51-R54 VanDerWaalsContact CD2-NH2 3.31Å; R54-F56 PolarHBondContact O-N 2.99Å
55	D	56	Low	53.6	Low	43 Å²	43	87.4 Å²	87.4	23%	0.23	43%	0.431	C	S	.	.				16.4	93.9	119.4	-162.6	-18.6	0	0	0	116.4	L57 K58 W87	D55-L57 VanDerWaalsContact C-N 3.3Å; D55-L57 PolarHBondContact O-N 3.46Å; D55-L57 PolarHBondContact OD1-N 3.02Å; D55-K58 HydrophobicContact CB-CB 3.94Å; D55-K58 HydrophobicContact CB-CD 4.49Å; D55-K58 WeakPolarHBondContact O-CB 3.34Å; D55-K58 PolarHBondContact O-N 3.28Å; D55-W87 VanDerWaalsContact OD1-CE2 3.23Å; D55-W87 WeakPolarHBondContact OD1-CZ2 3.31Å; D55-W87 PolarHBondContact OD1-NE1 3.22Å; D55-W87 PolarHBondContact OD2-NE1 3.44Å
56	F	58.4	Low	55	Low	150 Å²	150	87.8 Å²	87.8	66%	0.658	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-57.7	-36.2	-176.4	-171.9	-102.6	0	0	0	113.6	R54 K58 L59 L60 L68	R54-F56 PolarHBondContact O-N 2.99Å; F56-K58 PolarHBondContact O-N 3.34Å; F56-L59 PolarHBondContact O-N 2.91Å; F56-L60 HydrophobicContact CD1-CD1 3.86Å; F56-L60 HydrophobicContact CE1-CD1 3.72Å; F56-L68 HydrophobicContact CE1-CD1 4.27Å
57	L	57.9	Low	56.6	Low	19 Å²	19	85.1 Å²	85.1	10%	0.099	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-68.8	-18.6	175.9	-81.7	163.2	0	0	0	113.1	D55 L59 L69 W87	D55-L57 VanDerWaalsContact C-N 3.3Å; D55-L57 PolarHBondContact O-N 3.46Å; D55-L57 PolarHBondContact OD1-N 3.02Å; L57-L59 VanDerWaalsContact C-N 3.31Å; L57-L69 HydrophobicContact CD1-CD2 4.1Å; L57-L69 HydrophobicContact CD2-CD2 4.49Å; L57-L69 HydrophobicContact CD2-CG 4.43Å; L57-W87 HydrophobicContact CD1-CD2 3.71Å; L57-W87 HydrophobicContact CD1-CE3 3.4Å; L57-W87 HydrophobicContact CD1-CG 4.49Å; L57-W87 HydrophobicContact CD1-CH2 3.72Å; L57-W87 HydrophobicContact CD1-CZ2 3.92Å; L57-W87 HydrophobicContact CD1-CZ3 3.43Å; L57-W87 VanDerWaalsContact CD1-CZ3 3.43Å
58	K	59.3	Low	57.9	Low	124 Å²	124	82.8 Å²	82.8	54%	0.539	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-76.4	-20.7	178.3	-165.9	175.4	178.8	174.8	0	113	D55 F56	D55-K58 HydrophobicContact CB-CB 3.94Å; D55-K58 HydrophobicContact CB-CD 4.49Å; D55-K58 WeakPolarHBondContact O-CB 3.34Å; D55-K58 PolarHBondContact O-N 3.28Å; F56-K58 PolarHBondContact O-N 3.34Å
59	L	58.9	Low	59.5	Low	85 Å²	85	80.4 Å²	80.4	45%	0.445	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-13.3	-177.5	-66.5	170.7	0	0	0	112.6	L48 F56 L57	L48-L59 HydrophobicContact CD2-CD1 4.13Å; F56-L59 PolarHBondContact O-N 2.91Å; L57-L59 VanDerWaalsContact C-N 3.31Å
60	L	64.4	Low	61.2	Low	41 Å²	41	78.5 Å²	78.5	22%	0.215	38%	0.375	C	S	.	.	S	Bend	trans	-86.9	142.1	179.1	-73	166.3	0	0	0	110.7	F56 L64 S65 L68	F56-L60 HydrophobicContact CD1-CD1 3.86Å; F56-L60 HydrophobicContact CE1-CD1 3.72Å; L60-L64 HydrophobicContact CB-CB 4.41Å; L60-L64 HydrophobicContact CD2-CB 4.11Å; L60-L64 HydrophobicContact CD2-CD1 4.14Å; L60-S65 WeakPolarHBondContact CB-OG 3.16Å; L60-L68 HydrophobicContact CD1-CD1 3.52Å
61	P	73.5	Confident	62.6	Low	34 Å²	34	79 Å²	79	22%	0.221	37%	0.367	C	S	.	.			trans	-47.5	149.8	158.5	-26.2	33.6	0	0	0	111.5	L10 E63 L64 S65	L10-P61 HydrophobicContact CD2-CG 4.43Å; P61-E63 VanDerWaalsContact CB-OE2 3.31Å; P61-E63 WeakPolarHBondContact CB-OE2 3.49Å; P61-E63 PolarHBondContact O-N 2.99Å; P61-L64 HydrophobicContact CG-CD1 4.13Å; P61-L64 PolarHBondContact O-N 3.31Å; P61-S65 WeakPolarHBondContact O-CB 3.39Å; P61-S65 PolarHBondContact O-N 3.29Å; P61-S65 PolarHBondContact O-OG 3.3Å
62	L	69.8	Low	64	Low	94 Å²	94	79 Å²	79	49%	0.492	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-33.2	-176	-76.8	167	0	0	0	111.5	S65 F66 V90	L62-S65 WeakPolarHBondContact O-CB 3.33Å; L62-S65 PolarHBondContact O-N 3.46Å; L62-F66 WeakPolarHBondContact O-CB 3.48Å; L62-F66 WeakPolarHBondContact O-CD1 3.46Å; L62-F66 WeakPolarHBondContact O-CG 3.37Å; L62-F66 PolarHBondContact O-N 2.97Å; L62-V90 HydrophobicContact CD2-CG1 4.28Å; L62-V90 HydrophobicContact CD2-CG2 4.27Å
63	E	69.4	Low	65.8	Low	72 Å²	72	75.3 Å²	75.3	34%	0.336	35%	0.348	S	S	.	.	H	α-helix	trans	-67	-47	-178.9	-57.2	72.6	-156.8	0	0	111.3	S14 L18 P61 S65 F66 Y67	S14-E63 PolarHBondContact OG-OE2 2.94Å; L18-E63 HydrophobicContact CD1-CG 4.27Å; L18-E63 HydrophobicContact CD2-CG 4.09Å; L18-E63 HydrophobicContact CG-CG 4.35Å; P61-E63 VanDerWaalsContact CB-OE2 3.31Å; P61-E63 WeakPolarHBondContact CB-OE2 3.49Å; P61-E63 PolarHBondContact O-N 2.99Å; E63-S65 VanDerWaalsContact C-N 3.31Å; E63-F66 PolarHBondContact O-N 3.37Å; E63-Y67 PolarHBondContact O-N 3.49Å
64	L	68.8	Low	67.2	Low	32 Å²	32	67.1 Å²	67.1	17%	0.168	32%	0.315	C	S	.	.	H	α-helix	trans	-67.2	-36.6	175.8	-73.5	174.1	0	0	0	111.5	F17 L29 L60 P61 Y67 L68	F17-L64 HydrophobicContact CD1-CD2 3.97Å; F17-L64 HydrophobicContact CE1-CD2 3.37Å; F17-L64 HydrophobicContact CE1-CG 4.37Å; F17-L64 HydrophobicContact CE2-CD2 4.01Å; F17-L64 HydrophobicContact CZ-CD2 3.38Å; L29-L64 HydrophobicContact CD1-CD2 4.37Å; L29-L64 HydrophobicContact CD2-CD2 4.47Å; L60-L64 HydrophobicContact CB-CB 4.41Å; L60-L64 HydrophobicContact CD2-CB 4.11Å; L60-L64 HydrophobicContact CD2-CD1 4.14Å; P61-L64 HydrophobicContact CG-CD1 4.13Å; P61-L64 PolarHBondContact O-N 3.31Å; L64-Y67 PolarHBondContact O-N 3.31Å; L64-L68 PolarHBondContact O-N 3.34Å
65	S	70.8	Confident	68.2	Low	1 Å²	1	68.8 Å²	68.8	1%	0.007	33%	0.327	C	S	.	.	H	α-helix	trans	-60.7	-48.7	173.7	-59.3	0	0	0	0	110.8	L60 P61 L62 E63 Y67 L68 L69	L60-S65 WeakPolarHBondContact CB-OG 3.16Å; P61-S65 WeakPolarHBondContact O-CB 3.39Å; P61-S65 PolarHBondContact O-N 3.29Å; P61-S65 PolarHBondContact O-OG 3.3Å; L62-S65 WeakPolarHBondContact O-CB 3.33Å; L62-S65 PolarHBondContact O-N 3.46Å; E63-S65 VanDerWaalsContact C-N 3.31Å; S65-Y67 PolarHBondContact O-N 3.36Å; S65-L68 PolarHBondContact O-N 3.16Å; S65-L69 WeakPolarHBondContact O-CB 3.14Å; S65-L69 WeakPolarHBondContact O-CG 3.16Å; S65-L69 PolarHBondContact O-N 3.33Å
66	F	72.4	Confident	69.1	Low	57 Å²	57	69.2 Å²	69.2	25%	0.25	33%	0.332	C	S	.	.	H	α-helix	trans	-63.1	-40.2	178	-67.8	-13.5	0	0	0	112.7	L62 E63 L69 K70 V90 A93 C94	L62-F66 WeakPolarHBondContact O-CB 3.48Å; L62-F66 WeakPolarHBondContact O-CD1 3.46Å; L62-F66 WeakPolarHBondContact O-CG 3.37Å; L62-F66 PolarHBondContact O-N 2.97Å; E63-F66 PolarHBondContact O-N 3.37Å; F66-L69 HydrophobicContact CD1-CD1 4.31Å; F66-L69 PolarHBondContact O-N 3.3Å; F66-K70 PolarHBondContact O-N 2.62Å; F66-K70 VanDerWaalsContact O-N 3.16Å; F66-V90 HydrophobicContact CD1-CG1 4.23Å; F66-V90 HydrophobicContact CE1-CG1 3.81Å; F66-V90 WeakPolarHBondContact CE1-O 3.45Å; F66-A93 HydrophobicContact CZ-CB 4.29Å; F66-C94 HydrophobicContact CD1-CB 3.6Å; F66-C94 HydrophobicContact CE1-CB 3.7Å; F66-C94 HydrophobicContact CG-CB 4.08Å; F66-C94 VanDerWaalsContact CG-SG 3.58Å; F66-C94 HydrophobicContact CZ-CB 4.25Å
67	Y	72.6	Confident	69.8	Low	25 Å²	25	62.2 Å²	62.2	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-46	175.8	-173.3	-101.5	0	0	0	112.1	N26 E63 L64 S65 L69 K70 W71	N26-Y67 VanDerWaalsContact CG-OH 3.24Å; N26-Y67 PolarHBondContact ND2-OH 3.41Å; N26-Y67 VanDerWaalsContact OD1-CE1 3.24Å; N26-Y67 WeakPolarHBondContact OD1-CE1 3.45Å; N26-Y67 PolarHBondContact OD1-OH 3.12Å; E63-Y67 PolarHBondContact O-N 3.49Å; L64-Y67 PolarHBondContact O-N 3.31Å; S65-Y67 PolarHBondContact O-N 3.36Å; Y67-L69 VanDerWaalsContact C-N 3.34Å; Y67-L69 PolarHBondContact O-N 2.86Å; Y67-K70 WeakPolarHBondContact O-CB 3.48Å; Y67-K70 PolarHBondContact O-N 3.28Å; Y67-W71 AromaticContact CE1-NE1 3.57Å; Y67-W71 AromaticContact CZ-NE1 3.55Å
68	L	73.6	Confident	70.4	Confident	77 Å²	77	63.2 Å²	63.2	40%	0.403	31%	0.307	S	S	.	.	H	α-helix	trans	-61.7	-41.6	175.4	-88.5	160.5	0	0	0	112.4	F56 L60 L64 S65 K70 W71	F56-L68 HydrophobicContact CE1-CD1 4.27Å; L60-L68 HydrophobicContact CD1-CD1 3.52Å; L64-L68 PolarHBondContact O-N 3.34Å; S65-L68 PolarHBondContact O-N 3.16Å; L68-K70 PolarHBondContact O-N 2.73Å; L68-W71 PolarHBondContact O-N 3.35Å
69	L	73.8	Confident	70.9	Confident	1 Å²	1	61 Å²	61	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-64.4	-25.8	-179.7	-68.6	170.9	0	0	0	112.8	L57 S65 F66 Y67 W71 L72 L77 V90 I91 V97	L57-L69 HydrophobicContact CD1-CD2 4.1Å; L57-L69 HydrophobicContact CD2-CD2 4.49Å; L57-L69 HydrophobicContact CD2-CG 4.43Å; S65-L69 WeakPolarHBondContact O-CB 3.14Å; S65-L69 WeakPolarHBondContact O-CG 3.16Å; S65-L69 PolarHBondContact O-N 3.33Å; F66-L69 HydrophobicContact CD1-CD1 4.31Å; F66-L69 PolarHBondContact O-N 3.3Å; Y67-L69 VanDerWaalsContact C-N 3.34Å; Y67-L69 PolarHBondContact O-N 2.86Å; L69-W71 PolarHBondContact O-N 2.98Å; L69-L72 HydrophobicContact CD2-CD1 3.96Å; L69-L72 PolarHBondContact O-N 3.18Å; L69-L77 HydrophobicContact CB-CD2 4.22Å; L69-L77 HydrophobicContact CD2-CD2 3.58Å; L69-L77 HydrophobicContact CG-CD2 4.46Å; L69-V90 HydrophobicContact CD1-CG1 4.15Å; L69-I91 HydrophobicContact CD1-CB 4.47Å; L69-I91 HydrophobicContact CD1-CG1 3.78Å; L69-I91 HydrophobicContact CD2-CD1 4.16Å; L69-I91 HydrophobicContact CD2-CG1 3.76Å; L69-I91 HydrophobicContact CG-CG1 4.43Å; L69-V97 HydrophobicContact CB-CG2 3.95Å
70	K	72.8	Confident	71.4	Confident	91 Å²	91	57.9 Å²	57.9	40%	0.396	29%	0.288	S	S	.	.	H	α-helix	trans	-62.8	-27.4	175.5	-173.1	178.5	175.8	179.9	0	113.3	F66 Y67 L68	F66-K70 PolarHBondContact O-N 2.62Å; F66-K70 VanDerWaalsContact O-N 3.16Å; Y67-K70 WeakPolarHBondContact O-CB 3.48Å; Y67-K70 PolarHBondContact O-N 3.28Å; L68-K70 PolarHBondContact O-N 2.73Å
71	W	72.3	Confident	71.6	Confident	176 Å²	176	56.4 Å²	56.4	67%	0.667	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-11.1	-177.4	-64	99.5	0	0	0	113.8	Y67 L68 L69	Y67-W71 AromaticContact CE1-NE1 3.57Å; Y67-W71 AromaticContact CZ-NE1 3.55Å; L68-W71 PolarHBondContact O-N 3.35Å; L69-W71 PolarHBondContact O-N 2.98Å
72	L	71.6	Confident	71.2	Confident	69 Å²	69	62.1 Å²	62.1	36%	0.361	31%	0.309	S	S	.	.	S	Bend	trans	-82.6	143.1	178.1	-70.4	168.4	0	0	0	110.4	L69 T76 L77	L69-L72 HydrophobicContact CD2-CD1 3.96Å; L69-L72 PolarHBondContact O-N 3.18Å; L72-T76 HydrophobicContact CD2-CG2 4.19Å; L72-L77 HydrophobicContact CB-CD2 3.87Å; L72-L77 HydrophobicContact CB-CG 4.03Å; L72-L77 HydrophobicContact CD1-CD2 4.01Å
73	D	73.2	Confident	71.1	Confident	79 Å²	79	63.1 Å²	63.1	42%	0.422	32%	0.319	S	S	.	.			trans	-66.8	145.5	173.4	72.8	-87.2	0	0	0	110.3	Q75 T76 L77	D73-Q75 PolarHBondContact O-N 3.23Å; D73-Q75 VanDerWaalsContact O-N 3.14Å; D73-Q75 WeakPolarHBondContact OD2-CA 3.36Å; D73-Q75 WeakPolarHBondContact OD2-CB 3.25Å; D73-Q75 PolarHBondContact OD2-N 2.83Å; D73-Q75 VanDerWaalsContact OD2-N 3.07Å; D73-T76 VanDerWaalsContact CG-OG1 3.25Å; D73-T76 WeakPolarHBondContact O-CB 3.43Å; D73-T76 PolarHBondContact O-N 3.46Å; D73-T76 VanDerWaalsContact O-N 3.12Å; D73-T76 WeakPolarHBondContact OD1-CB 3.31Å; D73-T76 PolarHBondContact OD1-OG1 3.24Å; D73-T76 PolarHBondContact OD2-N 3.24Å; D73-T76 PolarHBondContact OD2-OG1 3.04Å; D73-L77 PolarHBondContact O-N 3.24Å
74	P	72.7	Confident	71.1	Confident	27 Å²	27	61.2 Å²	61.2	18%	0.175	31%	0.313	C	S	.	.	H	α-helix	trans	-58.6	-26.3	-177.6	-31.7	39.3	0	0	0	116.2	L77 L78 A101 Y123	P74-L77 WeakPolarHBondContact O-CB 3.35Å; P74-L77 PolarHBondContact O-N 3.2Å; P74-L78 PolarHBondContact O-N 2.72Å; P74-A101 HydrophobicContact CB-CB 4.04Å; P74-A101 HydrophobicContact CG-CB 3.54Å; P74-Y123 HydrophobicContact CB-CE1 4.08Å; P74-Y123 HydrophobicContact CB-CE2 3.95Å; P74-Y123 WeakPolarHBondContact CB-OH 3.45Å; P74-Y123 HydrophobicContact CG-CE2 4.41Å
75	Q	70	Confident	71.1	Confident	147 Å²	147	69.1 Å²	69.1	69%	0.687	35%	0.347	S	S	*	.	H	α-helix	trans	-73.9	-39.6	177.8	-175.3	176.2	-10.2	0	0	110.8	D73 L77 L78 T79	D73-Q75 PolarHBondContact O-N 3.23Å; D73-Q75 VanDerWaalsContact O-N 3.14Å; D73-Q75 WeakPolarHBondContact OD2-CA 3.36Å; D73-Q75 WeakPolarHBondContact OD2-CB 3.25Å; D73-Q75 PolarHBondContact OD2-N 2.83Å; D73-Q75 VanDerWaalsContact OD2-N 3.07Å; Q75-L77 VanDerWaalsContact C-N 3.33Å; Q75-L78 PolarHBondContact O-N 2.89Å; Q75-T79 PolarHBondContact O-N 3.3Å; Q75-T79 PolarHBondContact O-OG1 3.11Å
76	T	74.7	Confident	70.9	Confident	53 Å²	53	73.6 Å²	73.6	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-61.1	-42.8	169.1	-63.3	0	0	0	0	110.7	L72 D73 L78 T79 C80	L72-T76 HydrophobicContact CD2-CG2 4.19Å; D73-T76 VanDerWaalsContact CG-OG1 3.25Å; D73-T76 WeakPolarHBondContact O-CB 3.43Å; D73-T76 PolarHBondContact O-N 3.46Å; D73-T76 VanDerWaalsContact O-N 3.12Å; D73-T76 WeakPolarHBondContact OD1-CB 3.31Å; D73-T76 PolarHBondContact OD1-OG1 3.24Å; D73-T76 PolarHBondContact OD2-N 3.24Å; D73-T76 PolarHBondContact OD2-OG1 3.04Å; T76-L78 VanDerWaalsContact C-N 3.34Å; T76-L78 PolarHBondContact O-N 3.22Å; T76-T79 WeakPolarHBondContact O-CB 3.47Å; T76-T79 PolarHBondContact O-N 3.42Å; T76-T79 VanDerWaalsContact O-N 3.16Å; T76-C80 VanDerWaalsContact O-CB 3.27Å; T76-C80 WeakPolarHBondContact O-CB 3.26Å; T76-C80 PolarHBondContact O-N 3.09Å; T76-C80 PolarHBondContact O-SG 2.8Å
77	L	73.3	Confident	70.7	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-59.6	-39.8	176.3	-68.4	175.3	0	0	0	113.3	L69 L72 D73 P74 Q75 C80 C81 I91 V97	L69-L77 HydrophobicContact CB-CD2 4.22Å; L69-L77 HydrophobicContact CD2-CD2 3.58Å; L69-L77 HydrophobicContact CG-CD2 4.46Å; L72-L77 HydrophobicContact CB-CD2 3.87Å; L72-L77 HydrophobicContact CB-CG 4.03Å; L72-L77 HydrophobicContact CD1-CD2 4.01Å; D73-L77 PolarHBondContact O-N 3.24Å; P74-L77 WeakPolarHBondContact O-CB 3.35Å; P74-L77 PolarHBondContact O-N 3.2Å; Q75-L77 VanDerWaalsContact C-N 3.33Å; L77-C80 WeakPolarHBondContact O-CB 3.31Å; L77-C80 PolarHBondContact O-N 3.42Å; L77-C81 PolarHBondContact O-N 2.9Å; L77-C81 PolarHBondContact O-SG 3.2Å; L77-I91 HydrophobicContact CB-CG2 4.35Å; L77-I91 HydrophobicContact CD2-CD1 4.36Å; L77-I91 HydrophobicContact CD2-CG2 4.26Å; L77-V97 HydrophobicContact CD1-CG1 3.23Å
78	L	70.1	Confident	70.8	Confident	41 Å²	41	75.1 Å²	75.1	22%	0.215	38%	0.376	C	S	.	.	H	α-helix	trans	-66.2	-44.3	174.1	-76.6	172.7	0	0	0	111.8	P74 Q75 T76 C80 C81 L82 W98 Y123 L124 I127	P74-L78 PolarHBondContact O-N 2.72Å; Q75-L78 PolarHBondContact O-N 2.89Å; T76-L78 VanDerWaalsContact C-N 3.34Å; T76-L78 PolarHBondContact O-N 3.22Å; L78-C80 VanDerWaalsContact C-N 3.31Å; L78-C80 PolarHBondContact O-N 2.91Å; L78-C81 WeakPolarHBondContact O-CB 3.29Å; L78-C81 PolarHBondContact O-N 3.47Å; L78-C81 VanDerWaalsContact O-N 3.14Å; L78-L82 PolarHBondContact O-N 2.96Å; L78-W98 HydrophobicContact CD2-CH2 3.92Å; L78-W98 HydrophobicContact CD2-CZ3 4.37Å; L78-W98 HydrophobicContact CG-CH2 4.35Å; L78-Y123 HydrophobicContact CD1-CE1 3.91Å; L78-Y123 HydrophobicContact CG-CE1 4.38Å; L78-L124 HydrophobicContact CD1-CD2 4.38Å; L78-L124 HydrophobicContact CD2-CD2 4.12Å; L78-I127 HydrophobicContact CD1-CD1 3.82Å
79	T	70.1	Confident	70.8	Confident	77 Å²	77	78.8 Å²	78.8	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-58.9	-46.2	175.5	-54.9	0	0	0	0	110.7	Q75 T76 C81 L82 V83	Q75-T79 PolarHBondContact O-N 3.3Å; Q75-T79 PolarHBondContact O-OG1 3.11Å; T76-T79 WeakPolarHBondContact O-CB 3.47Å; T76-T79 PolarHBondContact O-N 3.42Å; T76-T79 VanDerWaalsContact O-N 3.16Å; T79-C81 VanDerWaalsContact C-N 3.3Å; T79-C81 PolarHBondContact O-N 2.95Å; T79-L82 WeakPolarHBondContact O-CB 3.3Å; T79-L82 PolarHBondContact O-N 3.31Å; T79-V83 WeakPolarHBondContact O-CG2 3.43Å; T79-V83 PolarHBondContact O-N 3.27Å
80	C	68.5	Low	70.8	Confident	19 Å²	19	79.4 Å²	79.4	13%	0.128	39%	0.392	C	S	.	.	H	α-helix	trans	-55.5	-39.7	173.8	-79.3	0	0	0	0	113.4	T76 L77 L78 L82 V83 W87 I91	T76-C80 VanDerWaalsContact O-CB 3.27Å; T76-C80 WeakPolarHBondContact O-CB 3.26Å; T76-C80 PolarHBondContact O-N 3.09Å; T76-C80 PolarHBondContact O-SG 2.8Å; L77-C80 WeakPolarHBondContact O-CB 3.31Å; L77-C80 PolarHBondContact O-N 3.42Å; L78-C80 VanDerWaalsContact C-N 3.31Å; L78-C80 PolarHBondContact O-N 2.91Å; C80-L82 VanDerWaalsContact C-N 3.28Å; C80-L82 PolarHBondContact O-N 3.42Å; C80-V83 PolarHBondContact O-N 2.74Å; C80-W87 HydrophobicContact CB-CE3 3.51Å; C80-W87 HydrophobicContact CB-CZ3 3.95Å; C80-W87 WeakPolarHBondContact O-CB 3.32Å; C80-W87 WeakPolarHBondContact SG-CZ3 3.19Å; C80-I91 HydrophobicContact CB-CD1 3.64Å
81	C	68.9	Low	70.9	Confident	10 Å²	10	75.1 Å²	75.1	7%	0.068	37%	0.374	C	S	.	.	H	α-helix	trans	-64.1	-29.9	174.1	-68.9	0	0	0	0	113.2	L77 L78 T79 N88	L77-C81 PolarHBondContact O-N 2.9Å; L77-C81 PolarHBondContact O-SG 3.2Å; L78-C81 WeakPolarHBondContact O-CB 3.29Å; L78-C81 PolarHBondContact O-N 3.47Å; L78-C81 VanDerWaalsContact O-N 3.14Å; T79-C81 VanDerWaalsContact C-N 3.3Å; T79-C81 PolarHBondContact O-N 2.95Å; C81-N88 HydrophobicContact CB-CB 4.18Å; C81-N88 WeakPolarHBondContact O-CB 3.5Å
82	L	66.9	Low	71.1	Confident	155 Å²	155	67.5 Å²	67.5	81%	0.812	35%	0.347	S	S	*	.	H	α-helix	trans	-79.4	-28.6	179	-63.6	171.8	0	0	0	112.4	L78 T79 C80	L78-L82 PolarHBondContact O-N 2.96Å; T79-L82 WeakPolarHBondContact O-CB 3.3Å; T79-L82 PolarHBondContact O-N 3.31Å; C80-L82 VanDerWaalsContact C-N 3.28Å; C80-L82 PolarHBondContact O-N 3.42Å
83	V	66.8	Low	71.5	Confident	115 Å²	115	66.6 Å²	66.6	70%	0.697	35%	0.35	S	S	*	.	H	α-helix	trans	-74.1	-34.3	-176	173	0	0	0	0	112.5	T79 C80	T79-V83 WeakPolarHBondContact O-CG2 3.43Å; T79-V83 PolarHBondContact O-N 3.27Å; C80-V83 PolarHBondContact O-N 2.74Å
84	S	68.3	Low	71.8	Confident	31 Å²	31	63 Å²	63	22%	0.217	33%	0.331	C	S	.	.			trans	-146.9	132.9	-176.3	174	0	0	0	0	112.9	Q86 W87 N88	S84-Q86 PolarHBondContact O-N 3.11Å; S84-Q86 PolarHBondContact OG-N 3.14Å; S84-W87 PolarHBondContact O-N 3.12Å; S84-N88 PolarHBondContact O-N 3.02Å
85	K	68.8	Low	72.3	Confident	199 Å²	199	62.3 Å²	62.3	87%	0.865	33%	0.326	S	S	*	.	H	α-helix	trans	-59.4	-32.6	174.1	-69.8	-173.8	179.7	-178.9	0	112.3	K89	K85-K89 PolarHBondContact O-N 3.5Å; K85-K89 VanDerWaalsContact O-N 3.09Å
86	Q	68.1	Low	72.8	Confident	94 Å²	94	61 Å²	61	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-73.4	-41.1	178.4	-168.5	69.5	10.4	0	0	111.2	S84 N88 K89 V90	S84-Q86 PolarHBondContact O-N 3.11Å; S84-Q86 PolarHBondContact OG-N 3.14Å; Q86-N88 VanDerWaalsContact C-N 3.3Å; Q86-N88 PolarHBondContact O-N 3.03Å; Q86-K89 WeakPolarHBondContact O-CB 3.46Å; Q86-K89 PolarHBondContact O-N 3.41Å; Q86-K89 VanDerWaalsContact O-N 3.11Å; Q86-V90 WeakPolarHBondContact O-CG2 3.37Å; Q86-V90 PolarHBondContact O-N 3.18Å
87	W	68.7	Low	73.3	Confident	55 Å²	55	58.9 Å²	58.9	21%	0.208	31%	0.307	C	S	.	.	H	α-helix	trans	-62.4	-43.6	174.5	-71.8	45	0	0	0	110.1	D55 L57 C80 S84 K89 V90 I91	D55-W87 VanDerWaalsContact OD1-CE2 3.23Å; D55-W87 WeakPolarHBondContact OD1-CZ2 3.31Å; D55-W87 PolarHBondContact OD1-NE1 3.22Å; D55-W87 PolarHBondContact OD2-NE1 3.44Å; L57-W87 HydrophobicContact CD1-CD2 3.71Å; L57-W87 HydrophobicContact CD1-CE3 3.4Å; L57-W87 HydrophobicContact CD1-CG 4.49Å; L57-W87 HydrophobicContact CD1-CH2 3.72Å; L57-W87 HydrophobicContact CD1-CZ2 3.92Å; L57-W87 HydrophobicContact CD1-CZ3 3.43Å; L57-W87 VanDerWaalsContact CD1-CZ3 3.43Å; C80-W87 HydrophobicContact CB-CE3 3.51Å; C80-W87 HydrophobicContact CB-CZ3 3.95Å; C80-W87 WeakPolarHBondContact O-CB 3.32Å; C80-W87 WeakPolarHBondContact SG-CZ3 3.19Å; S84-W87 PolarHBondContact O-N 3.12Å; W87-K89 PolarHBondContact O-N 3.36Å; W87-V90 PolarHBondContact O-N 3.33Å; W87-I91 HydrophobicContact CB-CD1 4.12Å; W87-I91 HydrophobicContact CE3-CD1 4.3Å; W87-I91 VanDerWaalsContact O-CB 3.3Å; W87-I91 WeakPolarHBondContact O-CB 3.27Å; W87-I91 WeakPolarHBondContact O-CG1 3.22Å; W87-I91 PolarHBondContact O-N 3.14Å
88	N	72.9	Confident	73.8	Confident	60 Å²	60	58.8 Å²	58.8	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-56.4	-42.2	174.8	-166.2	5.5	0	0	0	111.2	C81 S84 Q86 S92 K120	C81-N88 HydrophobicContact CB-CB 4.18Å; C81-N88 WeakPolarHBondContact O-CB 3.5Å; S84-N88 PolarHBondContact O-N 3.02Å; Q86-N88 VanDerWaalsContact C-N 3.3Å; Q86-N88 PolarHBondContact O-N 3.03Å; N88-S92 WeakPolarHBondContact O-CA 3.33Å; N88-S92 WeakPolarHBondContact O-CB 3.47Å; N88-S92 PolarHBondContact O-N 3.45Å; N88-S92 PolarHBondContact O-OG 3.26Å; N88-S92 PolarHBondContact OD1-OG 2.58Å; N88-K120 PolarHBondContact OD1-NZ 3.31Å
89	K	75.3	Confident	74.4	Confident	153 Å²	153	57.4 Å²	57.4	67%	0.665	30%	0.299	S	S	*	.	H	α-helix	trans	-65.8	-44.3	177.8	-168.3	178	179.3	-178.2	0	112.6	K85 Q86 W87 A93	K85-K89 PolarHBondContact O-N 3.5Å; K85-K89 VanDerWaalsContact O-N 3.09Å; Q86-K89 WeakPolarHBondContact O-CB 3.46Å; Q86-K89 PolarHBondContact O-N 3.41Å; Q86-K89 VanDerWaalsContact O-N 3.11Å; W87-K89 PolarHBondContact O-N 3.36Å; K89-A93 VanDerWaalsContact O-CB 3.29Å; K89-A93 WeakPolarHBondContact O-CB 3.46Å; K89-A93 PolarHBondContact O-N 2.82Å
90	V	73.4	Confident	75.1	Confident	15 Å²	15	56.1 Å²	56.1	9%	0.091	29%	0.291	C	S	.	.	H	α-helix	trans	-70.2	-50.7	-179.4	177	0	0	0	0	110.8	L62 F66 L69 Q86 W87 S92 A93 C94	L62-V90 HydrophobicContact CD2-CG1 4.28Å; L62-V90 HydrophobicContact CD2-CG2 4.27Å; F66-V90 HydrophobicContact CD1-CG1 4.23Å; F66-V90 HydrophobicContact CE1-CG1 3.81Å; F66-V90 WeakPolarHBondContact CE1-O 3.45Å; L69-V90 HydrophobicContact CD1-CG1 4.15Å; Q86-V90 WeakPolarHBondContact O-CG2 3.37Å; Q86-V90 PolarHBondContact O-N 3.18Å; W87-V90 PolarHBondContact O-N 3.33Å; V90-S92 VanDerWaalsContact C-N 3.34Å; V90-S92 PolarHBondContact O-N 2.82Å; V90-A93 PolarHBondContact O-N 3.07Å; V90-C94 PolarHBondContact O-N 3.21Å
91	I	74.6	Confident	75.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-42.3	179.7	-60.1	169.1	0	0	0	110.5	L69 L77 C80 W87 A93 C94 W98	L69-I91 HydrophobicContact CD1-CB 4.47Å; L69-I91 HydrophobicContact CD1-CG1 3.78Å; L69-I91 HydrophobicContact CD2-CD1 4.16Å; L69-I91 HydrophobicContact CD2-CG1 3.76Å; L69-I91 HydrophobicContact CG-CG1 4.43Å; L77-I91 HydrophobicContact CB-CG2 4.35Å; L77-I91 HydrophobicContact CD2-CD1 4.36Å; L77-I91 HydrophobicContact CD2-CG2 4.26Å; C80-I91 HydrophobicContact CB-CD1 3.64Å; W87-I91 HydrophobicContact CB-CD1 4.12Å; W87-I91 HydrophobicContact CE3-CD1 4.3Å; W87-I91 VanDerWaalsContact O-CB 3.3Å; W87-I91 WeakPolarHBondContact O-CB 3.27Å; W87-I91 WeakPolarHBondContact O-CG1 3.22Å; W87-I91 PolarHBondContact O-N 3.14Å; I91-A93 PolarHBondContact O-N 2.99Å; I91-C94 PolarHBondContact O-N 3.41Å; I91-W98 HydrophobicContact CG2-CH2 4.46Å; I91-W98 HydrophobicContact CG2-CZ2 3.64Å; I91-W98 PolarHBondContact O-NE1 3.39Å
92	S	76.7	Confident	76.7	Confident	16 Å²	16	54.8 Å²	54.8	11%	0.112	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-4.6	177.3	-50.9	0	0	0	0	113.5	N88 V90 P116 K120	N88-S92 WeakPolarHBondContact O-CA 3.33Å; N88-S92 WeakPolarHBondContact O-CB 3.47Å; N88-S92 PolarHBondContact O-N 3.45Å; N88-S92 PolarHBondContact O-OG 3.26Å; N88-S92 PolarHBondContact OD1-OG 2.58Å; V90-S92 VanDerWaalsContact C-N 3.34Å; V90-S92 PolarHBondContact O-N 2.82Å; S92-P116 WeakPolarHBondContact O-CB 3.13Å; S92-K120 PolarHBondContact OG-NZ 2.93Å
93	A	79.9	Confident	77.6	Confident	51 Å²	51	51.6 Å²	51.6	42%	0.421	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-8.9	173.3	0	0	0	0	0	112.6	F66 K89 V90 I91 T95 P116	F66-A93 HydrophobicContact CZ-CB 4.29Å; K89-A93 VanDerWaalsContact O-CB 3.29Å; K89-A93 WeakPolarHBondContact O-CB 3.46Å; K89-A93 PolarHBondContact O-N 2.82Å; V90-A93 PolarHBondContact O-N 3.07Å; I91-A93 PolarHBondContact O-N 2.99Å; A93-T95 PolarHBondContact O-N 3.16Å; A93-P116 VanDerWaalsContact O-CG 3.25Å; A93-P116 WeakPolarHBondContact O-CG 3.37Å
94	C	80	Confident	78.4	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.027	25%	0.254	C	S	.	.			trans	-93.4	97.5	-177.9	-166.3	0	0	0	0	111.2	F66 V90 I91 V97	F66-C94 HydrophobicContact CD1-CB 3.6Å; F66-C94 HydrophobicContact CE1-CB 3.7Å; F66-C94 HydrophobicContact CG-CB 4.08Å; F66-C94 VanDerWaalsContact CG-SG 3.58Å; F66-C94 HydrophobicContact CZ-CB 4.25Å; V90-C94 PolarHBondContact O-N 3.21Å; I91-C94 PolarHBondContact O-N 3.41Å; C94-V97 HydrophobicContact CB-CB 4.19Å; C94-V97 HydrophobicContact CB-CG2 4.11Å; C94-V97 WeakPolarHBondContact SG-CG2 3.33Å
95	T	82.3	Confident	79.2	Confident	12 Å²	12	51.2 Å²	51.2	7%	0.074	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-47.7	179	-56.8	0	0	0	0	112.3	A93 V97 W98 Q99 P116 W119	A93-T95 PolarHBondContact O-N 3.16Å; T95-V97 VanDerWaalsContact C-N 3.26Å; T95-V97 PolarHBondContact O-N 3.48Å; T95-W98 PolarHBondContact O-N 3Å; T95-W98 VanDerWaalsContact O-N 3.14Å; T95-Q99 HydrophobicContact CG2-CG 3.93Å; T95-Q99 WeakPolarHBondContact O-CG 3.45Å; T95-Q99 PolarHBondContact O-N 3.11Å; T95-P116 WeakPolarHBondContact OG1-CD 3.32Å; T95-P116 VanDerWaalsContact OG1-CG 3.24Å; T95-P116 WeakPolarHBondContact OG1-CG 2.94Å; T95-W119 HydrophobicContact CG2-CG 4.49Å
96	E	81.1	Confident	79.8	Confident	120 Å²	120	41.8 Å²	41.8	56%	0.561	21%	0.212	S	C	*	.	H	α-helix	trans	-59.8	-36.1	-173.6	-65.3	-176.7	179.6	0	0	112.8	T100	E96-T100 VanDerWaalsContact O-CB 3.31Å; E96-T100 WeakPolarHBondContact O-CB 3.24Å; E96-T100 PolarHBondContact O-N 3.11Å; E96-T100 PolarHBondContact O-OG1 2.8Å
97	V	83.7	Confident	80.7	Confident	7 Å²	7	37.9 Å²	37.9	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-47.8	178	167.8	0	0	0	0	110.6	L69 L77 C94 T95 T100 A101	L69-V97 HydrophobicContact CB-CG2 3.95Å; L77-V97 HydrophobicContact CD1-CG1 3.23Å; C94-V97 HydrophobicContact CB-CB 4.19Å; C94-V97 HydrophobicContact CB-CG2 4.11Å; C94-V97 WeakPolarHBondContact SG-CG2 3.33Å; T95-V97 VanDerWaalsContact C-N 3.26Å; T95-V97 PolarHBondContact O-N 3.48Å; V97-T100 PolarHBondContact O-N 3.28Å; V97-A101 VanDerWaalsContact O-CB 3.31Å; V97-A101 WeakPolarHBondContact O-CB 3.27Å; V97-A101 PolarHBondContact O-N 3.41Å
98	W	83.7	Confident	81.5	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.6	-35.2	178.6	-64.4	110.3	0	0	0	112.3	L78 I91 T95 A101 C102 W119 K120 Y123	L78-W98 HydrophobicContact CD2-CH2 3.92Å; L78-W98 HydrophobicContact CD2-CZ3 4.37Å; L78-W98 HydrophobicContact CG-CH2 4.35Å; I91-W98 HydrophobicContact CG2-CH2 4.46Å; I91-W98 HydrophobicContact CG2-CZ2 3.64Å; I91-W98 PolarHBondContact O-NE1 3.39Å; T95-W98 PolarHBondContact O-N 3Å; T95-W98 VanDerWaalsContact O-N 3.14Å; W98-A101 PolarHBondContact O-N 3.4Å; W98-C102 WeakPolarHBondContact O-CB 3.26Å; W98-C102 PolarHBondContact O-N 2.99Å; W98-C102 PolarHBondContact O-SG 2.68Å; W98-C102 VanDerWaalsContact O-SG 3.37Å; W98-W119 HydrophobicContact CB-CB 3.63Å; W98-K120 HydrophobicContact CD2-CB 4.04Å; W98-K120 HydrophobicContact CD2-CG 4.22Å; W98-K120 HydrophobicContact CE3-CG 4.41Å; W98-K120 HydrophobicContact CG-CB 4.3Å; W98-K120 HydrophobicContact CH2-CD 4.35Å; W98-K120 HydrophobicContact CH2-CG 4.05Å; W98-K120 HydrophobicContact CZ2-CB 4.39Å; W98-K120 HydrophobicContact CZ2-CD 3.8Å; W98-K120 HydrophobicContact CZ2-CG 3.8Å; W98-K120 HydrophobicContact CZ3-CG 4.35Å; W98-Y123 AromaticContact CE3-CD1 3.67Å; W98-Y123 HydrophobicContact CE3-CD1 3.67Å; W98-Y123 HydrophobicContact CE3-CE1 4.38Å; W98-Y123 AromaticContact CE3-CG 3.78Å; W98-Y123 HydrophobicContact CE3-CG 3.78Å; W98-Y123 AromaticContact CZ3-CD1 3.35Å; W98-Y123 HydrophobicContact CZ3-CD1 3.35Å; W98-Y123 AromaticContact CZ3-CE1 3.79Å; W98-Y123 HydrophobicContact CZ3-CE1 3.79Å; W98-Y123 AromaticContact CZ3-CG 3.97Å; W98-Y123 HydrophobicContact CZ3-CG 3.97Å
99	Q	84.6	Confident	82.1	Confident	13 Å²	13	37.5 Å²	37.5	6%	0.061	19%	0.193	C	C	.	.	H	α-helix	trans	-62.7	-49.5	172.1	-74.2	178.8	-22.6	0	0	110.8	T95 A101 C102 K103 I109 V113 W119	T95-Q99 HydrophobicContact CG2-CG 3.93Å; T95-Q99 WeakPolarHBondContact O-CG 3.45Å; T95-Q99 PolarHBondContact O-N 3.11Å; Q99-A101 VanDerWaalsContact C-N 3.26Å; Q99-A101 PolarHBondContact O-N 2.89Å; Q99-C102 PolarHBondContact O-N 2.75Å; Q99-C102 VanDerWaalsContact O-N 3.17Å; Q99-K103 PolarHBondContact O-N 3Å; Q99-I109 VanDerWaalsContact C-CD1 3.44Å; Q99-I109 VanDerWaalsContact CA-CD1 3.48Å; Q99-I109 HydrophobicContact CB-CD1 3.84Å; Q99-I109 HydrophobicContact CB-CG2 4.18Å; Q99-I109 HydrophobicContact CG-CD1 4.31Å; Q99-I109 HydrophobicContact CG-CG2 3.82Å; Q99-I109 WeakPolarHBondContact O-CD1 3.48Å; Q99-V113 PolarHBondContact NE2-O 3Å; Q99-W119 HydrophobicContact CG-CD2 3.77Å; Q99-W119 HydrophobicContact CG-CE3 4.36Å; Q99-W119 HydrophobicContact CG-CG 3.89Å
100	T	83.8	Confident	82.3	Confident	49 Å²	49	34.4 Å²	34.4	30%	0.301	18%	0.184	S	C	.	.	H	α-helix	trans	-60	-40.5	177.6	-53.7	0	0	0	0	111.1	E96 V97 K103 N104	E96-T100 VanDerWaalsContact O-CB 3.31Å; E96-T100 WeakPolarHBondContact O-CB 3.24Å; E96-T100 PolarHBondContact O-N 3.11Å; E96-T100 PolarHBondContact O-OG1 2.8Å; V97-T100 PolarHBondContact O-N 3.28Å; T100-K103 PolarHBondContact O-N 3.43Å; T100-N104 WeakPolarHBondContact O-CB 3.47Å; T100-N104 PolarHBondContact O-N 2.89Å; T100-N104 PolarHBondContact O-ND2 3.14Å
101	A	84.3	Confident	82.4	Confident	2 Å²	2	38 Å²	38	2%	0.017	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-43.7	175.8	0	0	0	0	0	112.9	P74 V97 W98 Q99 N104 L105 Y123	P74-A101 HydrophobicContact CB-CB 4.04Å; P74-A101 HydrophobicContact CG-CB 3.54Å; V97-A101 VanDerWaalsContact O-CB 3.31Å; V97-A101 WeakPolarHBondContact O-CB 3.27Å; V97-A101 PolarHBondContact O-N 3.41Å; W98-A101 PolarHBondContact O-N 3.4Å; Q99-A101 VanDerWaalsContact C-N 3.26Å; Q99-A101 PolarHBondContact O-N 2.89Å; A101-N104 PolarHBondContact O-N 3.36Å; A101-L105 PolarHBondContact O-N 3.17Å; A101-Y123 HydrophobicContact CB-CD2 3.69Å; A101-Y123 HydrophobicContact CB-CE2 3.63Å
102	C	86.4	Confident	82.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.8	-44.7	174.7	-76.2	0	0	0	0	112	W98 Q99 N104 L105 G106 W107 I109 Y123	W98-C102 WeakPolarHBondContact O-CB 3.26Å; W98-C102 PolarHBondContact O-N 2.99Å; W98-C102 PolarHBondContact O-SG 2.68Å; W98-C102 VanDerWaalsContact O-SG 3.37Å; Q99-C102 PolarHBondContact O-N 2.75Å; Q99-C102 VanDerWaalsContact O-N 3.17Å; C102-N104 VanDerWaalsContact C-N 3.27Å; C102-N104 PolarHBondContact O-N 2.88Å; C102-L105 PolarHBondContact O-N 3.3Å; C102-G106 PolarHBondContact O-N 3.4Å; C102-W107 HydrophobicContact CB-CB 3.99Å; C102-W107 WeakPolarHBondContact O-CB 3Å; C102-W107 PolarHBondContact O-N 2.82Å; C102-I109 HydrophobicContact CB-CD1 3.55Å; C102-I109 HydrophobicContact CB-CG1 4.25Å; C102-Y123 WeakPolarHBondContact SG-CA 3.5Å; C102-Y123 VanDerWaalsContact SG-CB 3.59Å
103	K	85.8	Confident	82.8	Confident	87 Å²	87	43.7 Å²	43.7	38%	0.378	24%	0.24	S	C	.	.	H	α-helix	trans	-56.6	-43.6	175	-91.2	161.9	-168.1	179.7	0	110.3	Q99 T100 L105 G106 I109 D111 R393	Q99-K103 PolarHBondContact O-N 3Å; T100-K103 PolarHBondContact O-N 3.43Å; K103-L105 VanDerWaalsContact C-N 3.29Å; K103-L105 PolarHBondContact O-N 2.92Å; K103-G106 PolarHBondContact O-N 3.48Å; K103-I109 HydrophobicContact CB-CD1 4.17Å; K103-I109 HydrophobicContact CD-CD1 3.94Å; K103-I109 HydrophobicContact CD-CG1 4.44Å; K103-I109 HydrophobicContact CG-CB 4.47Å; K103-I109 HydrophobicContact CG-CD1 3.53Å; K103-I109 HydrophobicContact CG-CG1 3.88Å; K103-D111 IonicContact NZ-OD1 3.79Å; K103-D111 PolarHBondContact NZ-OD1 3.19Å; K103-D111 IonicContact NZ-OD2 3.59Å; K103-D111 PolarHBondContact NZ-OD2 3.41Å; K103-R393 PolarHBondContact O-NH1 2.91Å
104	N	84.6	Confident	82.7	Confident	100 Å²	100	47.2 Å²	47.2	54%	0.535	25%	0.248	S	C	.	.	H	α-helix	trans	-64.1	-30.9	177.6	-71.1	-15.3	0	0	0	113.2	T100 A101 C102 G106 R393	T100-N104 WeakPolarHBondContact O-CB 3.47Å; T100-N104 PolarHBondContact O-N 2.89Å; T100-N104 PolarHBondContact O-ND2 3.14Å; A101-N104 PolarHBondContact O-N 3.36Å; C102-N104 VanDerWaalsContact C-N 3.27Å; C102-N104 PolarHBondContact O-N 2.88Å; N104-G106 PolarHBondContact O-N 2.93Å; N104-R393 PolarHBondContact O-NH1 3.07Å; N104-R393 PolarHBondContact O-NH2 3.4Å
105	L	83.9	Confident	82.8	Confident	39 Å²	39	50.6 Å²	50.6	20%	0.204	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-5.8	172.4	-69.8	178.5	0	0	0	114.1	A101 C102 K103 Y123 A126 I127 M130	A101-L105 PolarHBondContact O-N 3.17Å; C102-L105 PolarHBondContact O-N 3.3Å; K103-L105 VanDerWaalsContact C-N 3.29Å; K103-L105 PolarHBondContact O-N 2.92Å; L105-Y123 HydrophobicContact CD1-CD2 3.83Å; L105-Y123 HydrophobicContact CD1-CE2 3.36Å; L105-Y123 HydrophobicContact CG-CE2 4.13Å; L105-A126 HydrophobicContact CD1-CB 3.79Å; L105-I127 HydrophobicContact CD1-CG1 3.97Å; L105-M130 HydrophobicContact CD2-CG 4.45Å
106	G	82.5	Confident	82.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	23.5	-176.8	0	0	0	0	0	113.5	C102 K103 N104 G425 L426	C102-G106 PolarHBondContact O-N 3.4Å; K103-G106 PolarHBondContact O-N 3.48Å; N104-G106 PolarHBondContact O-N 2.93Å; G106-G425 CarbonylContact O-C 3.57Å; G106-G425 WeakPolarHBondContact O-CA 3.27Å; G106-L426 PolarHBondContact O-N 3.37Å
107	W	87.3	Confident	82.4	Confident	12 Å²	12	50.5 Å²	50.5	5%	0.045	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-86.2	139.1	173.7	-130.3	-96.4	0	0	0	110.9	C102 V122 A126 R129 L426	C102-W107 HydrophobicContact CB-CB 3.99Å; C102-W107 WeakPolarHBondContact O-CB 3Å; C102-W107 PolarHBondContact O-N 2.82Å; W107-V122 HydrophobicContact CG-CG1 4.4Å; W107-A126 HydrophobicContact CD2-CB 3.62Å; W107-A126 HydrophobicContact CE3-CB 3.24Å; W107-A126 HydrophobicContact CG-CB 4.29Å; W107-A126 HydrophobicContact CH2-CB 4.12Å; W107-A126 HydrophobicContact CZ2-CB 4.42Å; W107-A126 HydrophobicContact CZ3-CB 3.53Å; W107-R129 HydrophobicContact CH2-CB 3.84Å; W107-R129 HydrophobicContact CH2-CG 4.09Å; W107-R129 HydrophobicContact CZ3-CB 4.12Å; W107-R129 HydrophobicContact CZ3-CG 4.4Å; W107-L426 CarbonylContact C-O 3.55Å; W107-L426 WeakPolarHBondContact CA-O 2.9Å; W107-L426 HydrophobicContact CD2-CB 3.73Å; W107-L426 HydrophobicContact CE3-CB 3.46Å; W107-L426 VanDerWaalsContact CE3-CB 3.46Å; W107-L426 HydrophobicContact CE3-CD1 3.99Å; W107-L426 HydrophobicContact CE3-CG 4.36Å; W107-L426 HydrophobicContact CH2-CB 3.66Å; W107-L426 HydrophobicContact CH2-CD1 3.97Å; W107-L426 HydrophobicContact CH2-CG 4.36Å; W107-L426 HydrophobicContact CZ2-CB 3.9Å; W107-L426 HydrophobicContact CZ3-CB 3.42Å; W107-L426 VanDerWaalsContact CZ3-CB 3.42Å; W107-L426 HydrophobicContact CZ3-CD1 3.38Å; W107-L426 HydrophobicContact CZ3-CG 4.01Å; W107-L426 PolarHBondContact NE1-O 2.85Å
108	Q	85.5	Confident	82.5	Confident	78 Å²	78	53.9 Å²	53.9	36%	0.364	29%	0.285	S	S	.	.			trans	-74	138.8	169.7	-65.3	-179.7	-8.2	0	0	109.6	N424 G425 L426 N427	Q108-N424 PolarHBondContact NE2-O 2.99Å; Q108-G425 PolarHBondContact NE2-O 3.28Å; Q108-L426 PolarHBondContact N-O 2.85Å; Q108-N427 HydrophobicContact CB-CB 4.23Å
109	I	83.9	Confident	82.5	Confident	30 Å²	30	54.3 Å²	54.3	15%	0.154	29%	0.286	C	S	.	.			trans	-125.4	136.3	-173.7	-58.9	-159.7	0	0	0	109.6	Q99 C102 K103 W119	Q99-I109 VanDerWaalsContact C-CD1 3.44Å; Q99-I109 VanDerWaalsContact CA-CD1 3.48Å; Q99-I109 HydrophobicContact CB-CD1 3.84Å; Q99-I109 HydrophobicContact CB-CG2 4.18Å; Q99-I109 HydrophobicContact CG-CD1 4.31Å; Q99-I109 HydrophobicContact CG-CG2 3.82Å; Q99-I109 WeakPolarHBondContact O-CD1 3.48Å; C102-I109 HydrophobicContact CB-CD1 3.55Å; C102-I109 HydrophobicContact CB-CG1 4.25Å; K103-I109 HydrophobicContact CB-CD1 4.17Å; K103-I109 HydrophobicContact CD-CD1 3.94Å; K103-I109 HydrophobicContact CD-CG1 4.44Å; K103-I109 HydrophobicContact CG-CB 4.47Å; K103-I109 HydrophobicContact CG-CD1 3.53Å; K103-I109 HydrophobicContact CG-CG1 3.88Å; I109-W119 HydrophobicContact CB-CH2 3.97Å; I109-W119 HydrophobicContact CB-CZ3 4.21Å; I109-W119 HydrophobicContact CD1-CE3 4.49Å; I109-W119 HydrophobicContact CD1-CZ3 4.19Å; I109-W119 HydrophobicContact CG1-CH2 4.21Å; I109-W119 HydrophobicContact CG1-CZ3 3.93Å; I109-W119 HydrophobicContact CG2-CH2 3.52Å; I109-W119 HydrophobicContact CG2-CZ2 3.69Å; I109-W119 HydrophobicContact CG2-CZ3 3.95Å
110	D	80.6	Confident	82.5	Confident	88 Å²	88	55.3 Å²	55.3	47%	0.471	29%	0.29	S	S	.	.			trans	-94.6	102.8	167	-174.2	-8.5	0	0	0	108.8	S112 V113 W119	D110-S112 PolarHBondContact O-N 2.89Å; D110-S112 VanDerWaalsContact O-N 3.11Å; D110-S112 VanDerWaalsContact OD1-CB 3.22Å; D110-S112 WeakPolarHBondContact OD1-CB 2.79Å; D110-S112 PolarHBondContact OD1-N 2.89Å; D110-S112 PolarHBondContact OD1-OG 3.04Å; D110-S112 PolarHBondContact OD2-OG 2.82Å; D110-S112 VanDerWaalsContact OD2-OG 3.13Å; D110-V113 HydrophobicContact CB-CG2 4.2Å; D110-V113 PolarHBondContact O-N 2.92Å; D110-W119 VanDerWaalsContact O-CZ2 3.3Å; D110-W119 WeakPolarHBondContact O-CZ2 3.39Å
111	D	76.1	Confident	82.5	Confident	90 Å²	90	59.2 Å²	59.2	48%	0.481	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-12	-178.5	-66.5	-33.7	0	0	0	112.3	K103 Q114	K103-D111 IonicContact NZ-OD1 3.79Å; K103-D111 PolarHBondContact NZ-OD1 3.19Å; K103-D111 IonicContact NZ-OD2 3.59Å; K103-D111 PolarHBondContact NZ-OD2 3.41Å; D111-Q114 PolarHBondContact O-NE2 2.63Å; D111-Q114 VanDerWaalsContact O-NE2 3.11Å
112	S	79.4	Confident	82.7	Confident	90 Å²	90	60.1 Å²	60.1	63%	0.629	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-24.5	175.5	76.8	0	0	0	0	113.5	D110 Q114	D110-S112 PolarHBondContact O-N 2.89Å; D110-S112 VanDerWaalsContact O-N 3.11Å; D110-S112 VanDerWaalsContact OD1-CB 3.22Å; D110-S112 WeakPolarHBondContact OD1-CB 2.79Å; D110-S112 PolarHBondContact OD1-N 2.89Å; D110-S112 PolarHBondContact OD1-OG 3.04Å; D110-S112 PolarHBondContact OD2-OG 2.82Å; D110-S112 VanDerWaalsContact OD2-OG 3.13Å; S112-Q114 PolarHBondContact O-N 3.23Å
113	V	80.1	Confident	82.7	Confident	45 Å²	45	60.7 Å²	60.7	27%	0.273	31%	0.311	S	S	.	.			trans	-83.9	99.9	-177.6	-178.6	0	0	0	0	109.9	Q99 D110 D115 W119	Q99-V113 PolarHBondContact NE2-O 3Å; D110-V113 HydrophobicContact CB-CG2 4.2Å; D110-V113 PolarHBondContact O-N 2.92Å; V113-D115 VanDerWaalsContact C-N 3.29Å; V113-D115 HydrophobicContact CG1-CB 4.13Å; V113-D115 PolarHBondContact O-N 3.34Å; V113-W119 HydrophobicContact CB-CZ2 4.16Å; V113-W119 PolarHBondContact O-NE1 3.05Å
114	Q	77.4	Confident	82.7	Confident	125 Å²	125	60.6 Å²	60.6	58%	0.584	31%	0.314	S	S	*	.			trans	-92.2	49.3	175.8	-63.6	-62.7	-31.9	0	0	112.2	D111 S112	D111-Q114 PolarHBondContact O-NE2 2.63Å; D111-Q114 VanDerWaalsContact O-NE2 3.11Å; S112-Q114 PolarHBondContact O-N 3.23Å
115	D	81.7	Confident	82.8	Confident	76 Å²	76	62.8 Å²	62.8	41%	0.406	32%	0.319	S	S	.	.			trans	-113.6	101.1	174.3	-178.9	-1.4	0	0	0	111	V113 L117 H118 W119	V113-D115 VanDerWaalsContact C-N 3.29Å; V113-D115 HydrophobicContact CG1-CB 4.13Å; V113-D115 PolarHBondContact O-N 3.34Å; D115-L117 VanDerWaalsContact C-N 3.28Å; D115-L117 PolarHBondContact O-N 3.21Å; D115-L117 WeakPolarHBondContact OD1-CB 3.44Å; D115-L117 PolarHBondContact OD1-N 3.35Å; D115-H118 HydrophobicContact CB-CB 3.8Å; D115-H118 WeakPolarHBondContact O-CB 3.45Å; D115-H118 PolarHBondContact O-N 3.42Å; D115-H118 PolarHBondContact OD1-N 3.42Å; D115-H118 WeakPolarHBondContact OD2-CB 3.48Å; D115-W119 PolarHBondContact O-N 2.81Å; D115-W119 VanDerWaalsContact O-N 3.16Å
116	P	74.3	Confident	83	Confident	27 Å²	27	61 Å²	61	18%	0.175	31%	0.309	C	S	.	.	H	α-helix	trans	-56.8	-36.6	177.5	-24.4	30.1	0	0	0	114.6	S92 A93 T95 W119 K120	S92-P116 WeakPolarHBondContact O-CB 3.13Å; A93-P116 VanDerWaalsContact O-CG 3.25Å; A93-P116 WeakPolarHBondContact O-CG 3.37Å; T95-P116 WeakPolarHBondContact OG1-CD 3.32Å; T95-P116 VanDerWaalsContact OG1-CG 3.24Å; T95-P116 WeakPolarHBondContact OG1-CG 2.94Å; P116-W119 PolarHBondContact O-N 2.96Å; P116-K120 WeakPolarHBondContact O-CB 3.3Å; P116-K120 PolarHBondContact O-N 3.06Å
117	L	80.6	Confident	83.2	Confident	102 Å²	102	63.6 Å²	63.6	53%	0.534	32%	0.322	S	S	.	.	H	α-helix	trans	-73.3	-35.1	-175.3	-133.8	103.1	0	0	0	110.7	D115 K121	D115-L117 VanDerWaalsContact C-N 3.28Å; D115-L117 PolarHBondContact O-N 3.21Å; D115-L117 WeakPolarHBondContact OD1-CB 3.44Å; D115-L117 PolarHBondContact OD1-N 3.35Å; L117-K121 WeakPolarHBondContact O-CG 3.36Å; L117-K121 PolarHBondContact O-N 3.26Å
118	H	85.8	Confident	83.2	Confident	79 Å²	79	66.6 Å²	66.6	37%	0.366	34%	0.339	S	S	.	.	H	α-helix	trans	-59.9	-54.1	169.6	175.2	86.3	0	0	0	110.8	D115 K120 K121 V122	D115-H118 HydrophobicContact CB-CB 3.8Å; D115-H118 WeakPolarHBondContact O-CB 3.45Å; D115-H118 PolarHBondContact O-N 3.42Å; D115-H118 PolarHBondContact OD1-N 3.42Å; D115-H118 WeakPolarHBondContact OD2-CB 3.48Å; H118-K120 VanDerWaalsContact C-N 3.31Å; H118-K120 PolarHBondContact O-N 3.36Å; H118-K121 WeakPolarHBondContact O-CA 3.42Å; H118-K121 WeakPolarHBondContact O-CB 3.17Å; H118-K121 PolarHBondContact O-N 3.36Å; H118-V122 WeakPolarHBondContact NE2-CG2 3.22Å; H118-V122 WeakPolarHBondContact O-CG2 3.28Å; H118-V122 PolarHBondContact O-N 2.98Å
119	W	84.6	Confident	83.4	Confident	9 Å²	9	63.8 Å²	63.8	3%	0.034	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-34	-177.2	-73.7	109.7	0	0	0	113.5	T95 W98 Q99 I109 D110 V113 D115 P116 V122 Y123	T95-W119 HydrophobicContact CG2-CG 4.49Å; W98-W119 HydrophobicContact CB-CB 3.63Å; Q99-W119 HydrophobicContact CG-CD2 3.77Å; Q99-W119 HydrophobicContact CG-CE3 4.36Å; Q99-W119 HydrophobicContact CG-CG 3.89Å; I109-W119 HydrophobicContact CB-CH2 3.97Å; I109-W119 HydrophobicContact CB-CZ3 4.21Å; I109-W119 HydrophobicContact CD1-CE3 4.49Å; I109-W119 HydrophobicContact CD1-CZ3 4.19Å; I109-W119 HydrophobicContact CG1-CH2 4.21Å; I109-W119 HydrophobicContact CG1-CZ3 3.93Å; I109-W119 HydrophobicContact CG2-CH2 3.52Å; I109-W119 HydrophobicContact CG2-CZ2 3.69Å; I109-W119 HydrophobicContact CG2-CZ3 3.95Å; D110-W119 VanDerWaalsContact O-CZ2 3.3Å; D110-W119 WeakPolarHBondContact O-CZ2 3.39Å; V113-W119 HydrophobicContact CB-CZ2 4.16Å; V113-W119 PolarHBondContact O-NE1 3.05Å; D115-W119 PolarHBondContact O-N 2.81Å; D115-W119 VanDerWaalsContact O-N 3.16Å; P116-W119 PolarHBondContact O-N 2.96Å; W119-V122 HydrophobicContact CE3-CB 4.19Å; W119-V122 HydrophobicContact CE3-CG1 4.2Å; W119-V122 HydrophobicContact CE3-CG2 4.47Å; W119-V122 HydrophobicContact CZ3-CB 4.49Å; W119-V122 HydrophobicContact CZ3-CG1 4.09Å; W119-V122 PolarHBondContact O-N 2.87Å; W119-Y123 VanDerWaalsContact O-CB 3.28Å; W119-Y123 WeakPolarHBondContact O-CB 3.4Å; W119-Y123 PolarHBondContact O-N 2.88Å
120	K	83.3	Confident	83.6	Confident	34 Å²	34	63.2 Å²	63.2	15%	0.148	32%	0.322	C	S	.	.	H	α-helix	trans	-62.4	-41	170.9	-173.2	176.4	-173.5	176	0	112.4	N88 S92 W98 P116 H118 Y123 L124	N88-K120 PolarHBondContact OD1-NZ 3.31Å; S92-K120 PolarHBondContact OG-NZ 2.93Å; W98-K120 HydrophobicContact CD2-CB 4.04Å; W98-K120 HydrophobicContact CD2-CG 4.22Å; W98-K120 HydrophobicContact CE3-CG 4.41Å; W98-K120 HydrophobicContact CG-CB 4.3Å; W98-K120 HydrophobicContact CH2-CD 4.35Å; W98-K120 HydrophobicContact CH2-CG 4.05Å; W98-K120 HydrophobicContact CZ2-CB 4.39Å; W98-K120 HydrophobicContact CZ2-CD 3.8Å; W98-K120 HydrophobicContact CZ2-CG 3.8Å; W98-K120 HydrophobicContact CZ3-CG 4.35Å; P116-K120 WeakPolarHBondContact O-CB 3.3Å; P116-K120 PolarHBondContact O-N 3.06Å; H118-K120 VanDerWaalsContact C-N 3.31Å; H118-K120 PolarHBondContact O-N 3.36Å; K120-Y123 PolarHBondContact O-N 3.17Å; K120-L124 WeakPolarHBondContact O-CG 3.35Å; K120-L124 PolarHBondContact O-N 2.82Å
121	K	85.6	Confident	84	Confident	131 Å²	131	64.8 Å²	64.8	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-66.7	-43.1	175.4	-72.3	173.7	-178.5	176.5	0	111.5	L117 H118 Y123 L124 K125	L117-K121 WeakPolarHBondContact O-CG 3.36Å; L117-K121 PolarHBondContact O-N 3.26Å; H118-K121 WeakPolarHBondContact O-CA 3.42Å; H118-K121 WeakPolarHBondContact O-CB 3.17Å; H118-K121 PolarHBondContact O-N 3.36Å; K121-Y123 VanDerWaalsContact C-N 3.3Å; K121-Y123 PolarHBondContact O-N 3.07Å; K121-L124 PolarHBondContact O-N 2.79Å; K121-K125 PolarHBondContact O-N 3.35Å
122	V	87.2	Confident	84.6	Confident	21 Å²	21	61.3 Å²	61.3	13%	0.127	31%	0.305	C	S	.	.	H	α-helix	trans	-59.8	-43.9	175.1	175.2	0	0	0	0	110.2	W107 H118 W119 L124 K125 A126	W107-V122 HydrophobicContact CG-CG1 4.4Å; H118-V122 WeakPolarHBondContact NE2-CG2 3.22Å; H118-V122 WeakPolarHBondContact O-CG2 3.28Å; H118-V122 PolarHBondContact O-N 2.98Å; W119-V122 HydrophobicContact CE3-CB 4.19Å; W119-V122 HydrophobicContact CE3-CG1 4.2Å; W119-V122 HydrophobicContact CE3-CG2 4.47Å; W119-V122 HydrophobicContact CZ3-CB 4.49Å; W119-V122 HydrophobicContact CZ3-CG1 4.09Å; W119-V122 PolarHBondContact O-N 2.87Å; V122-L124 PolarHBondContact O-N 2.77Å; V122-K125 WeakPolarHBondContact O-CB 3.38Å; V122-K125 PolarHBondContact O-N 2.77Å; V122-A126 WeakPolarHBondContact O-CB 3.48Å; V122-A126 PolarHBondContact O-N 3.04Å
123	Y	86.9	Confident	85.1	Confident	12 Å²	12	57.2 Å²	57.2	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-43.8	177	180	-104.5	0	0	0	112.7	P74 L78 W98 A101 C102 L105 W119 K120 K121 K125 A126 I127	P74-Y123 HydrophobicContact CB-CE1 4.08Å; P74-Y123 HydrophobicContact CB-CE2 3.95Å; P74-Y123 WeakPolarHBondContact CB-OH 3.45Å; P74-Y123 HydrophobicContact CG-CE2 4.41Å; L78-Y123 HydrophobicContact CD1-CE1 3.91Å; L78-Y123 HydrophobicContact CG-CE1 4.38Å; W98-Y123 AromaticContact CE3-CD1 3.67Å; W98-Y123 HydrophobicContact CE3-CD1 3.67Å; W98-Y123 HydrophobicContact CE3-CE1 4.38Å; W98-Y123 AromaticContact CE3-CG 3.78Å; W98-Y123 HydrophobicContact CE3-CG 3.78Å; W98-Y123 AromaticContact CZ3-CD1 3.35Å; W98-Y123 HydrophobicContact CZ3-CD1 3.35Å; W98-Y123 AromaticContact CZ3-CE1 3.79Å; W98-Y123 HydrophobicContact CZ3-CE1 3.79Å; W98-Y123 AromaticContact CZ3-CG 3.97Å; W98-Y123 HydrophobicContact CZ3-CG 3.97Å; A101-Y123 HydrophobicContact CB-CD2 3.69Å; A101-Y123 HydrophobicContact CB-CE2 3.63Å; C102-Y123 WeakPolarHBondContact SG-CA 3.5Å; C102-Y123 VanDerWaalsContact SG-CB 3.59Å; L105-Y123 HydrophobicContact CD1-CD2 3.83Å; L105-Y123 HydrophobicContact CD1-CE2 3.36Å; L105-Y123 HydrophobicContact CG-CE2 4.13Å; W119-Y123 VanDerWaalsContact O-CB 3.28Å; W119-Y123 WeakPolarHBondContact O-CB 3.4Å; W119-Y123 PolarHBondContact O-N 2.88Å; K120-Y123 PolarHBondContact O-N 3.17Å; K121-Y123 VanDerWaalsContact C-N 3.3Å; K121-Y123 PolarHBondContact O-N 3.07Å; Y123-K125 PolarHBondContact O-N 3.13Å; Y123-A126 WeakPolarHBondContact O-CB 3.43Å; Y123-A126 PolarHBondContact O-N 2.62Å; Y123-A126 VanDerWaalsContact O-N 3.17Å; Y123-I127 HydrophobicContact CD1-CD1 4.07Å; Y123-I127 HydrophobicContact CD1-CG1 4.43Å; Y123-I127 HydrophobicContact CE1-CD1 3.28Å; Y123-I127 HydrophobicContact CE1-CG1 3.85Å; Y123-I127 HydrophobicContact CE2-CD1 4.46Å; Y123-I127 HydrophobicContact CE2-CG1 4.2Å; Y123-I127 VanDerWaalsContact CZ-CD1 3.47Å; Y123-I127 PolarHBondContact O-N 3.3Å; Y123-I127 VanDerWaalsContact OH-CD1 3.32Å; Y123-I127 WeakPolarHBondContact OH-CD1 3.46Å
124	L	85.2	Confident	85.5	Confident	84 Å²	84	60.9 Å²	60.9	44%	0.44	29%	0.289	S	S	.	.	H	α-helix	trans	-63	-41.1	176	-70.7	172.4	0	0	0	112.1	L78 K120 K121 V122 A126 L128	L78-L124 HydrophobicContact CD1-CD2 4.38Å; L78-L124 HydrophobicContact CD2-CD2 4.12Å; K120-L124 WeakPolarHBondContact O-CG 3.35Å; K120-L124 PolarHBondContact O-N 2.82Å; K121-L124 PolarHBondContact O-N 2.79Å; V122-L124 PolarHBondContact O-N 2.77Å; L124-A126 VanDerWaalsContact C-N 3.32Å; L124-L128 WeakPolarHBondContact O-CB 3.3Å; L124-L128 PolarHBondContact O-N 2.69Å
125	K	87.3	Confident	86	Confident	147 Å²	147	58.7 Å²	58.7	64%	0.639	28%	0.281	S	S	*	.	H	α-helix	trans	-61.8	-41.5	171.9	-71.2	-177.4	173.7	-168.3	0	111.4	K121 V122 Y123 L128 R129	K121-K125 PolarHBondContact O-N 3.35Å; V122-K125 WeakPolarHBondContact O-CB 3.38Å; V122-K125 PolarHBondContact O-N 2.77Å; Y123-K125 PolarHBondContact O-N 3.13Å; K125-L128 PolarHBondContact O-N 3.33Å; K125-R129 WeakPolarHBondContact O-CB 3.48Å; K125-R129 PolarHBondContact O-N 3.08Å
126	A	87.5	Confident	86.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-45.1	179.4	0	0	0	0	0	112.4	L105 W107 V122 Y123 L124 L128 R129 M130	L105-A126 HydrophobicContact CD1-CB 3.79Å; W107-A126 HydrophobicContact CD2-CB 3.62Å; W107-A126 HydrophobicContact CE3-CB 3.24Å; W107-A126 HydrophobicContact CG-CB 4.29Å; W107-A126 HydrophobicContact CH2-CB 4.12Å; W107-A126 HydrophobicContact CZ2-CB 4.42Å; W107-A126 HydrophobicContact CZ3-CB 3.53Å; V122-A126 WeakPolarHBondContact O-CB 3.48Å; V122-A126 PolarHBondContact O-N 3.04Å; Y123-A126 WeakPolarHBondContact O-CB 3.43Å; Y123-A126 PolarHBondContact O-N 2.62Å; Y123-A126 VanDerWaalsContact O-N 3.17Å; L124-A126 VanDerWaalsContact C-N 3.32Å; A126-L128 VanDerWaalsContact C-N 3.33Å; A126-L128 PolarHBondContact O-N 3.25Å; A126-R129 PolarHBondContact O-N 2.77Å; A126-M130 WeakPolarHBondContact O-CB 3.48Å; A126-M130 VanDerWaalsContact O-CG 3.26Å; A126-M130 WeakPolarHBondContact O-CG 3.42Å; A126-M130 PolarHBondContact O-N 3.19Å
127	I	87.1	Confident	87	Confident	55 Å²	55	62.7 Å²	62.7	28%	0.282	30%	0.295	S	S	.	.	H	α-helix	trans	-56.9	-50.4	172	-72.2	-178.3	0	0	0	110.2	L78 L105 Y123 R129 M130 K131	L78-I127 HydrophobicContact CD1-CD1 3.82Å; L105-I127 HydrophobicContact CD1-CG1 3.97Å; Y123-I127 HydrophobicContact CD1-CD1 4.07Å; Y123-I127 HydrophobicContact CD1-CG1 4.43Å; Y123-I127 HydrophobicContact CE1-CD1 3.28Å; Y123-I127 HydrophobicContact CE1-CG1 3.85Å; Y123-I127 HydrophobicContact CE2-CD1 4.46Å; Y123-I127 HydrophobicContact CE2-CG1 4.2Å; Y123-I127 VanDerWaalsContact CZ-CD1 3.47Å; Y123-I127 PolarHBondContact O-N 3.3Å; Y123-I127 VanDerWaalsContact OH-CD1 3.32Å; Y123-I127 WeakPolarHBondContact OH-CD1 3.46Å; I127-R129 VanDerWaalsContact C-N 3.29Å; I127-R129 PolarHBondContact O-N 3.16Å; I127-M130 PolarHBondContact O-N 3.41Å; I127-K131 WeakPolarHBondContact O-CB 3.26Å; I127-K131 PolarHBondContact O-N 3.05Å
128	L	87.8	Confident	87.3	Confident	76 Å²	76	57.9 Å²	57.9	40%	0.398	27%	0.27	S	S	.	.	H	α-helix	trans	-59	-45.4	-175.6	-178	62.5	0	0	0	110.6	L124 K125 A126 K131 Q132 G454	L124-L128 WeakPolarHBondContact O-CB 3.3Å; L124-L128 PolarHBondContact O-N 2.69Å; K125-L128 PolarHBondContact O-N 3.33Å; A126-L128 VanDerWaalsContact C-N 3.33Å; A126-L128 PolarHBondContact O-N 3.25Å; L128-K131 WeakPolarHBondContact O-CB 3.43Å; L128-K131 PolarHBondContact O-N 3.21Å; L128-Q132 WeakPolarHBondContact O-CG 3.41Å; L128-Q132 PolarHBondContact O-N 2.92Å; L128-G454 VanDerWaalsContact CD2-OXT 3.26Å; L128-G454 WeakPolarHBondContact CD2-OXT 3.4Å
129	R	88.4	Confident	87.7	Confident	19 Å²	19	54.7 Å²	54.7	7%	0.072	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-43.5	177.6	-172.2	63.9	73.7	-177.8	18.4	112.4	W107 K125 A126 I127 K131 Q132 L133 L426 D431	W107-R129 HydrophobicContact CH2-CB 3.84Å; W107-R129 HydrophobicContact CH2-CG 4.09Å; W107-R129 HydrophobicContact CZ3-CB 4.12Å; W107-R129 HydrophobicContact CZ3-CG 4.4Å; K125-R129 WeakPolarHBondContact O-CB 3.48Å; K125-R129 PolarHBondContact O-N 3.08Å; A126-R129 PolarHBondContact O-N 2.77Å; I127-R129 VanDerWaalsContact C-N 3.29Å; I127-R129 PolarHBondContact O-N 3.16Å; R129-K131 VanDerWaalsContact C-N 3.26Å; R129-K131 PolarHBondContact O-N 3.12Å; R129-Q132 WeakPolarHBondContact O-CB 3.44Å; R129-Q132 PolarHBondContact O-N 3.31Å; R129-L133 WeakPolarHBondContact O-CG 3.11Å; R129-L133 PolarHBondContact O-N 3.29Å; R129-L426 HydrophobicContact CG-CD1 4.19Å; R129-D431 IonicContact CZ-OD2 2.6Å; R129-D431 IonicContact NE-OD2 2.74Å; R129-D431 PolarHBondContact NE-OD2 3.23Å; R129-D431 IonicContact NH2-OD2 2.87Å; R129-D431 PolarHBondContact NH2-OD2 3.38Å
130	M	88.4	Confident	88.1	Confident	17 Å²	17	58.4 Å²	58.4	8%	0.084	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-33.3	175.6	-71	-59	-68.3	0	0	112.3	L105 A126 I127 L133 K134 F378 I398 L426	L105-M130 HydrophobicContact CD2-CG 4.45Å; A126-M130 WeakPolarHBondContact O-CB 3.48Å; A126-M130 VanDerWaalsContact O-CG 3.26Å; A126-M130 WeakPolarHBondContact O-CG 3.42Å; A126-M130 PolarHBondContact O-N 3.19Å; I127-M130 PolarHBondContact O-N 3.41Å; M130-L133 HydrophobicContact SD-CD1 3.97Å; M130-K134 WeakPolarHBondContact O-CG 3.47Å; M130-K134 PolarHBondContact O-N 3.32Å; M130-K134 VanDerWaalsContact O-N 3.15Å; M130-F378 HydrophobicContact SD-CZ 4.45Å; M130-I398 HydrophobicContact CE-CD1 4Å; M130-I398 HydrophobicContact CE-CG1 4.36Å; M130-I398 HydrophobicContact CE-CG2 3.83Å; M130-L426 HydrophobicContact SD-CD1 4.44Å
131	K	88.9	Confident	88.5	Confident	121 Å²	121	60.6 Å²	60.6	53%	0.526	29%	0.289	S	S	.	.	H	α-helix	trans	-67.3	-47	173.2	-176.1	178.9	177.4	-172.3	0	111	I127 L128 R129 L133 K134 D135	I127-K131 WeakPolarHBondContact O-CB 3.26Å; I127-K131 PolarHBondContact O-N 3.05Å; L128-K131 WeakPolarHBondContact O-CB 3.43Å; L128-K131 PolarHBondContact O-N 3.21Å; R129-K131 VanDerWaalsContact C-N 3.26Å; R129-K131 PolarHBondContact O-N 3.12Å; K131-L133 VanDerWaalsContact C-N 3.26Å; K131-L133 PolarHBondContact O-N 3.1Å; K131-K134 WeakPolarHBondContact O-CB 3.19Å; K131-K134 PolarHBondContact O-N 3.23Å; K131-D135 WeakPolarHBondContact CE-OD2 3.43Å; K131-D135 WeakPolarHBondContact CG-OD2 3.03Å; K131-D135 WeakPolarHBondContact O-CB 3.39Å; K131-D135 PolarHBondContact O-N 3.36Å
132	Q	89.1	Confident	88.9	Confident	17 Å²	17	56.3 Å²	56.3	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-58.7	-38.2	175.6	-74.1	168.5	-6.9	0	0	112.9	L128 R129 H136 E137 A138 G454	L128-Q132 WeakPolarHBondContact O-CG 3.41Å; L128-Q132 PolarHBondContact O-N 2.92Å; R129-Q132 WeakPolarHBondContact O-CB 3.44Å; R129-Q132 PolarHBondContact O-N 3.31Å; Q132-H136 PolarHBondContact O-N 3.34Å; Q132-H136 VanDerWaalsContact O-N 3.17Å; Q132-E137 HydrophobicContact CB-CB 4.4Å; Q132-E137 HydrophobicContact CG-CB 4.4Å; Q132-E137 PolarHBondContact O-N 2.91Å; Q132-A138 HydrophobicContact CB-CB 4.08Å; Q132-A138 PolarHBondContact O-N 2.72Å; Q132-G454 PolarHBondContact NE2-OXT 3.41Å
133	L	89.4	Confident	89.2	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-50.8	173.7	-74.9	167.4	0	0	0	110	R129 M130 K131 D135 H136 A138 F139 I389 I398 S399 W450	R129-L133 WeakPolarHBondContact O-CG 3.11Å; R129-L133 PolarHBondContact O-N 3.29Å; M130-L133 HydrophobicContact SD-CD1 3.97Å; K131-L133 VanDerWaalsContact C-N 3.26Å; K131-L133 PolarHBondContact O-N 3.1Å; L133-D135 VanDerWaalsContact C-N 3.34Å; L133-D135 PolarHBondContact O-N 2.91Å; L133-H136 PolarHBondContact O-N 3Å; L133-A138 HydrophobicContact CB-CB 4.49Å; L133-A138 HydrophobicContact CD2-CB 3.53Å; L133-A138 HydrophobicContact CG-CB 3.89Å; L133-F139 HydrophobicContact CD2-CE1 4.32Å; L133-F139 HydrophobicContact CD2-CE2 4.26Å; L133-F139 HydrophobicContact CD2-CZ 3.75Å; L133-I389 HydrophobicContact CD2-CD1 3.6Å; L133-I398 HydrophobicContact CB-CG2 4.48Å; L133-S399 WeakPolarHBondContact O-CB 3.42Å; L133-S399 PolarHBondContact O-OG 3.45Å; L133-W450 HydrophobicContact CD1-CH2 4.35Å; L133-W450 HydrophobicContact CD2-CH2 3.79Å; L133-W450 HydrophobicContact CD2-CZ3 3.99Å; L133-W450 HydrophobicContact CG-CH2 4.41Å
134	K	89.1	Confident	89.6	Confident	122 Å²	122	58.3 Å²	58.3	53%	0.53	29%	0.292	S	S	.	.	H	α-helix	trans	-62.2	-38.8	179.6	-72.5	174.2	-179.9	-177.6	0	113.4	M130 K131 H136 I398	M130-K134 WeakPolarHBondContact O-CG 3.47Å; M130-K134 PolarHBondContact O-N 3.32Å; M130-K134 VanDerWaalsContact O-N 3.15Å; K131-K134 WeakPolarHBondContact O-CB 3.19Å; K131-K134 PolarHBondContact O-N 3.23Å; K134-H136 VanDerWaalsContact C-N 3.29Å; K134-H136 PolarHBondContact O-N 3.31Å; K134-I398 HydrophobicContact CG-CG2 4.24Å
135	D	88.7	Confident	89.9	Confident	79 Å²	79	60.7 Å²	60.7	42%	0.422	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	2.5	-174.7	-64.8	-13.6	0	0	0	112.8	K131 L133 E137	K131-D135 WeakPolarHBondContact CE-OD2 3.43Å; K131-D135 WeakPolarHBondContact CG-OD2 3.03Å; K131-D135 WeakPolarHBondContact O-CB 3.39Å; K131-D135 PolarHBondContact O-N 3.36Å; L133-D135 VanDerWaalsContact C-N 3.34Å; L133-D135 PolarHBondContact O-N 2.91Å; D135-E137 HydrophobicContact CB-CG 4.35Å
136	H	86.9	Confident	90.1	Very high	77 Å²	77	55.6 Å²	55.6	36%	0.356	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	42.1	-177.8	-43.4	-48.6	0	0	0	113	Q132 L133 K134 S399 R400 W401	Q132-H136 PolarHBondContact O-N 3.34Å; Q132-H136 VanDerWaalsContact O-N 3.17Å; L133-H136 PolarHBondContact O-N 3Å; K134-H136 VanDerWaalsContact C-N 3.29Å; K134-H136 PolarHBondContact O-N 3.31Å; H136-S399 PolarHBondContact ND1-OG 2.89Å; H136-R400 PolarHBondContact CE1-O 2.84Å; H136-R400 PolarHBondContact ND1-O 2.88Å; H136-W401 VanDerWaalsContact C-CZ3 3.47Å; H136-W401 HydrophobicContact CB-CE3 4.09Å; H136-W401 HydrophobicContact CB-CZ3 4.06Å; H136-W401 WeakPolarHBondContact O-CZ3 3.41Å
137	E	88.5	Confident	90.4	Very high	111 Å²	111	56.4 Å²	56.4	52%	0.519	30%	0.297	S	S	.	.			trans	-118.9	-3.7	177.6	-62.3	-174.4	162.6	0	0	113	Q132 D135 F139	Q132-E137 HydrophobicContact CB-CB 4.4Å; Q132-E137 HydrophobicContact CG-CB 4.4Å; Q132-E137 PolarHBondContact O-N 2.91Å; D135-E137 HydrophobicContact CB-CG 4.35Å; E137-F139 VanDerWaalsContact C-N 3.32Å; E137-F139 PolarHBondContact O-N 2.8Å
138	A	88.6	Confident	90.6	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.008	32%	0.315	C	S	.	.	S	Bend	trans	-72.5	-23.2	-177.2	0	0	0	0	0	114.2	Q132 L133 W450 K451	Q132-A138 HydrophobicContact CB-CB 4.08Å; Q132-A138 PolarHBondContact O-N 2.72Å; L133-A138 HydrophobicContact CB-CB 4.49Å; L133-A138 HydrophobicContact CD2-CB 3.53Å; L133-A138 HydrophobicContact CG-CB 3.89Å; A138-W450 HydrophobicContact CB-CE3 4.43Å; A138-W450 HydrophobicContact CB-CZ3 3.94Å; A138-K451 WeakPolarHBondContact O-CB 3.34Å; A138-K451 PolarHBondContact O-N 3.1Å
139	F	92.8	Very high	90.8	Very high	12 Å²	12	55.8 Å²	55.8	5%	0.053	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	157	-173.7	-53.5	-46.2	0	0	0	112.2	L133 E137 I389 W401 V435 V448 L449 W450	L133-F139 HydrophobicContact CD2-CE1 4.32Å; L133-F139 HydrophobicContact CD2-CE2 4.26Å; L133-F139 HydrophobicContact CD2-CZ 3.75Å; E137-F139 VanDerWaalsContact C-N 3.32Å; E137-F139 PolarHBondContact O-N 2.8Å; F139-I389 HydrophobicContact CE2-CD1 3.88Å; F139-I389 HydrophobicContact CZ-CD1 3.7Å; F139-W401 HydrophobicContact CB-CD2 4.06Å; F139-W401 HydrophobicContact CB-CE3 3.95Å; F139-W401 HydrophobicContact CB-CH2 3.84Å; F139-W401 HydrophobicContact CB-CZ2 3.95Å; F139-W401 HydrophobicContact CB-CZ3 3.79Å; F139-W401 HydrophobicContact CD2-CB 4.13Å; F139-W401 AromaticContact CD2-CD2 3.74Å; F139-W401 HydrophobicContact CD2-CD2 3.74Å; F139-W401 AromaticContact CD2-CE3 3.63Å; F139-W401 HydrophobicContact CD2-CE3 3.63Å; F139-W401 AromaticContact CD2-CG 3.94Å; F139-W401 HydrophobicContact CD2-CG 3.94Å; F139-W401 HydrophobicContact CD2-CZ3 4.26Å; F139-W401 HydrophobicContact CE2-CB 4.45Å; F139-W401 HydrophobicContact CG-CD2 4.4Å; F139-W401 HydrophobicContact CG-CE3 4.24Å; F139-W401 HydrophobicContact CG-CZ3 4.46Å; F139-W401 WeakPolarHBondContact O-CH2 3.27Å; F139-V435 HydrophobicContact CD1-CG2 3.93Å; F139-V435 HydrophobicContact CE1-CG1 4.31Å; F139-V435 HydrophobicContact CE1-CG2 3.7Å; F139-V435 HydrophobicContact CZ-CG1 4.28Å; F139-V435 HydrophobicContact CZ-CG2 4.46Å; F139-V448 HydrophobicContact CB-CG1 3.71Å; F139-V448 HydrophobicContact CD2-CG1 4.18Å; F139-V448 HydrophobicContact CG-CG1 3.91Å; F139-L449 CarbonylContact C-O 3.33Å; F139-L449 WeakPolarHBondContact CA-O 3.29Å; F139-L449 WeakPolarHBondContact CB-O 3.26Å; F139-W450 HydrophobicContact CD1-CD2 4.15Å; F139-W450 HydrophobicContact CD1-CE3 4Å; F139-W450 HydrophobicContact CD1-CZ3 4.38Å; F139-W450 AromaticContact CE1-CD2 3.71Å; F139-W450 HydrophobicContact CE1-CD2 3.71Å; F139-W450 AromaticContact CE1-CE2 3.81Å; F139-W450 AromaticContact CE1-CE3 3.63Å; F139-W450 HydrophobicContact CE1-CE3 3.63Å; F139-W450 HydrophobicContact CE1-CG 4.45Å; F139-W450 AromaticContact CE1-CH2 3.82Å; F139-W450 HydrophobicContact CE1-CH2 3.82Å; F139-W450 AromaticContact CE1-CZ2 3.88Å; F139-W450 HydrophobicContact CE1-CZ2 3.88Å; F139-W450 AromaticContact CE1-CZ3 3.69Å; F139-W450 HydrophobicContact CE1-CZ3 3.69Å; F139-W450 HydrophobicContact CZ-CH2 4.27Å; F139-W450 HydrophobicContact CZ-CZ2 4.41Å; F139-W450 HydrophobicContact CZ-CZ3 4.43Å
140	E	92.6	Very high	90.9	Very high	87 Å²	87	58 Å²	58	41%	0.407	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	164.7	167.7	64.8	-177.5	-163.5	0	0	109.9	V448 L449	E140-V448 WeakPolarHBondContact O-CA 3.32Å; E140-L449 HydrophobicContact CG-CB 3.94Å; E140-L449 PolarHBondContact N-O 3.25Å; E140-L449 PolarHBondContact O-N 2.55Å
141	T	92.9	Very high	91.2	Very high	79 Å²	79	57.2 Å²	57.2	49%	0.485	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.9	-178.6	58	0	0	0	0	111.5	W401 L447 V448	T141-W401 HydrophobicContact CG2-CZ2 4.33Å; T141-L447 VanDerWaalsContact CA-O 3.26Å; T141-L447 WeakPolarHBondContact CA-O 3.26Å; T141-V448 HydrophobicContact CG2-CG2 4.36Å
142	S	93.4	Very high	91.3	Very high	41 Å²	41	53 Å²	53	29%	0.287	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	166.8	173.6	66.5	0	0	0	0	110.1	L447 L449	S142-L447 PolarHBondContact N-O 2.95Å; S142-L447 PolarHBondContact O-N 3.36Å; S142-L447 WeakPolarHBondContact OG-CB 3.48Å; S142-L449 WeakPolarHBondContact OG-CD1 3.21Å
143	S	93.8	Very high	91.4	Very high	70 Å²	70	52.2 Å²	52.2	49%	0.49	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.8	178	58.2	0	0	0	0	111.6	I445	S143-I445 CarbonylContact C-O 3.52Å; S143-I445 VanDerWaalsContact CA-O 3.27Å; S143-I445 WeakPolarHBondContact CA-O 3.29Å
144	L	94.4	Very high	91.7	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.8	171.3	-52.7	174.6	0	0	0	108.9	L161 W173 S444 I445 L447	L144-L161 HydrophobicContact CD1-CD2 3.96Å; L144-W173 HydrophobicContact CB-CD2 4.33Å; L144-W173 HydrophobicContact CB-CE3 4.1Å; L144-W173 HydrophobicContact CB-CH2 4.48Å; L144-W173 HydrophobicContact CB-CZ3 4.18Å; L144-W173 HydrophobicContact CD1-CB 3.77Å; L144-W173 HydrophobicContact CD1-CD2 3.9Å; L144-W173 HydrophobicContact CD1-CE3 4.17Å; L144-W173 HydrophobicContact CD1-CG 3.72Å; L144-W173 HydrophobicContact CD2-CE3 4.28Å; L144-W173 HydrophobicContact CG-CE3 4.43Å; L144-S444 WeakPolarHBondContact O-CA 3.24Å; L144-I445 HydrophobicContact CB-CB 4.18Å; L144-I445 HydrophobicContact CB-CD1 4.05Å; L144-I445 HydrophobicContact CD1-CD1 4.4Å; L144-I445 PolarHBondContact N-O 2.77Å; L144-I445 PolarHBondContact O-N 3.29Å; L144-L447 HydrophobicContact CD1-CD1 3.87Å; L144-L447 HydrophobicContact CD1-CD2 4.46Å; L144-L447 HydrophobicContact CD1-CG 4.48Å; L144-L447 HydrophobicContact CD2-CD1 4.16Å; L144-L447 HydrophobicContact CG-CD1 3.77Å; L144-L447 HydrophobicContact CG-CG 4.35Å
145	I	93.5	Very high	91.9	Very high	133 Å²	133	49.6 Å²	49.6	68%	0.682	28%	0.275	S	S	*	.			trans	-120.3	130.4	-176.9	-55.3	171.2	0	0	0	108	W173	I145-W173 WeakPolarHBondContact O-CH2 3.15Å
146	G	89.9	Confident	92.2	Very high	41 Å²	41	47.1 Å²	47.1	42%	0.423	26%	0.26	S	S	.	.			trans	166.6	-8.4	172.3	0	0	0	0	0	116.3	K171	G146-K171 VanDerWaalsContact O-CE 3.26Å; G146-K171 WeakPolarHBondContact O-CE 3.17Å
147	H	93.6	Very high	92.5	Very high	16 Å²	16	47.2 Å²	47.2	7%	0.074	26%	0.259	C	S	.	.			trans	-83	146.3	167.5	-77.7	-65.3	0	0	0	111.1	V151 T163 S165 D167 S169	H147-V151 HydrophobicContact CB-CG2 3.94Å; H147-V151 VanDerWaalsContact CD2-CG2 3.41Å; H147-V151 WeakPolarHBondContact CD2-CG2 3.35Å; H147-T163 PolarHBondContact NE2-OG1 2.77Å; H147-S165 VanDerWaalsContact CE1-CB 3.42Å; H147-S165 WeakPolarHBondContact CE1-CB 3.2Å; H147-S165 WeakPolarHBondContact ND1-CB 3.1Å; H147-D167 VanDerWaalsContact CA-OD2 3.26Å; H147-D167 WeakPolarHBondContact CA-OD2 3.4Å; H147-D167 VanDerWaalsContact CB-OD2 3.29Å; H147-D167 WeakPolarHBondContact CB-OD2 3.44Å; H147-D167 IonicContact CE1-OD1 2.81Å; H147-D167 IonicContact CE1-OD2 3.87Å; H147-D167 IonicContact CG-OD2 3.46Å; H147-D167 IonicContact ND1-OD1 3.41Å; H147-D167 PolarHBondContact ND1-OD1 2.79Å; H147-D167 IonicContact ND1-OD2 2.79Å; H147-D167 PolarHBondContact ND1-OD2 2.94Å; H147-S169 PolarHBondContact CE1-OG 3.01Å; H147-S169 VanDerWaalsContact CE1-OG 3.28Å; H147-S169 PolarHBondContact ND1-OG 3.48Å
148	S	92.8	Very high	92.6	Very high	96 Å²	96	47.3 Å²	47.3	67%	0.671	26%	0.264	S	S	*	.	S	Bend	trans	-100.6	-6.2	178.5	61.7	0	0	0	0	113.2	D167	S148-D167 PolarHBondContact N-OD2 3.32Å; S148-D167 WeakPolarHBondContact OG-CB 3.43Å
149	A	92.1	Very high	92.7	Very high	23 Å²	23	48.5 Å²	48.5	19%	0.19	28%	0.276	C	S	.	.	S	Bend	trans	-142.3	-175.8	176	0	0	0	0	0	110.7	V151 S165 D166 D167 H443	A149-V151 PolarHBondContact O-N 2.79Å; A149-S165 PolarHBondContact O-OG 2.85Å; A149-D166 HydrophobicContact CB-CB 4.07Å; A149-D167 HydrophobicContact CB-CB 3.8Å; A149-H443 WeakPolarHBondContact O-CB 3.49Å
150	R	90.5	Very high	92.8	Very high	65 Å²	65	49.8 Å²	49.8	25%	0.245	28%	0.283	C	S	.	.			trans	-64.5	128.6	-172.3	-174.1	171.5	-177.9	-167.8	0.4	112.4	Y152 S165 D166 R407	R150-Y152 HydrophobicContact CB-CE2 4.3Å; R150-Y152 HydrophobicContact CG-CE1 4.28Å; R150-Y152 HydrophobicContact CG-CE2 4.36Å; R150-S165 WeakPolarHBondContact O-CA 3.25Å; R150-S165 PolarHBondContact O-OG 3.1Å; R150-D166 PolarHBondContact O-N 2.88Å; R150-R407 VanDerWaalsContact NH2-CD 3.34Å
151	V	93	Very high	93	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121	171.1	-174.4	0	0	0	0	109.6	H147 A149 L154 T163 G164 S439 I445	H147-V151 HydrophobicContact CB-CG2 3.94Å; H147-V151 VanDerWaalsContact CD2-CG2 3.41Å; H147-V151 WeakPolarHBondContact CD2-CG2 3.35Å; A149-V151 PolarHBondContact O-N 2.79Å; V151-L154 HydrophobicContact CG1-CD2 3.91Å; V151-T163 HydrophobicContact CG1-CG2 4.43Å; V151-G164 WeakPolarHBondContact CG1-O 3.38Å; V151-S439 WeakPolarHBondContact O-CB 3.28Å; V151-S439 PolarHBondContact O-OG 3.44Å; V151-I445 HydrophobicContact CG2-CG1 4.38Å
152	Y	91.2	Very high	93.2	Very high	32 Å²	32	41.9 Å²	41.9	13%	0.125	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-24.3	-177.7	-81	-65.8	0	0	0	113.8	R150 G164 D166 C189 F204 S413	R150-Y152 HydrophobicContact CB-CE2 4.3Å; R150-Y152 HydrophobicContact CG-CE1 4.28Å; R150-Y152 HydrophobicContact CG-CE2 4.36Å; Y152-G164 PolarHBondContact N-O 2.82Å; Y152-D166 HydrophobicContact CD2-CB 4.12Å; Y152-D166 HydrophobicContact CE2-CB 3.78Å; Y152-C189 VanDerWaalsContact CB-O 3.32Å; Y152-C189 WeakPolarHBondContact CB-O 3.42Å; Y152-F204 HydrophobicContact CD1-CE2 4.32Å; Y152-F204 HydrophobicContact CD1-CZ 4.09Å; Y152-F204 AromaticContact CD2-CE2 3.58Å; Y152-F204 HydrophobicContact CD2-CE2 3.58Å; Y152-F204 HydrophobicContact CD2-CZ 4.17Å; Y152-F204 HydrophobicContact CE1-CZ 4.35Å; Y152-F204 AromaticContact CE2-CE2 3.92Å; Y152-F204 HydrophobicContact CE2-CE2 3.92Å; Y152-F204 HydrophobicContact CE2-CZ 4.41Å; Y152-F204 AromaticContact CG-CE2 3.78Å; Y152-F204 HydrophobicContact CG-CE2 3.78Å; Y152-F204 AromaticContact CG-CZ 3.98Å; Y152-F204 HydrophobicContact CG-CZ 3.98Å; Y152-S413 CarbonylContact O-C 3.56Å; Y152-S413 WeakPolarHBondContact O-CB 3.31Å; Y152-S413 PolarHBondContact O-OG 3.32Å
153	A	92.1	Very high	93.3	Very high	2 Å²	2	40 Å²	40	2%	0.017	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	137.1	-172.7	0	0	0	0	0	111	T163 G164 V192 S413	A153-T163 WeakPolarHBondContact O-CA 3.47Å; A153-G164 PolarHBondContact N-O 3.48Å; A153-G164 VanDerWaalsContact N-O 3.16Å; A153-G164 PolarHBondContact O-N 3.38Å; A153-V192 HydrophobicContact CB-CB 4.35Å; A153-V192 HydrophobicContact CB-CG1 3.99Å; A153-V192 HydrophobicContact CB-CG2 3.86Å; A153-S413 WeakPolarHBondContact CA-O 3.5Å
154	L	94.7	Very high	93.3	Very high	13 Å²	13	36.6 Å²	36.6	7%	0.068	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136	176	-62.2	173.3	0	0	0	109.1	V151 C162 T163 S413 S414 L416 A437 I445	V151-L154 HydrophobicContact CG1-CD2 3.91Å; L154-C162 WeakPolarHBondContact CA-O 3Å; L154-T163 HydrophobicContact CD2-CG2 3.3Å; L154-S413 PolarHBondContact N-O 3.06Å; L154-S414 WeakPolarHBondContact CD1-O 3.29Å; L154-L416 HydrophobicContact CB-CB 4.09Å; L154-L416 HydrophobicContact CB-CD2 4.31Å; L154-A437 HydrophobicContact CD1-CB 4.36Å; L154-I445 HydrophobicContact CD2-CG1 4.49Å; L154-I445 HydrophobicContact CD2-CG2 4.28Å
155	Y	94.8	Very high	93.3	Very high	58 Å²	58	36.3 Å²	36.3	23%	0.227	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	138.9	170.4	-174.3	-93.9	0	0	0	109.8	K157 L161 C162 V192 K193 F194	Y155-K157 HydrophobicContact CE1-CB 3.86Å; Y155-L161 CarbonylContact O-C 3.52Å; Y155-C162 PolarHBondContact N-O 3.1Å; Y155-C162 PolarHBondContact O-N 3.17Å; Y155-V192 WeakPolarHBondContact CB-O 3.48Å; Y155-K193 HydrophobicContact CD1-CG 4.48Å; Y155-K193 HydrophobicContact CD2-CG 4.35Å; Y155-K193 HydrophobicContact CE1-CG 4.1Å; Y155-K193 HydrophobicContact CE2-CD 4.29Å; Y155-K193 HydrophobicContact CE2-CG 3.96Å; Y155-K193 WeakPolarHBondContact OH-CE 3.24Å; Y155-F194 AromaticContact CD1-CD1 3.46Å; Y155-F194 HydrophobicContact CD1-CD1 3.46Å; Y155-F194 VanDerWaalsContact CD1-CD1 3.46Å; Y155-F194 AromaticContact CD1-CE1 3.51Å; Y155-F194 HydrophobicContact CD1-CE1 3.51Å; Y155-F194 HydrophobicContact CD1-CG 4.45Å; Y155-F194 HydrophobicContact CD1-CZ 4.47Å; Y155-F194 HydrophobicContact CE1-CD1 4.14Å; Y155-F194 HydrophobicContact CE1-CE1 4.18Å; Y155-F194 HydrophobicContact CG-CD1 4.43Å; Y155-F194 WeakPolarHBondContact O-CE1 3.48Å
156	Y	94.3	Very high	93.2	Very high	26 Å²	26	33.2 Å²	33.2	10%	0.102	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.4	-174.9	174.4	-98.8	0	0	0	108.7	G159 L160 L161 V175 L416 E419 L434	Y156-G159 WeakPolarHBondContact OH-CA 3.28Å; Y156-G159 PolarHBondContact OH-N 2.97Å; Y156-L160 WeakPolarHBondContact CA-O 3.42Å; Y156-L160 WeakPolarHBondContact CD2-O 3.08Å; Y156-L161 HydrophobicContact CD2-CB 4.43Å; Y156-V175 HydrophobicContact CD2-CG2 4.22Å; Y156-V175 HydrophobicContact CE2-CG2 3.91Å; Y156-L416 VanDerWaalsContact CB-CD2 3.41Å; Y156-E419 HydrophobicContact CE1-CG 3.93Å; Y156-L434 HydrophobicContact CD1-CD2 4.46Å; Y156-L434 HydrophobicContact CD2-CB 4.31Å; Y156-L434 HydrophobicContact CD2-CD2 3.45Å; Y156-L434 VanDerWaalsContact CD2-CD2 3.45Å; Y156-L434 HydrophobicContact CE1-CB 4.42Å; Y156-L434 HydrophobicContact CE2-CB 3.81Å; Y156-L434 HydrophobicContact CE2-CD2 3.82Å; Y156-L434 HydrophobicContact CE2-CG 4.49Å; Y156-L434 HydrophobicContact CG-CD2 3.8Å
157	K	93.2	Very high	93.4	Very high	79 Å²	79	32.8 Å²	32.8	34%	0.343	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	130.7	176.4	-178	-179.1	176.1	-164.4	0	108.9	Y155 G159 L160 F194	Y155-K157 HydrophobicContact CE1-CB 3.86Å; K157-G159 PolarHBondContact O-N 3.02Å; K157-L160 PolarHBondContact N-O 2.86Å; K157-L160 WeakPolarHBondContact O-CB 3.48Å; K157-L160 PolarHBondContact O-N 3.43Å; K157-F194 HydrophobicContact CB-CE1 4.47Å; K157-F194 HydrophobicContact CB-CE2 4.39Å; K157-F194 HydrophobicContact CB-CZ 3.93Å
158	D	90.1	Very high	93.4	Very high	114 Å²	114	35.5 Å²	35.5	61%	0.61	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	48.2	169.5	-52.4	-31.3	0	0	0	114	L160	D158-L160 PolarHBondContact O-N 3.01Å
159	G	91.7	Very high	93.5	Very high	25 Å²	25	31.8 Å²	31.8	26%	0.258	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	-6.8	-179.5	0	0	0	0	0	115.4	Y156 K157 V175	Y156-G159 WeakPolarHBondContact OH-CA 3.28Å; Y156-G159 PolarHBondContact OH-N 2.97Å; K157-G159 PolarHBondContact O-N 3.02Å; G159-V175 WeakPolarHBondContact O-CB 3.26Å; G159-V175 WeakPolarHBondContact O-CG2 3.46Å; G159-V175 PolarHBondContact O-N 3.26Å; G159-V175 VanDerWaalsContact O-N 3.1Å
160	L	95.3	Very high	93.7	Very high	40 Å²	40	30.7 Å²	30.7	21%	0.209	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	138.6	179.9	-59.3	177.3	0	0	0	111.2	Y156 K157 D158 L172 W173 D174 I181 F194	Y156-L160 WeakPolarHBondContact CA-O 3.42Å; Y156-L160 WeakPolarHBondContact CD2-O 3.08Å; K157-L160 PolarHBondContact N-O 2.86Å; K157-L160 WeakPolarHBondContact O-CB 3.48Å; K157-L160 PolarHBondContact O-N 3.43Å; D158-L160 PolarHBondContact O-N 3.01Å; L160-L172 HydrophobicContact CB-CD1 4.15Å; L160-L172 HydrophobicContact CD1-CD2 4.3Å; L160-W173 WeakPolarHBondContact CA-O 3.46Å; L160-D174 HydrophobicContact CD2-CB 4.34Å; L160-I181 HydrophobicContact CD2-CD1 3.44Å; L160-I181 VanDerWaalsContact CD2-CD1 3.44Å; L160-F194 HydrophobicContact CB-CE2 3.86Å; L160-F194 HydrophobicContact CB-CZ 3.64Å; L160-F194 HydrophobicContact CD1-CE2 4.2Å; L160-F194 WeakPolarHBondContact O-CZ 3.42Å
161	L	96.3	Very high	94	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.4	174.8	-177.3	72.4	0	0	0	109.3	L144 Y155 Y156 T163 W173 V175 L416 L434 A437 I445 L447	L144-L161 HydrophobicContact CD1-CD2 3.96Å; Y155-L161 CarbonylContact O-C 3.52Å; Y156-L161 HydrophobicContact CD2-CB 4.43Å; L161-T163 HydrophobicContact CD2-CG2 4.15Å; L161-T163 HydrophobicContact CG-CG2 4.16Å; L161-W173 HydrophobicContact CB-CB 4.44Å; L161-W173 PolarHBondContact N-O 2.89Å; L161-W173 VanDerWaalsContact O-CD1 3.25Å; L161-W173 PolarHBondContact O-N 3.49Å; L161-V175 HydrophobicContact CB-CG2 3.76Å; L161-L416 HydrophobicContact CD1-CD2 4.21Å; L161-L434 HydrophobicContact CD1-CD2 4.43Å; L161-A437 HydrophobicContact CD1-CB 4.35Å; L161-A437 HydrophobicContact CD2-CB 4.33Å; L161-I445 HydrophobicContact CD2-CG2 3.94Å; L161-L447 HydrophobicContact CD2-CD2 3.81Å
162	C	96.1	Very high	94.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.9	169.6	-178.9	0	0	0	0	110.6	L154 Y155 K171 L172 V192 F194 L199	L154-C162 WeakPolarHBondContact CA-O 3Å; Y155-C162 PolarHBondContact N-O 3.1Å; Y155-C162 PolarHBondContact O-N 3.17Å; C162-K171 CarbonylContact C-O 3.5Å; C162-K171 VanDerWaalsContact CA-O 3.29Å; C162-K171 WeakPolarHBondContact CA-O 3.32Å; C162-L172 HydrophobicContact CB-CD1 3.95Å; C162-V192 HydrophobicContact CB-CG2 4.42Å; C162-F194 HydrophobicContact CB-CD1 3.15Å; C162-F194 HydrophobicContact CB-CE1 3.47Å; C162-F194 VanDerWaalsContact CB-CE1 3.47Å; C162-F194 HydrophobicContact CB-CG 4.03Å; C162-L199 VanDerWaalsContact SG-CD1 3.54Å
163	T	95.9	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.9	179.8	60.3	0	0	0	0	110.8	H147 V151 A153 L154 L161 A170 K171 W173 I445	H147-T163 PolarHBondContact NE2-OG1 2.77Å; V151-T163 HydrophobicContact CG1-CG2 4.43Å; A153-T163 WeakPolarHBondContact O-CA 3.47Å; L154-T163 HydrophobicContact CD2-CG2 3.3Å; L161-T163 HydrophobicContact CD2-CG2 4.15Å; L161-T163 HydrophobicContact CG-CG2 4.16Å; T163-A170 CarbonylContact O-C 3.51Å; T163-A170 WeakPolarHBondContact O-CA 3.35Å; T163-K171 PolarHBondContact N-O 2.95Å; T163-K171 PolarHBondContact O-N 3.31Å; T163-W173 PolarHBondContact OG1-NE1 3.26Å; T163-I445 HydrophobicContact CG2-CD1 3.32Å; T163-I445 HydrophobicContact CG2-CG1 3.99Å
164	G	94.9	Very high	94.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.9	174.3	0	0	0	0	0	110.7	V151 Y152 A153	V151-G164 WeakPolarHBondContact CG1-O 3.38Å; Y152-G164 PolarHBondContact N-O 2.82Å; A153-G164 PolarHBondContact N-O 3.48Å; A153-G164 VanDerWaalsContact N-O 3.16Å; A153-G164 PolarHBondContact O-N 3.38Å
165	S	93.8	Very high	94.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	163.2	-171.4	177.2	0	0	0	0	112.8	H147 A149 R150 D167 S169 C189	H147-S165 VanDerWaalsContact CE1-CB 3.42Å; H147-S165 WeakPolarHBondContact CE1-CB 3.2Å; H147-S165 WeakPolarHBondContact ND1-CB 3.1Å; A149-S165 PolarHBondContact O-OG 2.85Å; R150-S165 WeakPolarHBondContact O-CA 3.25Å; R150-S165 PolarHBondContact O-OG 3.1Å; S165-D167 WeakPolarHBondContact CB-OD1 3.4Å; S165-D167 PolarHBondContact O-N 2.86Å; S165-D167 PolarHBondContact OG-N 2.82Å; S165-D167 PolarHBondContact OG-OD1 2.94Å; S165-D167 PolarHBondContact OG-OD2 2.91Å; S165-D167 VanDerWaalsContact OG-OD2 3.12Å; S165-S169 PolarHBondContact N-O 3.13Å; S165-S169 VanDerWaalsContact N-O 3.11Å; S165-C189 PolarHBondContact O-N 2.8Å
166	D	91.9	Very high	94.3	Very high	68 Å²	68	33 Å²	33	36%	0.364	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-11.9	171.3	-145.2	18.2	0	0	0	112.6	A149 R150 Y152 L168 T188	A149-D166 HydrophobicContact CB-CB 4.07Å; R150-D166 PolarHBondContact O-N 2.88Å; Y152-D166 HydrophobicContact CD2-CB 4.12Å; Y152-D166 HydrophobicContact CE2-CB 3.78Å; D166-L168 PolarHBondContact O-N 3.15Å; D166-L168 VanDerWaalsContact O-N 3.1Å; D166-T188 VanDerWaalsContact OD1-CG2 3.32Å; D166-T188 WeakPolarHBondContact OD1-CG2 3.49Å
167	D	93.1	Very high	94.1	Very high	31 Å²	31	35.4 Å²	35.4	17%	0.166	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	12.8	175.7	63.8	19.8	0	0	0	113.7	H147 S148 A149 S165 S169	H147-D167 VanDerWaalsContact CA-OD2 3.26Å; H147-D167 WeakPolarHBondContact CA-OD2 3.4Å; H147-D167 VanDerWaalsContact CB-OD2 3.29Å; H147-D167 WeakPolarHBondContact CB-OD2 3.44Å; H147-D167 IonicContact CE1-OD1 2.81Å; H147-D167 IonicContact CE1-OD2 3.87Å; H147-D167 IonicContact CG-OD2 3.46Å; H147-D167 IonicContact ND1-OD1 3.41Å; H147-D167 PolarHBondContact ND1-OD1 2.79Å; H147-D167 IonicContact ND1-OD2 2.79Å; H147-D167 PolarHBondContact ND1-OD2 2.94Å; S148-D167 PolarHBondContact N-OD2 3.32Å; S148-D167 WeakPolarHBondContact OG-CB 3.43Å; A149-D167 HydrophobicContact CB-CB 3.8Å; S165-D167 WeakPolarHBondContact CB-OD1 3.4Å; S165-D167 PolarHBondContact O-N 2.86Å; S165-D167 PolarHBondContact OG-N 2.82Å; S165-D167 PolarHBondContact OG-OD1 2.94Å; S165-D167 PolarHBondContact OG-OD2 2.91Å; S165-D167 VanDerWaalsContact OG-OD2 3.12Å; D167-S169 VanDerWaalsContact CG-OG 3.31Å; D167-S169 PolarHBondContact O-N 3.12Å; D167-S169 WeakPolarHBondContact OD1-CA 3.38Å; D167-S169 VanDerWaalsContact OD1-CB 3.27Å; D167-S169 WeakPolarHBondContact OD1-CB 3.44Å; D167-S169 PolarHBondContact OD1-N 3.21Å; D167-S169 PolarHBondContact OD1-OG 2.84Å
168	L	93.8	Very high	94	Very high	74 Å²	74	33.3 Å²	33.3	39%	0.387	20%	0.202	S	C	.	.	S	Bend	trans	60.9	31.3	-177.1	-51	174.4	0	0	0	112.5	D166 Q185 T186 T188	D166-L168 PolarHBondContact O-N 3.15Å; D166-L168 VanDerWaalsContact O-N 3.1Å; L168-Q185 CarbonylContact O-C 3.56Å; L168-Q185 WeakPolarHBondContact O-CA 3.44Å; L168-T186 PolarHBondContact O-N 2.93Å; L168-T188 HydrophobicContact CD2-CG2 3.47Å; L168-T188 VanDerWaalsContact CD2-CG2 3.47Å
169	S	94.8	Very high	94.2	Very high	18 Å²	18	34.3 Å²	34.3	13%	0.126	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	149.6	173.5	78.6	0	0	0	0	112.8	H147 S165 D167 I184	H147-S169 PolarHBondContact CE1-OG 3.01Å; H147-S169 VanDerWaalsContact CE1-OG 3.28Å; H147-S169 PolarHBondContact ND1-OG 3.48Å; S165-S169 PolarHBondContact N-O 3.13Å; S165-S169 VanDerWaalsContact N-O 3.11Å; D167-S169 VanDerWaalsContact CG-OG 3.31Å; D167-S169 PolarHBondContact O-N 3.12Å; D167-S169 WeakPolarHBondContact OD1-CA 3.38Å; D167-S169 VanDerWaalsContact OD1-CB 3.27Å; D167-S169 WeakPolarHBondContact OD1-CB 3.44Å; D167-S169 PolarHBondContact OD1-N 3.21Å; D167-S169 PolarHBondContact OD1-OG 2.84Å; S169-I184 VanDerWaalsContact CA-O 3.29Å; S169-I184 WeakPolarHBondContact CA-O 3.39Å
170	A	96.4	Very high	94.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.7	164.6	0	0	0	0	0	108.9	T163 G183 I184 T186 L199	T163-A170 CarbonylContact O-C 3.51Å; T163-A170 WeakPolarHBondContact O-CA 3.35Å; A170-G183 WeakPolarHBondContact O-CA 3.45Å; A170-I184 PolarHBondContact N-O 2.8Å; A170-I184 PolarHBondContact O-N 3.28Å; A170-T186 HydrophobicContact CB-CG2 3.95Å; A170-L199 HydrophobicContact CB-CD2 3.39Å
171	K	96.2	Very high	94.4	Very high	42 Å²	42	37.5 Å²	37.5	18%	0.183	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145	-177.3	-67.6	175.2	-175.2	-77.6	0	110.4	G146 C162 T163 W173 Y182	G146-K171 VanDerWaalsContact O-CE 3.26Å; G146-K171 WeakPolarHBondContact O-CE 3.17Å; C162-K171 CarbonylContact C-O 3.5Å; C162-K171 VanDerWaalsContact CA-O 3.29Å; C162-K171 WeakPolarHBondContact CA-O 3.32Å; T163-K171 PolarHBondContact N-O 2.95Å; T163-K171 PolarHBondContact O-N 3.31Å; K171-W173 HydrophobicContact CB-CZ2 3.92Å; K171-W173 HydrophobicContact CD-CH2 4.09Å; K171-W173 HydrophobicContact CD-CZ2 3.47Å; K171-W173 VanDerWaalsContact CD-CZ2 3.47Å; K171-W173 HydrophobicContact CG-CZ2 4.33Å; K171-Y182 CarbonylContact C-O 3.55Å; K171-Y182 VanDerWaalsContact CA-O 3.27Å; K171-Y182 WeakPolarHBondContact CA-O 3.5Å
172	L	97.1	Very high	94.3	Very high	6 Å²	6	42 Å²	42	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.2	172	-170.2	68.5	0	0	0	108.6	L160 C162 C180 I181 Y182 F194 W213	L160-L172 HydrophobicContact CB-CD1 4.15Å; L160-L172 HydrophobicContact CD1-CD2 4.3Å; C162-L172 HydrophobicContact CB-CD1 3.95Å; L172-C180 CarbonylContact O-C 3.36Å; L172-C180 WeakPolarHBondContact O-CA 3.37Å; L172-I181 HydrophobicContact CD2-CD1 4.46Å; L172-I181 PolarHBondContact O-N 2.59Å; L172-Y182 HydrophobicContact CB-CD2 4.45Å; L172-Y182 HydrophobicContact CD2-CD2 3.83Å; L172-Y182 HydrophobicContact CD2-CE2 4.48Å; L172-Y182 PolarHBondContact N-O 3.34Å; L172-Y182 PolarHBondContact O-N 2.96Å; L172-F194 HydrophobicContact CD1-CD1 4.19Å; L172-F194 HydrophobicContact CD1-CD2 3.85Å; L172-F194 HydrophobicContact CD1-CE1 3.99Å; L172-F194 HydrophobicContact CD1-CE2 3.7Å; L172-F194 HydrophobicContact CD1-CG 4.12Å; L172-F194 HydrophobicContact CD1-CZ 3.78Å; L172-W213 HydrophobicContact CB-CH2 3.86Å; L172-W213 HydrophobicContact CB-CZ2 4.1Å; L172-W213 HydrophobicContact CB-CZ3 4.07Å; L172-W213 HydrophobicContact CD1-CZ2 4.13Å; L172-W213 HydrophobicContact CD2-CD2 4.47Å; L172-W213 HydrophobicContact CD2-CZ2 4.33Å; L172-W213 HydrophobicContact CG-CZ2 4.43Å
173	W	96.3	Very high	94.2	Very high	11 Å²	11	44.6 Å²	44.6	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.7	-174.4	-50.1	85.6	0	0	0	109.9	L144 I145 L160 L161 T163 K171 Q179 C180 I445	L144-W173 HydrophobicContact CB-CD2 4.33Å; L144-W173 HydrophobicContact CB-CE3 4.1Å; L144-W173 HydrophobicContact CB-CH2 4.48Å; L144-W173 HydrophobicContact CB-CZ3 4.18Å; L144-W173 HydrophobicContact CD1-CB 3.77Å; L144-W173 HydrophobicContact CD1-CD2 3.9Å; L144-W173 HydrophobicContact CD1-CE3 4.17Å; L144-W173 HydrophobicContact CD1-CG 3.72Å; L144-W173 HydrophobicContact CD2-CE3 4.28Å; L144-W173 HydrophobicContact CG-CE3 4.43Å; I145-W173 WeakPolarHBondContact O-CH2 3.15Å; L160-W173 WeakPolarHBondContact CA-O 3.46Å; L161-W173 HydrophobicContact CB-CB 4.44Å; L161-W173 PolarHBondContact N-O 2.89Å; L161-W173 VanDerWaalsContact O-CD1 3.25Å; L161-W173 PolarHBondContact O-N 3.49Å; T163-W173 PolarHBondContact OG1-NE1 3.26Å; K171-W173 HydrophobicContact CB-CZ2 3.92Å; K171-W173 HydrophobicContact CD-CH2 4.09Å; K171-W173 HydrophobicContact CD-CZ2 3.47Å; K171-W173 VanDerWaalsContact CD-CZ2 3.47Å; K171-W173 HydrophobicContact CG-CZ2 4.33Å; W173-Q179 WeakPolarHBondContact CA-O 3.44Å; W173-C180 HydrophobicContact CD2-CB 4.3Å; W173-C180 HydrophobicContact CE3-CB 3.71Å; W173-C180 HydrophobicContact CH2-CB 4.22Å; W173-C180 HydrophobicContact CZ3-CB 3.66Å; W173-I445 HydrophobicContact CZ2-CD1 4.23Å
174	D	95.1	Very high	94.2	Very high	39 Å²	39	44.9 Å²	44.9	21%	0.209	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.5	161.8	179.6	-17.2	0	0	0	108.4	L160 S176 T177 G178 Q179 I181	L160-D174 HydrophobicContact CD2-CB 4.34Å; D174-S176 VanDerWaalsContact C-N 3.31Å; D174-S176 PolarHBondContact O-N 2.88Å; D174-S176 WeakPolarHBondContact OD1-CB 3.47Å; D174-S176 PolarHBondContact OD1-N 2.95Å; D174-S176 PolarHBondContact OD1-OG 3.26Å; D174-T177 VanDerWaalsContact CB-OG1 3.26Å; D174-T177 WeakPolarHBondContact CB-OG1 3.48Å; D174-T177 PolarHBondContact OD1-N 2.84Å; D174-T177 WeakPolarHBondContact OD2-CG2 3.45Å; D174-T177 PolarHBondContact OD2-OG1 3.3Å; D174-T177 VanDerWaalsContact OD2-OG1 3.07Å; D174-G178 VanDerWaalsContact O-CA 3.24Å; D174-G178 WeakPolarHBondContact O-CA 3.09Å; D174-G178 PolarHBondContact O-N 2.84Å; D174-Q179 PolarHBondContact N-O 3.47Å; D174-I181 HydrophobicContact CB-CD1 4.04Å; D174-I181 HydrophobicContact CB-CG1 4.19Å
175	V	93.3	Very high	94.2	Very high	10 Å²	10	52.3 Å²	52.3	6%	0.061	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-30	-176.9	175.1	0	0	0	0	112.1	Y156 G159 L161 L434 L447 L449	Y156-V175 HydrophobicContact CD2-CG2 4.22Å; Y156-V175 HydrophobicContact CE2-CG2 3.91Å; G159-V175 WeakPolarHBondContact O-CB 3.26Å; G159-V175 WeakPolarHBondContact O-CG2 3.46Å; G159-V175 PolarHBondContact O-N 3.26Å; G159-V175 VanDerWaalsContact O-N 3.1Å; L161-V175 HydrophobicContact CB-CG2 3.76Å; V175-L434 HydrophobicContact CG1-CB 4.26Å; V175-L434 HydrophobicContact CG1-CD1 4.35Å; V175-L447 HydrophobicContact CG1-CD1 4.21Å; V175-L449 HydrophobicContact CG1-CD2 3.48Å; V175-L449 VanDerWaalsContact CG1-CD2 3.48Å
176	S	90.1	Very high	94.1	Very high	109 Å²	109	53 Å²	53	76%	0.762	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-40.1	-178	69.6	0	0	0	0	112.2	D174	D174-S176 VanDerWaalsContact C-N 3.31Å; D174-S176 PolarHBondContact O-N 2.88Å; D174-S176 WeakPolarHBondContact OD1-CB 3.47Å; D174-S176 PolarHBondContact OD1-N 2.95Å; D174-S176 PolarHBondContact OD1-OG 3.26Å
177	T	90.9	Very high	93.9	Very high	77 Å²	77	50.4 Å²	50.4	47%	0.472	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-17.1	-179	62.9	0	0	0	0	113.1	D174 Q179	D174-T177 VanDerWaalsContact CB-OG1 3.26Å; D174-T177 WeakPolarHBondContact CB-OG1 3.48Å; D174-T177 PolarHBondContact OD1-N 2.84Å; D174-T177 WeakPolarHBondContact OD2-CG2 3.45Å; D174-T177 PolarHBondContact OD2-OG1 3.3Å; D174-T177 VanDerWaalsContact OD2-OG1 3.07Å; T177-Q179 PolarHBondContact O-N 2.86Å; T177-Q179 PolarHBondContact OG1-N 2.82Å
178	G	91.5	Very high	93.8	Very high	35 Å²	35	50.4 Å²	50.4	36%	0.361	29%	0.289	S	S	.	.			trans	70.2	9	-173.1	0	0	0	0	0	114	D174	D174-G178 VanDerWaalsContact O-CA 3.24Å; D174-G178 WeakPolarHBondContact O-CA 3.09Å; D174-G178 PolarHBondContact O-N 2.84Å
179	Q	94.1	Very high	93.6	Very high	135 Å²	135	46.9 Å²	46.9	63%	0.631	27%	0.271	S	S	*	.			trans	-86.1	141.7	-176	-65.1	-171.1	-7.2	0	0	112	W173 D174 T177 I181	W173-Q179 WeakPolarHBondContact CA-O 3.44Å; D174-Q179 PolarHBondContact N-O 3.47Å; T177-Q179 PolarHBondContact O-N 2.86Å; T177-Q179 PolarHBondContact OG1-N 2.82Å; Q179-I181 PolarHBondContact O-N 2.91Å
180	C	95.4	Very high	93.5	Very high	55 Å²	55	46.1 Å²	46.1	37%	0.372	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	110	169.1	-173.1	0	0	0	0	108.8	L172 W173 Y182	L172-C180 CarbonylContact O-C 3.36Å; L172-C180 WeakPolarHBondContact O-CA 3.37Å; W173-C180 HydrophobicContact CD2-CB 4.3Å; W173-C180 HydrophobicContact CE3-CB 3.71Å; W173-C180 HydrophobicContact CH2-CB 4.22Å; W173-C180 HydrophobicContact CZ3-CB 3.66Å; C180-Y182 PolarHBondContact SG-O 3.17Å
181	I	94.9	Very high	93.4	Very high	77 Å²	77	46.5 Å²	46.5	40%	0.395	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-51	178.6	-52.2	177.6	0	0	0	110.3	L160 L172 D174 Q179	L160-I181 HydrophobicContact CD2-CD1 3.44Å; L160-I181 VanDerWaalsContact CD2-CD1 3.44Å; L172-I181 HydrophobicContact CD2-CD1 4.46Å; L172-I181 PolarHBondContact O-N 2.59Å; D174-I181 HydrophobicContact CB-CD1 4.04Å; D174-I181 HydrophobicContact CB-CG1 4.19Å; Q179-I181 PolarHBondContact O-N 2.91Å
182	Y	94.5	Very high	93.3	Very high	94 Å²	94	45 Å²	45	37%	0.369	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	147.2	-178.9	-66.4	-66.7	0	0	0	111.1	K171 L172 C180 W213	K171-Y182 CarbonylContact C-O 3.55Å; K171-Y182 VanDerWaalsContact CA-O 3.27Å; K171-Y182 WeakPolarHBondContact CA-O 3.5Å; L172-Y182 HydrophobicContact CB-CD2 4.45Å; L172-Y182 HydrophobicContact CD2-CD2 3.83Å; L172-Y182 HydrophobicContact CD2-CE2 4.48Å; L172-Y182 PolarHBondContact N-O 3.34Å; L172-Y182 PolarHBondContact O-N 2.96Å; C180-Y182 PolarHBondContact SG-O 3.17Å; Y182-W213 VanDerWaalsContact CB-CE3 3.47Å; Y182-W213 HydrophobicContact CD1-CB 4.45Å; Y182-W213 WeakPolarHBondContact CD1-O 3.28Å; Y182-W213 HydrophobicContact CD2-CB 3.77Å; Y182-W213 HydrophobicContact CD2-CD2 4.08Å; Y182-W213 HydrophobicContact CD2-CE3 4.07Å; Y182-W213 AromaticContact CD2-CG 3.98Å; Y182-W213 HydrophobicContact CD2-CG 3.98Å; Y182-W213 HydrophobicContact CE1-CB 4.45Å; Y182-W213 HydrophobicContact CE2-CB 3.78Å; Y182-W213 HydrophobicContact CE2-CG 4.3Å; Y182-W213 HydrophobicContact CG-CB 4.14Å; Y182-W213 HydrophobicContact CG-CD2 4.39Å; Y182-W213 AromaticContact CG-CE3 3.94Å; Y182-W213 HydrophobicContact CG-CE3 3.94Å
183	G	94.8	Very high	93.3	Very high	55 Å²	55	46.3 Å²	46.3	57%	0.567	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	109.3	168.9	0	0	0	0	0	109.5	A170	A170-G183 WeakPolarHBondContact O-CA 3.45Å
184	I	95.4	Very high	93.2	Very high	6 Å²	6	46 Å²	46	3%	0.031	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135.9	179.2	-56.8	178.8	0	0	0	108.8	S169 A170 T186 L199 W211 W213	S169-I184 VanDerWaalsContact CA-O 3.29Å; S169-I184 WeakPolarHBondContact CA-O 3.39Å; A170-I184 PolarHBondContact N-O 2.8Å; A170-I184 PolarHBondContact O-N 3.28Å; I184-T186 HydrophobicContact CB-CG2 4.03Å; I184-T186 HydrophobicContact CG2-CG2 3.69Å; I184-T186 PolarHBondContact O-N 3.39Å; I184-L199 HydrophobicContact CD1-CD2 4.43Å; I184-W211 HydrophobicContact CD1-CB 3.99Å; I184-W211 HydrophobicContact CG2-CD2 4.35Å; I184-W211 HydrophobicContact CG2-CE3 3.94Å; I184-W211 HydrophobicContact CG2-CZ3 4.44Å; I184-W213 HydrophobicContact CD1-CD2 4.15Å; I184-W213 HydrophobicContact CD1-CE3 3.33Å; I184-W213 HydrophobicContact CD1-CZ3 3.61Å; I184-W213 HydrophobicContact CG1-CE3 3.79Å; I184-W213 HydrophobicContact CG1-CZ3 3.86Å
185	Q	94.6	Very high	93.1	Very high	157 Å²	157	45.3 Å²	45.3	73%	0.734	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	115.7	167.5	-172.6	150.8	8.6	0	0	109.9	L168 W211	L168-Q185 CarbonylContact O-C 3.56Å; L168-Q185 WeakPolarHBondContact O-CA 3.44Å; Q185-W211 WeakPolarHBondContact O-CZ3 3.03Å
186	T	91.6	Very high	92.9	Very high	15 Å²	15	52.5 Å²	52.5	9%	0.092	30%	0.297	C	S	.	.			trans	-124.1	-154.8	-172.3	63.8	0	0	0	0	110.9	L168 A170 I184 C189 L199 W211	L168-T186 PolarHBondContact O-N 2.93Å; A170-T186 HydrophobicContact CB-CG2 3.95Å; I184-T186 HydrophobicContact CB-CG2 4.03Å; I184-T186 HydrophobicContact CG2-CG2 3.69Å; I184-T186 PolarHBondContact O-N 3.39Å; T186-C189 PolarHBondContact OG1-SG 3.43Å; T186-L199 HydrophobicContact CG2-CD2 4.41Å; T186-W211 HydrophobicContact CG2-CD2 3.97Å; T186-W211 HydrophobicContact CG2-CE3 4.34Å; T186-W211 HydrophobicContact CG2-CG 4.45Å; T186-W211 HydrophobicContact CG2-CH2 4.14Å; T186-W211 HydrophobicContact CG2-CZ2 3.78Å; T186-W211 HydrophobicContact CG2-CZ3 4.41Å
187	H	89.3	Confident	93	Very high	13 Å²	13	54.4 Å²	54.4	6%	0.06	29%	0.293	C	S	.	.	S	Bend	trans	-99	-174.9	168.6	52	-129.7	0	0	0	110.5	C189 T201 S203 D205	H187-C189 PolarHBondContact O-N 3.2Å; H187-C189 PolarHBondContact O-SG 3.04Å; H187-T201 PolarHBondContact CE1-OG1 2.94Å; H187-T201 WeakPolarHBondContact NE2-CB 3.39Å; H187-T201 PolarHBondContact NE2-OG1 2.94Å; H187-S203 WeakPolarHBondContact CD2-CB 3.45Å; H187-S203 PolarHBondContact CD2-OG 3.11Å; H187-S203 WeakPolarHBondContact NE2-CB 3.18Å; H187-D205 VanDerWaalsContact CB-OD2 3.32Å; H187-D205 WeakPolarHBondContact CB-OD2 3.38Å; H187-D205 IonicContact CG-OD2 3.41Å; H187-D205 IonicContact ND1-OD2 4Å
188	T	90	Very high	93.2	Very high	31 Å²	31	52 Å²	52	19%	0.19	28%	0.277	C	S	.	.			trans	-67.1	100.9	174.2	49.3	0	0	0	0	110.6	D166 L168 A190 S203 F204	D166-T188 VanDerWaalsContact OD1-CG2 3.32Å; D166-T188 WeakPolarHBondContact OD1-CG2 3.49Å; L168-T188 HydrophobicContact CD2-CG2 3.47Å; L168-T188 VanDerWaalsContact CD2-CG2 3.47Å; T188-A190 PolarHBondContact O-N 3.3Å; T188-S203 VanDerWaalsContact O-CA 3.25Å; T188-S203 WeakPolarHBondContact O-CA 3.37Å; T188-S203 PolarHBondContact O-OG 3.01Å; T188-S203 VanDerWaalsContact O-OG 3.1Å; T188-F204 PolarHBondContact O-N 3.44Å; T188-F204 VanDerWaalsContact O-N 3.12Å
189	C	89.8	Confident	93.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	114.1	-170.1	-69.1	0	0	0	0	111.8	Y152 S165 T186 H187 V192	Y152-C189 VanDerWaalsContact CB-O 3.32Å; Y152-C189 WeakPolarHBondContact CB-O 3.42Å; S165-C189 PolarHBondContact O-N 2.8Å; T186-C189 PolarHBondContact OG1-SG 3.43Å; H187-C189 PolarHBondContact O-N 3.2Å; H187-C189 PolarHBondContact O-SG 3.04Å; C189-V192 HydrophobicContact CB-CG1 4.21Å
190	A	92.2	Very high	93.6	Very high	2 Å²	2	44 Å²	44	2%	0.017	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	-24.9	172.1	0	0	0	0	0	112.9	T188 G202 F204 V229 F230	T188-A190 PolarHBondContact O-N 3.3Å; A190-G202 WeakPolarHBondContact CA-O 3.41Å; A190-G202 PolarHBondContact N-O 2.9Å; A190-F204 HydrophobicContact CB-CD1 4.15Å; A190-F204 HydrophobicContact CB-CD2 3.92Å; A190-F204 HydrophobicContact CB-CE1 3.87Å; A190-F204 HydrophobicContact CB-CE2 3.65Å; A190-F204 HydrophobicContact CB-CG 4.17Å; A190-F204 HydrophobicContact CB-CZ 3.61Å; A190-V229 VanDerWaalsContact CB-O 3.25Å; A190-V229 WeakPolarHBondContact CB-O 3.46Å; A190-F230 HydrophobicContact CB-CD1 4.45Å
191	A	93.9	Very high	93.7	Very high	8 Å²	8	41.3 Å²	41.3	7%	0.066	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.7	175.1	0	0	0	0	0	110.6	T201 G202 V232	A191-T201 WeakPolarHBondContact O-CA 3.49Å; A191-G202 PolarHBondContact N-O 3.22Å; A191-G202 PolarHBondContact O-N 3.47Å; A191-V232 HydrophobicContact CB-CG1 4.49Å; A191-V232 HydrophobicContact CB-CG2 4.07Å
192	V	95.6	Very high	93.7	Very high	11 Å²	11	37.7 Å²	37.7	7%	0.067	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.7	173.6	-63.6	0	0	0	0	109.8	A153 Y155 C162 C189 L199 V200 T201	A153-V192 HydrophobicContact CB-CB 4.35Å; A153-V192 HydrophobicContact CB-CG1 3.99Å; A153-V192 HydrophobicContact CB-CG2 3.86Å; Y155-V192 WeakPolarHBondContact CB-O 3.48Å; C162-V192 HydrophobicContact CB-CG2 4.42Å; C189-V192 HydrophobicContact CB-CG1 4.21Å; V192-L199 HydrophobicContact CB-CD1 4.19Å; V192-L199 HydrophobicContact CG1-CD1 4.43Å; V192-V200 CarbonylContact C-O 3.59Å; V192-V200 WeakPolarHBondContact CA-O 3.46Å; V192-T201 HydrophobicContact CG1-CG2 4.29Å
193	K	95.7	Very high	93.7	Very high	32 Å²	32	33.2 Å²	33.2	14%	0.139	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	138.3	166	-175.1	169.7	177.4	143.7	0	108.2	Y155 V200 V232 D233 Y234	Y155-K193 HydrophobicContact CD1-CG 4.48Å; Y155-K193 HydrophobicContact CD2-CG 4.35Å; Y155-K193 HydrophobicContact CE1-CG 4.1Å; Y155-K193 HydrophobicContact CE2-CD 4.29Å; Y155-K193 HydrophobicContact CE2-CG 3.96Å; Y155-K193 WeakPolarHBondContact OH-CE 3.24Å; K193-V200 PolarHBondContact N-O 3.37Å; K193-V200 PolarHBondContact O-N 3.28Å; K193-V232 HydrophobicContact CB-CG2 4.19Å; K193-D233 WeakPolarHBondContact CD-OD1 3.49Å; K193-D233 VanDerWaalsContact CE-OD1 3.31Å; K193-D233 WeakPolarHBondContact CE-OD1 3.47Å; K193-D233 IonicContact NZ-OD1 3.87Å; K193-D233 PolarHBondContact NZ-OD1 3.31Å; K193-D233 IonicContact NZ-OD2 3.46Å; K193-Y234 HydrophobicContact CB-CD1 4.48Å; K193-Y234 HydrophobicContact CB-CE1 4.2Å; K193-Y234 HydrophobicContact CD-CD1 3.9Å; K193-Y234 HydrophobicContact CD-CE1 3.9Å; K193-Y234 HydrophobicContact CG-CD1 4.14Å; K193-Y234 HydrophobicContact CG-CE1 3.7Å
194	F	95.4	Very high	93.7	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.018	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	162.5	-177.1	75.6	-86.8	0	0	0	112.2	Y155 K157 L160 C162 L172 K198 L199 W213	Y155-F194 AromaticContact CD1-CD1 3.46Å; Y155-F194 HydrophobicContact CD1-CD1 3.46Å; Y155-F194 VanDerWaalsContact CD1-CD1 3.46Å; Y155-F194 AromaticContact CD1-CE1 3.51Å; Y155-F194 HydrophobicContact CD1-CE1 3.51Å; Y155-F194 HydrophobicContact CD1-CG 4.45Å; Y155-F194 HydrophobicContact CD1-CZ 4.47Å; Y155-F194 HydrophobicContact CE1-CD1 4.14Å; Y155-F194 HydrophobicContact CE1-CE1 4.18Å; Y155-F194 HydrophobicContact CG-CD1 4.43Å; Y155-F194 WeakPolarHBondContact O-CE1 3.48Å; K157-F194 HydrophobicContact CB-CE1 4.47Å; K157-F194 HydrophobicContact CB-CE2 4.39Å; K157-F194 HydrophobicContact CB-CZ 3.93Å; L160-F194 HydrophobicContact CB-CE2 3.86Å; L160-F194 HydrophobicContact CB-CZ 3.64Å; L160-F194 HydrophobicContact CD1-CE2 4.2Å; L160-F194 WeakPolarHBondContact O-CZ 3.42Å; C162-F194 HydrophobicContact CB-CD1 3.15Å; C162-F194 HydrophobicContact CB-CE1 3.47Å; C162-F194 VanDerWaalsContact CB-CE1 3.47Å; C162-F194 HydrophobicContact CB-CG 4.03Å; L172-F194 HydrophobicContact CD1-CD1 4.19Å; L172-F194 HydrophobicContact CD1-CD2 3.85Å; L172-F194 HydrophobicContact CD1-CE1 3.99Å; L172-F194 HydrophobicContact CD1-CE2 3.7Å; L172-F194 HydrophobicContact CD1-CG 4.12Å; L172-F194 HydrophobicContact CD1-CZ 3.78Å; F194-K198 VanDerWaalsContact CA-O 3.31Å; F194-K198 WeakPolarHBondContact CA-O 3.24Å; F194-K198 WeakPolarHBondContact CB-O 2.92Å; F194-L199 HydrophobicContact CB-CD1 4.22Å; F194-W213 HydrophobicContact CB-CZ2 3.85Å; F194-W213 HydrophobicContact CG-CZ2 4.35Å
195	D	93.2	Very high	93.6	Very high	25 Å²	25	36.2 Å²	36.2	13%	0.134	18%	0.176	C	C	.	.			trans	-127.9	-170.8	157.1	63.1	27.9	0	0	0	109.2	Q197 K198 W213 Y234	D195-Q197 PolarHBondContact O-N 3.32Å; D195-Q197 VanDerWaalsContact O-N 3.14Å; D195-Q197 PolarHBondContact OD1-N 2.92Å; D195-K198 PolarHBondContact N-O 3.06Å; D195-K198 WeakPolarHBondContact OD1-CG 3.3Å; D195-K198 PolarHBondContact OD1-N 3.34Å; D195-K198 WeakPolarHBondContact OD2-CE 3.48Å; D195-K198 WeakPolarHBondContact OD2-CG 3.46Å; D195-K198 IonicContact OD2-NZ 2.84Å; D195-W213 PolarHBondContact O-NE1 2.91Å; D195-W213 VanDerWaalsContact O-NE1 3.13Å; D195-Y234 VanDerWaalsContact CB-OH 3.31Å; D195-Y234 WeakPolarHBondContact CB-OH 3.26Å; D195-Y234 VanDerWaalsContact CG-OH 3.31Å; D195-Y234 PolarHBondContact N-OH 2.77Å; D195-Y234 PolarHBondContact OD2-OH 3.25Å; D195-Y234 VanDerWaalsContact OD2-OH 3.1Å
196	E	88.9	Confident	93.6	Very high	161 Å²	161	31.2 Å²	31.2	75%	0.752	16%	0.155	S	C	*	.	S	Bend	trans	-58	-25.4	-178.5	-60.9	179.8	177.7	0	0	113.9
197	Q	91.1	Very high	93.8	Very high	149 Å²	149	31.4 Å²	31.4	70%	0.696	16%	0.155	S	C	*	.	S	Bend	trans	-111.8	-36	-171	-63.6	-173.5	-3.4	0	0	113.3	D195 W213	D195-Q197 PolarHBondContact O-N 3.32Å; D195-Q197 VanDerWaalsContact O-N 3.14Å; D195-Q197 PolarHBondContact OD1-N 2.92Å; Q197-W213 VanDerWaalsContact C-CD1 3.46Å; Q197-W213 PolarHBondContact O-N 2.89Å
198	K	94.9	Very high	94.2	Very high	28 Å²	28	30.8 Å²	30.8	12%	0.122	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	154.8	-171.8	61.5	173.6	178	-177.3	0	113.6	F194 D195 W211 W213 Y234 D236 L255	F194-K198 VanDerWaalsContact CA-O 3.31Å; F194-K198 WeakPolarHBondContact CA-O 3.24Å; F194-K198 WeakPolarHBondContact CB-O 2.92Å; D195-K198 PolarHBondContact N-O 3.06Å; D195-K198 WeakPolarHBondContact OD1-CG 3.3Å; D195-K198 PolarHBondContact OD1-N 3.34Å; D195-K198 WeakPolarHBondContact OD2-CE 3.48Å; D195-K198 WeakPolarHBondContact OD2-CG 3.46Å; D195-K198 IonicContact OD2-NZ 2.84Å; K198-W211 CarbonylContact C-O 3.48Å; K198-W211 WeakPolarHBondContact CA-O 3.26Å; K198-W211 VanDerWaalsContact CB-O 3.31Å; K198-W211 WeakPolarHBondContact CB-O 3.48Å; K198-W213 PolarHBondContact O-NE1 3.15Å; K198-Y234 VanDerWaalsContact NZ-CE2 3.25Å; K198-D236 IonicContact NZ-OD1 3.97Å; K198-D236 PolarHBondContact NZ-OD1 2.88Å; K198-D236 IonicContact NZ-OD2 3.35Å; K198-D236 PolarHBondContact NZ-OD2 2.82Å; K198-L255 VanDerWaalsContact NZ-CD2 3.34Å
199	L	97.3	Very high	94.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.9	170.5	172.5	66.5	0	0	0	109.1	C162 A170 I184 T186 V192 F194 T201 C210 W211 W213	C162-L199 VanDerWaalsContact SG-CD1 3.54Å; A170-L199 HydrophobicContact CB-CD2 3.39Å; I184-L199 HydrophobicContact CD1-CD2 4.43Å; T186-L199 HydrophobicContact CG2-CD2 4.41Å; V192-L199 HydrophobicContact CB-CD1 4.19Å; V192-L199 HydrophobicContact CG1-CD1 4.43Å; F194-L199 HydrophobicContact CB-CD1 4.22Å; L199-T201 HydrophobicContact CD1-CG2 4.09Å; L199-T201 HydrophobicContact CD2-CG2 3.56Å; L199-T201 HydrophobicContact CG-CG2 3.63Å; L199-C210 CarbonylContact O-C 3.51Å; L199-C210 VanDerWaalsContact O-CA 3.31Å; L199-C210 WeakPolarHBondContact O-CA 3.4Å; L199-W211 HydrophobicContact CB-CB 4.25Å; L199-W211 PolarHBondContact N-O 2.79Å; L199-W211 PolarHBondContact O-N 2.89Å; L199-W213 HydrophobicContact CB-CD2 4.4Å; L199-W213 HydrophobicContact CB-CH2 3.91Å; L199-W213 HydrophobicContact CB-CZ2 3.6Å; L199-W213 HydrophobicContact CB-CZ3 4.44Å; L199-W213 HydrophobicContact CD1-CH2 4Å; L199-W213 HydrophobicContact CD1-CZ2 3.87Å; L199-W213 HydrophobicContact CD2-CH2 3.71Å; L199-W213 HydrophobicContact CD2-CZ2 4.24Å; L199-W213 HydrophobicContact CD2-CZ3 4.11Å; L199-W213 HydrophobicContact CG-CH2 4.07Å; L199-W213 HydrophobicContact CG-CZ2 4.09Å
200	V	97.5	Very high	94.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.9	167.6	-179.1	0	0	0	0	108.6	V192 K193 V208 A209 V232 Y234 L241	V192-V200 CarbonylContact C-O 3.59Å; V192-V200 WeakPolarHBondContact CA-O 3.46Å; K193-V200 PolarHBondContact N-O 3.37Å; K193-V200 PolarHBondContact O-N 3.28Å; V200-V208 HydrophobicContact CG1-CG1 3.79Å; V200-A209 WeakPolarHBondContact CA-O 3.36Å; V200-V232 HydrophobicContact CG1-CB 4.21Å; V200-V232 HydrophobicContact CG1-CG2 4.03Å; V200-Y234 HydrophobicContact CB-CD1 4.2Å; V200-Y234 HydrophobicContact CB-CE1 4.31Å; V200-Y234 HydrophobicContact CG2-CD1 3.56Å; V200-Y234 HydrophobicContact CG2-CE1 3.65Å; V200-Y234 HydrophobicContact CG2-CG 4.4Å; V200-L241 HydrophobicContact CG1-CD1 3.51Å; V200-L241 HydrophobicContact CG1-CG 4.47Å; V200-L241 HydrophobicContact CG2-CD1 4.31Å
201	T	97	Very high	95.1	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.6	179	64	0	0	0	0	111.1	H187 A191 V192 L199 V208 A209 W211	H187-T201 PolarHBondContact CE1-OG1 2.94Å; H187-T201 WeakPolarHBondContact NE2-CB 3.39Å; H187-T201 PolarHBondContact NE2-OG1 2.94Å; A191-T201 WeakPolarHBondContact O-CA 3.49Å; V192-T201 HydrophobicContact CG1-CG2 4.29Å; L199-T201 HydrophobicContact CD1-CG2 4.09Å; L199-T201 HydrophobicContact CD2-CG2 3.56Å; L199-T201 HydrophobicContact CG-CG2 3.63Å; T201-V208 CarbonylContact O-C 3.53Å; T201-V208 WeakPolarHBondContact O-CA 3.35Å; T201-V208 VanDerWaalsContact O-CG1 3.3Å; T201-V208 WeakPolarHBondContact O-CG1 3.49Å; T201-A209 PolarHBondContact N-O 3.24Å; T201-A209 PolarHBondContact O-N 2.99Å; T201-W211 PolarHBondContact OG1-NE1 3.43Å
202	G	95.9	Very high	95.2	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138	165.4	0	0	0	0	0	109.9	A190 A191	A190-G202 WeakPolarHBondContact CA-O 3.41Å; A190-G202 PolarHBondContact N-O 2.9Å; A191-G202 PolarHBondContact N-O 3.22Å; A191-G202 PolarHBondContact O-N 3.47Å
203	S	94.6	Very high	95.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	159.3	-167	-165	0	0	0	0	114.6	H187 T188 D205 T207 V229	H187-S203 WeakPolarHBondContact CD2-CB 3.45Å; H187-S203 PolarHBondContact CD2-OG 3.11Å; H187-S203 WeakPolarHBondContact NE2-CB 3.18Å; T188-S203 VanDerWaalsContact O-CA 3.25Å; T188-S203 WeakPolarHBondContact O-CA 3.37Å; T188-S203 PolarHBondContact O-OG 3.01Å; T188-S203 VanDerWaalsContact O-OG 3.1Å; S203-D205 WeakPolarHBondContact CB-OD1 3.17Å; S203-D205 PolarHBondContact O-N 3.06Å; S203-D205 PolarHBondContact OG-N 2.76Å; S203-D205 PolarHBondContact OG-OD1 2.77Å; S203-D205 PolarHBondContact OG-OD2 2.96Å; S203-T207 VanDerWaalsContact CB-O 3.31Å; S203-T207 WeakPolarHBondContact CB-O 3.35Å; S203-T207 PolarHBondContact N-O 3.22Å; S203-V229 PolarHBondContact O-N 2.83Å
204	F	93.1	Very high	95	Very high	54 Å²	54	35.4 Å²	35.4	24%	0.237	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-13.2	161.6	-66.1	-72.9	0	0	0	113.4	Y152 T188 A190 N206 A228 F230	Y152-F204 HydrophobicContact CD1-CE2 4.32Å; Y152-F204 HydrophobicContact CD1-CZ 4.09Å; Y152-F204 AromaticContact CD2-CE2 3.58Å; Y152-F204 HydrophobicContact CD2-CE2 3.58Å; Y152-F204 HydrophobicContact CD2-CZ 4.17Å; Y152-F204 HydrophobicContact CE1-CZ 4.35Å; Y152-F204 AromaticContact CE2-CE2 3.92Å; Y152-F204 HydrophobicContact CE2-CE2 3.92Å; Y152-F204 HydrophobicContact CE2-CZ 4.41Å; Y152-F204 AromaticContact CG-CE2 3.78Å; Y152-F204 HydrophobicContact CG-CE2 3.78Å; Y152-F204 AromaticContact CG-CZ 3.98Å; Y152-F204 HydrophobicContact CG-CZ 3.98Å; T188-F204 PolarHBondContact O-N 3.44Å; T188-F204 VanDerWaalsContact O-N 3.12Å; A190-F204 HydrophobicContact CB-CD1 4.15Å; A190-F204 HydrophobicContact CB-CD2 3.92Å; A190-F204 HydrophobicContact CB-CE1 3.87Å; A190-F204 HydrophobicContact CB-CE2 3.65Å; A190-F204 HydrophobicContact CB-CG 4.17Å; A190-F204 HydrophobicContact CB-CZ 3.61Å; F204-N206 PolarHBondContact O-N 2.92Å; F204-N206 PolarHBondContact O-OD1 2.87Å; F204-A228 HydrophobicContact CD1-CB 3.84Å; F204-F230 HydrophobicContact CD1-CE1 4.4Å; F204-F230 AromaticContact CE1-CE1 3.95Å; F204-F230 HydrophobicContact CE1-CE1 3.95Å
205	D	93.6	Very high	94.9	Very high	70 Å²	70	38.6 Å²	38.6	37%	0.374	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	10	174.9	70.8	23.3	0	0	0	114.4	H187 S203 T207	H187-D205 VanDerWaalsContact CB-OD2 3.32Å; H187-D205 WeakPolarHBondContact CB-OD2 3.38Å; H187-D205 IonicContact CG-OD2 3.41Å; H187-D205 IonicContact ND1-OD2 4Å; S203-D205 WeakPolarHBondContact CB-OD1 3.17Å; S203-D205 PolarHBondContact O-N 3.06Å; S203-D205 PolarHBondContact OG-N 2.76Å; S203-D205 PolarHBondContact OG-OD1 2.77Å; S203-D205 PolarHBondContact OG-OD2 2.96Å; D205-T207 PolarHBondContact O-N 2.97Å; D205-T207 WeakPolarHBondContact OD1-CA 3.23Å; D205-T207 WeakPolarHBondContact OD1-CB 3.49Å; D205-T207 VanDerWaalsContact OD1-CG2 3.27Å; D205-T207 WeakPolarHBondContact OD1-CG2 3.09Å; D205-T207 PolarHBondContact OD1-N 3.37Å; D205-T207 PolarHBondContact OD1-OG1 2.83Å; D205-T207 PolarHBondContact OD2-OG1 3.24Å
206	N	95.6	Very high	94.9	Very high	53 Å²	53	38.8 Å²	38.8	28%	0.283	22%	0.217	S	C	.	.	S	Bend	trans	70.9	10.5	-178.3	-42.2	-24.9	0	0	0	114.8	F204 H225 T226 G227 A228	F204-N206 PolarHBondContact O-N 2.92Å; F204-N206 PolarHBondContact O-OD1 2.87Å; N206-H225 WeakPolarHBondContact CB-O 3.36Å; N206-H225 WeakPolarHBondContact O-CB 3.48Å; N206-T226 PolarHBondContact ND2-O 3.15Å; N206-G227 WeakPolarHBondContact CA-O 3.25Å; N206-G227 WeakPolarHBondContact CB-O 3.44Å; N206-G227 VanDerWaalsContact CG-C 3.46Å; N206-G227 VanDerWaalsContact OD1-CA 3.23Å; N206-G227 WeakPolarHBondContact OD1-CA 3.46Å; N206-G227 PolarHBondContact OD1-O 3.38Å; N206-A228 PolarHBondContact OD1-N 3.43Å
207	T	95.4	Very high	95.1	Very high	18 Å²	18	33.4 Å²	33.4	11%	0.11	20%	0.2	C	C	.	.			trans	-108.3	159.1	179.1	76	0	0	0	0	112.3	S203 D205	S203-T207 VanDerWaalsContact CB-O 3.31Å; S203-T207 WeakPolarHBondContact CB-O 3.35Å; S203-T207 PolarHBondContact N-O 3.22Å; D205-T207 PolarHBondContact O-N 2.97Å; D205-T207 WeakPolarHBondContact OD1-CA 3.23Å; D205-T207 WeakPolarHBondContact OD1-CB 3.49Å; D205-T207 VanDerWaalsContact OD1-CG2 3.27Å; D205-T207 WeakPolarHBondContact OD1-CG2 3.09Å; D205-T207 PolarHBondContact OD1-N 3.37Å; D205-T207 PolarHBondContact OD1-OG1 2.83Å; D205-T207 PolarHBondContact OD2-OG1 3.24Å
208	V	97.6	Very high	95.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	147.1	162.6	-179.4	0	0	0	0	107.6	V200 T201 F222 V229 V232 L241	V200-V208 HydrophobicContact CG1-CG1 3.79Å; T201-V208 CarbonylContact O-C 3.53Å; T201-V208 WeakPolarHBondContact O-CA 3.35Å; T201-V208 VanDerWaalsContact O-CG1 3.3Å; T201-V208 WeakPolarHBondContact O-CG1 3.49Å; V208-F222 HydrophobicContact CB-CB 3.97Å; V208-F222 HydrophobicContact CB-CD2 3.93Å; V208-F222 HydrophobicContact CB-CG 4.22Å; V208-F222 HydrophobicContact CG1-CD2 3.86Å; V208-F222 HydrophobicContact CG1-CE2 4.4Å; V208-F222 HydrophobicContact CG1-CG 4.49Å; V208-F222 PolarHBondContact N-O 2.95Å; V208-F222 WeakPolarHBondContact O-CD2 3.35Å; V208-F222 PolarHBondContact O-N 3.06Å; V208-V229 HydrophobicContact CG2-CB 4.27Å; V208-V229 HydrophobicContact CG2-CG1 3.78Å; V208-V229 HydrophobicContact CG2-CG2 4.01Å; V208-V232 HydrophobicContact CG1-CG1 4.14Å; V208-V232 HydrophobicContact CG2-CG1 4.03Å; V208-L241 HydrophobicContact CG1-CD1 4.02Å; V208-L241 HydrophobicContact CG1-CD2 4.06Å
209	A	97.1	Very high	95.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.3	174.2	0	0	0	0	0	111.2	V200 T201 W211 K218 Q220	V200-A209 WeakPolarHBondContact CA-O 3.36Å; T201-A209 PolarHBondContact N-O 3.24Å; T201-A209 PolarHBondContact O-N 2.99Å; A209-W211 HydrophobicContact CB-CZ2 3.89Å; A209-K218 HydrophobicContact CB-CD 4.17Å; A209-K218 HydrophobicContact CB-CG 4.3Å; A209-Q220 WeakPolarHBondContact CA-O 2.83Å
210	C	97.3	Very high	95.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	143.3	166.2	-67.7	0	0	0	0	109.3	L199 K218 T219 Q220 F222	L199-C210 CarbonylContact O-C 3.51Å; L199-C210 VanDerWaalsContact O-CA 3.31Å; L199-C210 WeakPolarHBondContact O-CA 3.4Å; C210-K218 CarbonylContact O-C 3.57Å; C210-K218 WeakPolarHBondContact O-CA 3.09Å; C210-T219 WeakPolarHBondContact CB-OG1 3.35Å; C210-T219 PolarHBondContact O-N 3.4Å; C210-T219 PolarHBondContact O-OG1 3.49Å; C210-Q220 HydrophobicContact CB-CB 4Å; C210-Q220 PolarHBondContact N-O 2.54Å; C210-Q220 PolarHBondContact O-N 2.97Å; C210-F222 HydrophobicContact CB-CE2 4.47Å; C210-F222 VanDerWaalsContact SG-CE2 3.52Å
211	W	96.9	Very high	95.2	Very high	14 Å²	14	38 Å²	38	5%	0.053	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.4	-178.5	-44.8	81.8	0	0	0	109.3	I184 Q185 T186 K198 L199 T201 A209 A217 K218	I184-W211 HydrophobicContact CD1-CB 3.99Å; I184-W211 HydrophobicContact CG2-CD2 4.35Å; I184-W211 HydrophobicContact CG2-CE3 3.94Å; I184-W211 HydrophobicContact CG2-CZ3 4.44Å; Q185-W211 WeakPolarHBondContact O-CZ3 3.03Å; T186-W211 HydrophobicContact CG2-CD2 3.97Å; T186-W211 HydrophobicContact CG2-CE3 4.34Å; T186-W211 HydrophobicContact CG2-CG 4.45Å; T186-W211 HydrophobicContact CG2-CH2 4.14Å; T186-W211 HydrophobicContact CG2-CZ2 3.78Å; T186-W211 HydrophobicContact CG2-CZ3 4.41Å; K198-W211 CarbonylContact C-O 3.48Å; K198-W211 WeakPolarHBondContact CA-O 3.26Å; K198-W211 VanDerWaalsContact CB-O 3.31Å; K198-W211 WeakPolarHBondContact CB-O 3.48Å; L199-W211 HydrophobicContact CB-CB 4.25Å; L199-W211 PolarHBondContact N-O 2.79Å; L199-W211 PolarHBondContact O-N 2.89Å; T201-W211 PolarHBondContact OG1-NE1 3.43Å; A209-W211 HydrophobicContact CB-CZ2 3.89Å; W211-A217 VanDerWaalsContact CA-O 3.29Å; W211-A217 WeakPolarHBondContact CA-O 3.22Å; W211-K218 HydrophobicContact CD2-CB 4.36Å; W211-K218 HydrophobicContact CD2-CG 4.49Å; W211-K218 HydrophobicContact CE3-CB 3.71Å; W211-K218 HydrophobicContact CE3-CG 4.27Å; W211-K218 HydrophobicContact CH2-CB 4.34Å; W211-K218 HydrophobicContact CH2-CD 4.31Å; W211-K218 HydrophobicContact CH2-CG 4.47Å; W211-K218 HydrophobicContact CZ3-CB 3.71Å; W211-K218 VanDerWaalsContact CZ3-CE 3.48Å; W211-K218 HydrophobicContact CZ3-CG 4.27Å
212	E	95.9	Very high	95.1	Very high	94 Å²	94	38.1 Å²	38.1	44%	0.439	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.4	171.6	179.5	-178.8	-139.7	0	0	110	S215 G216 A217 T219	E212-S215 VanDerWaalsContact OE2-CB 3.31Å; E212-S215 WeakPolarHBondContact OE2-CB 3.49Å; E212-S215 PolarHBondContact OE2-OG 2.82Å; E212-G216 VanDerWaalsContact O-CA 3.24Å; E212-G216 WeakPolarHBondContact O-CA 3.4Å; E212-G216 PolarHBondContact O-N 3.32Å; E212-A217 PolarHBondContact N-O 2.59Å; E212-T219 HydrophobicContact CB-CG2 4Å
213	W	93.8	Very high	95.1	Very high	7 Å²	7	47.2 Å²	47.2	3%	0.027	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-45.1	-178.2	-73.2	124.8	0	0	0	113.3	L172 Y182 I184 F194 D195 Q197 K198 L199 S215	L172-W213 HydrophobicContact CB-CH2 3.86Å; L172-W213 HydrophobicContact CB-CZ2 4.1Å; L172-W213 HydrophobicContact CB-CZ3 4.07Å; L172-W213 HydrophobicContact CD1-CZ2 4.13Å; L172-W213 HydrophobicContact CD2-CD2 4.47Å; L172-W213 HydrophobicContact CD2-CZ2 4.33Å; L172-W213 HydrophobicContact CG-CZ2 4.43Å; Y182-W213 VanDerWaalsContact CB-CE3 3.47Å; Y182-W213 HydrophobicContact CD1-CB 4.45Å; Y182-W213 WeakPolarHBondContact CD1-O 3.28Å; Y182-W213 HydrophobicContact CD2-CB 3.77Å; Y182-W213 HydrophobicContact CD2-CD2 4.08Å; Y182-W213 HydrophobicContact CD2-CE3 4.07Å; Y182-W213 AromaticContact CD2-CG 3.98Å; Y182-W213 HydrophobicContact CD2-CG 3.98Å; Y182-W213 HydrophobicContact CE1-CB 4.45Å; Y182-W213 HydrophobicContact CE2-CB 3.78Å; Y182-W213 HydrophobicContact CE2-CG 4.3Å; Y182-W213 HydrophobicContact CG-CB 4.14Å; Y182-W213 HydrophobicContact CG-CD2 4.39Å; Y182-W213 AromaticContact CG-CE3 3.94Å; Y182-W213 HydrophobicContact CG-CE3 3.94Å; I184-W213 HydrophobicContact CD1-CD2 4.15Å; I184-W213 HydrophobicContact CD1-CE3 3.33Å; I184-W213 HydrophobicContact CD1-CZ3 3.61Å; I184-W213 HydrophobicContact CG1-CE3 3.79Å; I184-W213 HydrophobicContact CG1-CZ3 3.86Å; F194-W213 HydrophobicContact CB-CZ2 3.85Å; F194-W213 HydrophobicContact CG-CZ2 4.35Å; D195-W213 PolarHBondContact O-NE1 2.91Å; D195-W213 VanDerWaalsContact O-NE1 3.13Å; Q197-W213 VanDerWaalsContact C-CD1 3.46Å; Q197-W213 PolarHBondContact O-N 2.89Å; K198-W213 PolarHBondContact O-NE1 3.15Å; L199-W213 HydrophobicContact CB-CD2 4.4Å; L199-W213 HydrophobicContact CB-CH2 3.91Å; L199-W213 HydrophobicContact CB-CZ2 3.6Å; L199-W213 HydrophobicContact CB-CZ3 4.44Å; L199-W213 HydrophobicContact CD1-CH2 4Å; L199-W213 HydrophobicContact CD1-CZ2 3.87Å; L199-W213 HydrophobicContact CD2-CH2 3.71Å; L199-W213 HydrophobicContact CD2-CZ2 4.24Å; L199-W213 HydrophobicContact CD2-CZ3 4.11Å; L199-W213 HydrophobicContact CG-CH2 4.07Å; L199-W213 HydrophobicContact CG-CZ2 4.09Å; W213-S215 PolarHBondContact O-N 2.75Å
214	G	92.5	Very high	95.1	Very high	65 Å²	65	49.1 Å²	49.1	67%	0.67	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-36.9	-174.1	0	0	0	0	0	114
215	S	93.3	Very high	95.3	Very high	71 Å²	71	47.1 Å²	47.1	50%	0.497	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-21.1	-178.8	66.7	0	0	0	0	113.6	E212 W213 A217	E212-S215 VanDerWaalsContact OE2-CB 3.31Å; E212-S215 WeakPolarHBondContact OE2-CB 3.49Å; E212-S215 PolarHBondContact OE2-OG 2.82Å; W213-S215 PolarHBondContact O-N 2.75Å; S215-A217 PolarHBondContact O-N 3.02Å; S215-A217 VanDerWaalsContact OG-CB 3.25Å; S215-A217 WeakPolarHBondContact OG-CB 3.43Å; S215-A217 PolarHBondContact OG-N 3.39Å; S215-A217 VanDerWaalsContact OG-N 3.09Å
216	G	92.9	Very high	95.5	Very high	28 Å²	28	49.3 Å²	49.3	29%	0.289	29%	0.287	S	S	.	.			trans	68.2	6.6	-167.4	0	0	0	0	0	113.6	E212	E212-G216 VanDerWaalsContact O-CA 3.24Å; E212-G216 WeakPolarHBondContact O-CA 3.4Å; E212-G216 PolarHBondContact O-N 3.32Å
217	A	94.4	Very high	95.5	Very high	48 Å²	48	47.3 Å²	47.3	40%	0.397	28%	0.28	S	S	.	.			trans	-74.8	142.3	-176.9	0	0	0	0	0	111.3	W211 E212 S215 T219	W211-A217 VanDerWaalsContact CA-O 3.29Å; W211-A217 WeakPolarHBondContact CA-O 3.22Å; E212-A217 PolarHBondContact N-O 2.59Å; S215-A217 PolarHBondContact O-N 3.02Å; S215-A217 VanDerWaalsContact OG-CB 3.25Å; S215-A217 WeakPolarHBondContact OG-CB 3.43Å; S215-A217 PolarHBondContact OG-N 3.39Å; S215-A217 VanDerWaalsContact OG-N 3.09Å; A217-T219 PolarHBondContact O-N 2.83Å
218	K	95.7	Very high	95.5	Very high	94 Å²	94	47.1 Å²	47.1	41%	0.409	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	110.1	169.3	-174.1	177.9	-66.3	179.8	0	109.1	A209 C210 W211 H221	A209-K218 HydrophobicContact CB-CD 4.17Å; A209-K218 HydrophobicContact CB-CG 4.3Å; C210-K218 CarbonylContact O-C 3.57Å; C210-K218 WeakPolarHBondContact O-CA 3.09Å; W211-K218 HydrophobicContact CD2-CB 4.36Å; W211-K218 HydrophobicContact CD2-CG 4.49Å; W211-K218 HydrophobicContact CE3-CB 3.71Å; W211-K218 HydrophobicContact CE3-CG 4.27Å; W211-K218 HydrophobicContact CH2-CB 4.34Å; W211-K218 HydrophobicContact CH2-CD 4.31Å; W211-K218 HydrophobicContact CH2-CG 4.47Å; W211-K218 HydrophobicContact CZ3-CB 3.71Å; W211-K218 VanDerWaalsContact CZ3-CE 3.48Å; W211-K218 HydrophobicContact CZ3-CG 4.27Å; K218-H221 HydrophobicContact CD-CB 4.4Å
219	T	94.9	Very high	95.5	Very high	65 Å²	65	47 Å²	47	40%	0.399	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-39.9	-176.4	52.9	0	0	0	0	112.3	C210 E212 A217	C210-T219 WeakPolarHBondContact CB-OG1 3.35Å; C210-T219 PolarHBondContact O-N 3.4Å; C210-T219 PolarHBondContact O-OG1 3.49Å; E212-T219 HydrophobicContact CB-CG2 4Å; A217-T219 PolarHBondContact O-N 2.83Å
220	Q	96	Very high	95.3	Very high	54 Å²	54	47.9 Å²	47.9	25%	0.252	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	153.6	177.5	-67.4	80.7	19.8	0	0	111.6	A209 C210 F222	A209-Q220 WeakPolarHBondContact CA-O 2.83Å; C210-Q220 HydrophobicContact CB-CB 4Å; C210-Q220 PolarHBondContact N-O 2.54Å; C210-Q220 PolarHBondContact O-N 2.97Å; Q220-F222 HydrophobicContact CB-CE2 3.75Å; Q220-F222 HydrophobicContact CB-CZ 3.87Å
221	H	94.8	Very high	95.2	Very high	62 Å²	62	48.2 Å²	48.2	29%	0.287	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	120.9	178.5	-172.5	-47	0	0	0	109.8	K218 R223	K218-H221 HydrophobicContact CD-CB 4.4Å; H221-R223 WeakPolarHBondContact CE1-CG 3.25Å; H221-R223 PolarHBondContact CE1-NE 3.38Å; H221-R223 VanDerWaalsContact ND1-CG 3.34Å; H221-R223 WeakPolarHBondContact ND1-CG 3.4Å
222	F	96.7	Very high	95.2	Very high	1 Å²	1	48.1 Å²	48.1	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.2	-176.4	-51.1	-99.5	0	0	0	109.3	V208 C210 Q220 L241 W253 L255 G258	V208-F222 HydrophobicContact CB-CB 3.97Å; V208-F222 HydrophobicContact CB-CD2 3.93Å; V208-F222 HydrophobicContact CB-CG 4.22Å; V208-F222 HydrophobicContact CG1-CD2 3.86Å; V208-F222 HydrophobicContact CG1-CE2 4.4Å; V208-F222 HydrophobicContact CG1-CG 4.49Å; V208-F222 PolarHBondContact N-O 2.95Å; V208-F222 WeakPolarHBondContact O-CD2 3.35Å; V208-F222 PolarHBondContact O-N 3.06Å; C210-F222 HydrophobicContact CB-CE2 4.47Å; C210-F222 VanDerWaalsContact SG-CE2 3.52Å; Q220-F222 HydrophobicContact CB-CE2 3.75Å; Q220-F222 HydrophobicContact CB-CZ 3.87Å; F222-L241 HydrophobicContact CE1-CD1 4.31Å; F222-L241 HydrophobicContact CE2-CD1 3.96Å; F222-L241 HydrophobicContact CZ-CD1 3.85Å; F222-W253 HydrophobicContact CB-CD2 4.01Å; F222-W253 HydrophobicContact CB-CE3 3.85Å; F222-W253 HydrophobicContact CB-CH2 4.28Å; F222-W253 HydrophobicContact CB-CZ2 4.4Å; F222-W253 HydrophobicContact CB-CZ3 3.99Å; F222-W253 HydrophobicContact CD1-CB 3.58Å; F222-W253 AromaticContact CD1-CD2 3.82Å; F222-W253 HydrophobicContact CD1-CD2 3.82Å; F222-W253 AromaticContact CD1-CE3 3.88Å; F222-W253 HydrophobicContact CD1-CE3 3.88Å; F222-W253 AromaticContact CD1-CG 3.71Å; F222-W253 HydrophobicContact CD1-CG 3.71Å; F222-W253 HydrophobicContact CE1-CB 3.75Å; F222-W253 HydrophobicContact CE1-CG 4.3Å; F222-W253 HydrophobicContact CG-CD2 4.32Å; F222-W253 HydrophobicContact CG-CE3 4.36Å; F222-W253 HydrophobicContact CG-CG 4.49Å; F222-L255 HydrophobicContact CZ-CD1 4.47Å; F222-G258 VanDerWaalsContact CE1-CA 3.47Å
223	R	95.4	Very high	95.2	Very high	191 Å²	191	44.2 Å²	44.2	72%	0.721	27%	0.268	S	S	*	.			trans	-116.9	136	178.9	-66.2	-174.6	179.5	-175.3	-3	110	H221 W253	H221-R223 WeakPolarHBondContact CE1-CG 3.25Å; H221-R223 PolarHBondContact CE1-NE 3.38Å; H221-R223 VanDerWaalsContact ND1-CG 3.34Å; H221-R223 WeakPolarHBondContact ND1-CG 3.4Å; R223-W253 WeakPolarHBondContact O-CZ3 3.37Å
224	G	94.4	Very high	95.2	Very high	41 Å²	41	44.9 Å²	44.9	42%	0.423	27%	0.271	S	S	.	.			trans	155.2	-19.6	173.1	0	0	0	0	0	114.8	K251	G224-K251 VanDerWaalsContact C-CE 3.49Å; G224-K251 WeakPolarHBondContact O-CE 3.26Å
225	H	97.5	Very high	95.2	Very high	12 Å²	12	43.3 Å²	43.3	6%	0.056	25%	0.247	C	C	.	.			trans	-68.5	146.7	167.5	-82.3	-59.2	0	0	0	110.4	N206 V229 S243 S245 D247 W253	N206-H225 WeakPolarHBondContact CB-O 3.36Å; N206-H225 WeakPolarHBondContact O-CB 3.48Å; H225-V229 HydrophobicContact CB-CG2 4.23Å; H225-S243 PolarHBondContact CD2-OG 3.01Å; H225-S243 PolarHBondContact NE2-O 3.45Å; H225-S243 PolarHBondContact NE2-OG 2.85Å; H225-S245 WeakPolarHBondContact CE1-CB 3.5Å; H225-S245 WeakPolarHBondContact ND1-CB 3.37Å; H225-D247 VanDerWaalsContact CA-OD2 3.26Å; H225-D247 WeakPolarHBondContact CA-OD2 3.47Å; H225-D247 WeakPolarHBondContact CB-OD2 3.4Å; H225-D247 IonicContact CE1-OD1 3.63Å; H225-D247 IonicContact CE1-OD2 3.92Å; H225-D247 IonicContact CG-OD2 2.57Å; H225-D247 IonicContact ND1-OD1 3.79Å; H225-D247 PolarHBondContact ND1-OD1 3.42Å; H225-D247 IonicContact ND1-OD2 3.85Å; H225-D247 PolarHBondContact ND1-OD2 2.73Å; H225-W253 AromaticContact CD2-CZ2 3.83Å
226	T	97.1	Very high	95.1	Very high	115 Å²	115	44.1 Å²	44.1	71%	0.706	25%	0.246	S	C	*	.	S	Bend	trans	-107.6	1.9	177.8	56.4	0	0	0	0	112.7	N206 D247	N206-T226 PolarHBondContact ND2-O 3.15Å; T226-D247 PolarHBondContact N-OD2 2.84Å; T226-D247 VanDerWaalsContact OG1-CB 3.24Å; T226-D247 WeakPolarHBondContact OG1-CB 3.37Å
227	G	96.4	Very high	94.9	Very high	12 Å²	12	49.7 Å²	49.7	12%	0.124	27%	0.265	C	S	.	.	S	Bend	trans	-141.9	169.1	174.4	0	0	0	0	0	112.3	N206 S245	N206-G227 WeakPolarHBondContact CA-O 3.25Å; N206-G227 WeakPolarHBondContact CB-O 3.44Å; N206-G227 VanDerWaalsContact CG-C 3.46Å; N206-G227 VanDerWaalsContact OD1-CA 3.23Å; N206-G227 WeakPolarHBondContact OD1-CA 3.46Å; N206-G227 PolarHBondContact OD1-O 3.38Å; G227-S245 VanDerWaalsContact C-OG 3.22Å; G227-S245 PolarHBondContact O-OG 2.87Å
228	A	95.3	Very high	94.6	Very high	13 Å²	13	50.1 Å²	50.1	11%	0.107	26%	0.26	C	S	.	.			trans	-54.8	138.7	-176.8	0	0	0	0	0	112.1	F204 N206 F230 S245 A246	F204-A228 HydrophobicContact CD1-CB 3.84Å; N206-A228 PolarHBondContact OD1-N 3.43Å; A228-F230 HydrophobicContact CB-CD1 4.32Å; A228-F230 HydrophobicContact CB-CE1 3.62Å; A228-F230 HydrophobicContact CB-CZ 3.95Å; A228-S245 CarbonylContact O-C 3.59Å; A228-S245 VanDerWaalsContact O-CA 3.28Å; A228-S245 WeakPolarHBondContact O-CA 3.45Å; A228-S245 PolarHBondContact O-OG 2.81Å; A228-A246 HydrophobicContact CB-CB 4.33Å; A228-A246 PolarHBondContact O-N 2.9Å
229	V	96.6	Very high	94.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	110.2	-178.9	-176.4	0	0	0	0	109.6	A190 S203 V208 H225 V232	A190-V229 VanDerWaalsContact CB-O 3.25Å; A190-V229 WeakPolarHBondContact CB-O 3.46Å; S203-V229 PolarHBondContact O-N 2.83Å; V208-V229 HydrophobicContact CG2-CB 4.27Å; V208-V229 HydrophobicContact CG2-CG1 3.78Å; V208-V229 HydrophobicContact CG2-CG2 4.01Å; H225-V229 HydrophobicContact CB-CG2 4.23Å; V229-V232 HydrophobicContact CG1-CG1 3.83Å
230	F	94.3	Very high	94.4	Very high	17 Å²	17	46.1 Å²	46.1	8%	0.075	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-17.8	-172.6	-63	-40.8	0	0	0	114.6	A190 F204 A228 G244 A246 W270	A190-F230 HydrophobicContact CB-CD1 4.45Å; F204-F230 HydrophobicContact CD1-CE1 4.4Å; F204-F230 AromaticContact CE1-CE1 3.95Å; F204-F230 HydrophobicContact CE1-CE1 3.95Å; A228-F230 HydrophobicContact CB-CD1 4.32Å; A228-F230 HydrophobicContact CB-CE1 3.62Å; A228-F230 HydrophobicContact CB-CZ 3.95Å; F230-G244 PolarHBondContact N-O 3.3Å; F230-A246 HydrophobicContact CD2-CB 4.4Å; F230-A246 HydrophobicContact CE2-CB 3.53Å; F230-A246 HydrophobicContact CZ-CB 3.77Å; F230-W270 HydrophobicContact CD2-CB 4.23Å; F230-W270 HydrophobicContact CE2-CB 3.92Å; F230-W270 AromaticContact CE2-CD2 3.81Å; F230-W270 HydrophobicContact CE2-CD2 3.81Å; F230-W270 AromaticContact CE2-CE3 3.86Å; F230-W270 HydrophobicContact CE2-CE3 3.86Å; F230-W270 AromaticContact CE2-CG 3.85Å; F230-W270 HydrophobicContact CE2-CG 3.85Å; F230-W270 HydrophobicContact CZ-CD2 4.39Å; F230-W270 HydrophobicContact CZ-CE3 4.25Å
231	S	94.6	Very high	94.4	Very high	8 Å²	8	43.5 Å²	43.5	6%	0.056	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	141	178.8	-169.7	0	0	0	0	110.1	S243 G244 V274	S231-S243 CarbonylContact O-C 3.56Å; S231-S243 WeakPolarHBondContact O-CA 3.43Å; S231-G244 PolarHBondContact N-O 3.37Å; S231-G244 PolarHBondContact O-N 3.04Å; S231-V274 WeakPolarHBondContact OG-CG2 3.07Å; S231-V274 PolarHBondContact OG-N 2.8Å
232	V	96.4	Very high	94.4	Very high	12 Å²	12	40.6 Å²	40.6	7%	0.073	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	145	174.5	-64.2	0	0	0	0	109.2	A191 K193 V200 V208 V229 V242	A191-V232 HydrophobicContact CB-CG1 4.49Å; A191-V232 HydrophobicContact CB-CG2 4.07Å; K193-V232 HydrophobicContact CB-CG2 4.19Å; V200-V232 HydrophobicContact CG1-CB 4.21Å; V200-V232 HydrophobicContact CG1-CG2 4.03Å; V208-V232 HydrophobicContact CG1-CG1 4.14Å; V208-V232 HydrophobicContact CG2-CG1 4.03Å; V229-V232 HydrophobicContact CG1-CG1 3.83Å; V232-V242 WeakPolarHBondContact CA-O 3.16Å
233	D	95.6	Very high	94.4	Very high	12 Å²	12	40.5 Å²	40.5	6%	0.064	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	156.4	169.5	-157.2	-16	0	0	0	108.7	K193 L241 V242 V274 V275 L276	K193-D233 WeakPolarHBondContact CD-OD1 3.49Å; K193-D233 VanDerWaalsContact CE-OD1 3.31Å; K193-D233 WeakPolarHBondContact CE-OD1 3.47Å; K193-D233 IonicContact NZ-OD1 3.87Å; K193-D233 PolarHBondContact NZ-OD1 3.31Å; K193-D233 IonicContact NZ-OD2 3.46Å; D233-L241 CarbonylContact O-C 3.6Å; D233-L241 WeakPolarHBondContact O-CA 3.45Å; D233-V242 HydrophobicContact CB-CG2 3.58Å; D233-V242 PolarHBondContact N-O 2.91Å; D233-V242 WeakPolarHBondContact O-CG2 3.13Å; D233-V242 PolarHBondContact O-N 2.86Å; D233-V274 HydrophobicContact CB-CG2 4.26Å; D233-V275 WeakPolarHBondContact OD2-CA 3.36Å; D233-L276 HydrophobicContact CB-CB 4.2Å; D233-L276 PolarHBondContact OD2-N 3.03Å
234	Y	94.5	Very high	94.5	Very high	21 Å²	21	31.4 Å²	31.4	8%	0.082	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	161.6	178.2	70.4	-96.3	0	0	0	111.9	K193 D195 K198 V200 D236 I240 L255	K193-Y234 HydrophobicContact CB-CD1 4.48Å; K193-Y234 HydrophobicContact CB-CE1 4.2Å; K193-Y234 HydrophobicContact CD-CD1 3.9Å; K193-Y234 HydrophobicContact CD-CE1 3.9Å; K193-Y234 HydrophobicContact CG-CD1 4.14Å; K193-Y234 HydrophobicContact CG-CE1 3.7Å; D195-Y234 VanDerWaalsContact CB-OH 3.31Å; D195-Y234 WeakPolarHBondContact CB-OH 3.26Å; D195-Y234 VanDerWaalsContact CG-OH 3.31Å; D195-Y234 PolarHBondContact N-OH 2.77Å; D195-Y234 PolarHBondContact OD2-OH 3.25Å; D195-Y234 VanDerWaalsContact OD2-OH 3.1Å; K198-Y234 VanDerWaalsContact NZ-CE2 3.25Å; V200-Y234 HydrophobicContact CB-CD1 4.2Å; V200-Y234 HydrophobicContact CB-CE1 4.31Å; V200-Y234 HydrophobicContact CG2-CD1 3.56Å; V200-Y234 HydrophobicContact CG2-CE1 3.65Å; V200-Y234 HydrophobicContact CG2-CG 4.4Å; Y234-D236 VanDerWaalsContact CE2-OD2 3.23Å; Y234-D236 WeakPolarHBondContact CE2-OD2 3.39Å; Y234-I240 CarbonylContact C-O 3.52Å; Y234-I240 WeakPolarHBondContact CA-O 3.3Å; Y234-I240 WeakPolarHBondContact CB-O 3.32Å; Y234-L255 HydrophobicContact CD2-CD2 4.29Å
235	N	92.2	Very high	94.6	Very high	32 Å²	32	29.5 Å²	29.5	17%	0.171	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	120.8	173.1	-177	-82.3	0	0	0	110	E237 L238 D239 I240 L276 Y291	N235-E237 WeakPolarHBondContact OD1-CA 3.26Å; N235-E237 WeakPolarHBondContact OD1-CB 3.42Å; N235-E237 PolarHBondContact OD1-N 3.19Å; N235-L238 HydrophobicContact CB-CB 4.37Å; N235-L238 HydrophobicContact CB-CD1 4.45Å; N235-L238 WeakPolarHBondContact OD1-CG 3.29Å; N235-L238 PolarHBondContact OD1-N 3.45Å; N235-D239 PolarHBondContact O-N 3.35Å; N235-I240 PolarHBondContact N-O 3.47Å; N235-I240 PolarHBondContact O-N 3.3Å; N235-I240 VanDerWaalsContact O-N 3.08Å; N235-L276 HydrophobicContact CB-CD2 3.72Å; N235-Y291 HydrophobicContact CB-CE1 4.46Å; N235-Y291 WeakPolarHBondContact ND2-CE1 3.49Å; N235-Y291 PolarHBondContact ND2-OH 3.04Å; N235-Y291 PolarHBondContact OD1-OH 3.31Å
236	D	90.9	Very high	94.6	Very high	89 Å²	89	29.9 Å²	29.9	48%	0.476	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-37.7	-179.9	-75.8	-71.2	0	0	0	113.5	K198 Y234 L238 D239 L255	K198-D236 IonicContact NZ-OD1 3.97Å; K198-D236 PolarHBondContact NZ-OD1 2.88Å; K198-D236 IonicContact NZ-OD2 3.35Å; K198-D236 PolarHBondContact NZ-OD2 2.82Å; Y234-D236 VanDerWaalsContact CE2-OD2 3.23Å; Y234-D236 WeakPolarHBondContact CE2-OD2 3.39Å; D236-L238 PolarHBondContact O-N 3.14Å; D236-D239 PolarHBondContact O-N 3.35Å; D236-D239 VanDerWaalsContact O-N 3.11Å; D236-L255 WeakPolarHBondContact OD1-CD2 3.45Å
237	E	88.8	Confident	94.6	Very high	145 Å²	145	25.7 Å²	25.7	68%	0.678	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-33.8	-179.6	-59.7	179.8	173.6	0	0	112.1	N235 K278 Y291	N235-E237 WeakPolarHBondContact OD1-CA 3.26Å; N235-E237 WeakPolarHBondContact OD1-CB 3.42Å; N235-E237 PolarHBondContact OD1-N 3.19Å; E237-K278 IonicContact OE1-NZ 2.76Å; E237-K278 IonicContact OE2-NZ 3.01Å; E237-K278 PolarHBondContact OE2-NZ 2.74Å; E237-Y291 PolarHBondContact OE2-OH 3.15Å
238	L	88.3	Confident	94.6	Very high	56 Å²	56	29.1 Å²	29.1	29%	0.293	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-10.6	178.7	-67.9	-178.3	0	0	0	113.7	N235 D236 I240 Y291 I306	N235-L238 HydrophobicContact CB-CB 4.37Å; N235-L238 HydrophobicContact CB-CD1 4.45Å; N235-L238 WeakPolarHBondContact OD1-CG 3.29Å; N235-L238 PolarHBondContact OD1-N 3.45Å; D236-L238 PolarHBondContact O-N 3.14Å; L238-I240 HydrophobicContact CB-CB 4.08Å; L238-I240 HydrophobicContact CB-CD1 4.04Å; L238-I240 HydrophobicContact CB-CG1 4.03Å; L238-I240 HydrophobicContact CD1-CD1 4.33Å; L238-I240 WeakPolarHBondContact O-CG1 3.43Å; L238-I240 PolarHBondContact O-N 3.42Å; L238-Y291 HydrophobicContact CD1-CD1 3.66Å; L238-Y291 HydrophobicContact CD1-CD2 3.36Å; L238-Y291 HydrophobicContact CD1-CE1 3.9Å; L238-Y291 HydrophobicContact CD1-CE2 3.58Å; L238-Y291 HydrophobicContact CD1-CG 3.33Å; L238-Y291 HydrophobicContact CD2-CD2 3.85Å; L238-Y291 HydrophobicContact CD2-CE2 3.68Å; L238-Y291 HydrophobicContact CG-CD2 3.85Å; L238-Y291 HydrophobicContact CG-CE1 4.39Å; L238-Y291 HydrophobicContact CG-CE2 3.58Å; L238-Y291 HydrophobicContact CG-CG 4.28Å; L238-I306 HydrophobicContact CD1-CG2 4.31Å
239	D	92.4	Very high	94.7	Very high	59 Å²	59	29.5 Å²	29.5	32%	0.316	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	39.1	-166.7	-168	35	0	0	0	112.7	N235 D236 A254 L255 S256	N235-D239 PolarHBondContact O-N 3.35Å; D236-D239 PolarHBondContact O-N 3.35Å; D236-D239 VanDerWaalsContact O-N 3.11Å; D239-A254 WeakPolarHBondContact O-CA 3.49Å; D239-L255 PolarHBondContact O-N 2.8Å; D239-L255 WeakPolarHBondContact OD1-CB 3.11Å; D239-L255 PolarHBondContact OD1-N 3.26Å; D239-S256 VanDerWaalsContact OD1-CB 3.22Å; D239-S256 WeakPolarHBondContact OD1-CB 3.33Å; D239-S256 PolarHBondContact OD1-N 3.43Å; D239-S256 PolarHBondContact OD1-OG 2.57Å; D239-S256 WeakPolarHBondContact OD2-CB 3.44Å; D239-S256 PolarHBondContact OD2-OG 2.91Å
240	I	93.3	Very high	94.7	Very high	16 Å²	16	29.5 Å²	29.5	8%	0.082	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.4	-175	-72.3	176.5	0	0	0	111.4	Y234 N235 L238 V242 V252 W253 L276 I306	Y234-I240 CarbonylContact C-O 3.52Å; Y234-I240 WeakPolarHBondContact CA-O 3.3Å; Y234-I240 WeakPolarHBondContact CB-O 3.32Å; N235-I240 PolarHBondContact N-O 3.47Å; N235-I240 PolarHBondContact O-N 3.3Å; N235-I240 VanDerWaalsContact O-N 3.08Å; L238-I240 HydrophobicContact CB-CB 4.08Å; L238-I240 HydrophobicContact CB-CD1 4.04Å; L238-I240 HydrophobicContact CB-CG1 4.03Å; L238-I240 HydrophobicContact CD1-CD1 4.33Å; L238-I240 WeakPolarHBondContact O-CG1 3.43Å; L238-I240 PolarHBondContact O-N 3.42Å; I240-V242 HydrophobicContact CG2-CG1 3.88Å; I240-V252 HydrophobicContact CD1-CG1 4.49Å; I240-V252 HydrophobicContact CG2-CG1 3.72Å; I240-W253 WeakPolarHBondContact CA-O 3.22Å; I240-L276 HydrophobicContact CG2-CD2 4.23Å; I240-I306 HydrophobicContact CD1-CG2 3.53Å
241	L	95.8	Very high	94.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	141.9	162.4	-175.6	154.5	0	0	0	108.9	V200 V208 F222 D233 V252 W253 L255	V200-L241 HydrophobicContact CG1-CD1 3.51Å; V200-L241 HydrophobicContact CG1-CG 4.47Å; V200-L241 HydrophobicContact CG2-CD1 4.31Å; V208-L241 HydrophobicContact CG1-CD1 4.02Å; V208-L241 HydrophobicContact CG1-CD2 4.06Å; F222-L241 HydrophobicContact CE1-CD1 4.31Å; F222-L241 HydrophobicContact CE2-CD1 3.96Å; F222-L241 HydrophobicContact CZ-CD1 3.85Å; D233-L241 CarbonylContact O-C 3.6Å; D233-L241 WeakPolarHBondContact O-CA 3.45Å; L241-V252 CarbonylContact O-C 3.55Å; L241-V252 WeakPolarHBondContact O-CA 3.38Å; L241-W253 HydrophobicContact CB-CB 4.29Å; L241-W253 HydrophobicContact CD2-CG 4.12Å; L241-W253 PolarHBondContact N-O 2.88Å; L241-W253 PolarHBondContact O-N 2.85Å; L241-L255 HydrophobicContact CB-CB 4.44Å; L241-L255 HydrophobicContact CB-CD1 4.17Å; L241-L255 HydrophobicContact CD1-CD1 3.99Å
242	V	96.1	Very high	94.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.3	174.3	-62.7	0	0	0	0	110.3	V232 D233 I240 K251 V252 V274 L276 L293	V232-V242 WeakPolarHBondContact CA-O 3.16Å; D233-V242 HydrophobicContact CB-CG2 3.58Å; D233-V242 PolarHBondContact N-O 2.91Å; D233-V242 WeakPolarHBondContact O-CG2 3.13Å; D233-V242 PolarHBondContact O-N 2.86Å; I240-V242 HydrophobicContact CG2-CG1 3.88Å; V242-K251 CarbonylContact C-O 3.48Å; V242-K251 VanDerWaalsContact CA-O 3.28Å; V242-K251 WeakPolarHBondContact CA-O 3.27Å; V242-V252 HydrophobicContact CG1-CG1 4.38Å; V242-V252 HydrophobicContact CG1-CG2 4.25Å; V242-V274 HydrophobicContact CG2-CB 4.36Å; V242-V274 HydrophobicContact CG2-CG2 4.06Å; V242-L276 HydrophobicContact CG2-CB 4.21Å; V242-L293 HydrophobicContact CB-CD1 4.12Å; V242-L293 HydrophobicContact CB-CD2 4.43Å; V242-L293 HydrophobicContact CG1-CD1 4.21Å; V242-L293 HydrophobicContact CG1-CD2 4.02Å; V242-L293 HydrophobicContact CG2-CD1 3.82Å
243	S	97.4	Very high	94.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	134.3	179.7	57.7	0	0	0	0	112.2	H225 S231 V250 K251 W253	H225-S243 PolarHBondContact CD2-OG 3.01Å; H225-S243 PolarHBondContact NE2-O 3.45Å; H225-S243 PolarHBondContact NE2-OG 2.85Å; S231-S243 CarbonylContact O-C 3.56Å; S231-S243 WeakPolarHBondContact O-CA 3.43Å; S243-V250 CarbonylContact O-C 3.41Å; S243-V250 VanDerWaalsContact O-CA 3.24Å; S243-V250 WeakPolarHBondContact O-CA 3.24Å; S243-V250 WeakPolarHBondContact O-CG1 3.44Å; S243-K251 PolarHBondContact N-O 2.91Å; S243-K251 PolarHBondContact O-N 2.73Å; S243-W253 PolarHBondContact OG-NE1 3.18Å
244	G	96.8	Very high	94.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134.9	173.4	0	0	0	0	0	111.2	F230 S231 V271	F230-G244 PolarHBondContact N-O 3.3Å; S231-G244 PolarHBondContact N-O 3.37Å; S231-G244 PolarHBondContact O-N 3.04Å; G244-V271 CarbonylContact C-O 3.57Å
245	S	97.1	Very high	94.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	162.4	-170	172.3	0	0	0	0	114.2	H225 G227 A228 D247 F248 T249 V271	H225-S245 WeakPolarHBondContact CE1-CB 3.5Å; H225-S245 WeakPolarHBondContact ND1-CB 3.37Å; G227-S245 VanDerWaalsContact C-OG 3.22Å; G227-S245 PolarHBondContact O-OG 2.87Å; A228-S245 CarbonylContact O-C 3.59Å; A228-S245 VanDerWaalsContact O-CA 3.28Å; A228-S245 WeakPolarHBondContact O-CA 3.45Å; A228-S245 PolarHBondContact O-OG 2.81Å; S245-D247 VanDerWaalsContact CB-OD1 3.3Å; S245-D247 WeakPolarHBondContact CB-OD1 3.27Å; S245-D247 PolarHBondContact O-N 2.89Å; S245-D247 VanDerWaalsContact OG-CG 3.28Å; S245-D247 PolarHBondContact OG-N 2.71Å; S245-D247 VanDerWaalsContact OG-N 3.08Å; S245-D247 PolarHBondContact OG-OD1 2.89Å; S245-D247 PolarHBondContact OG-OD2 2.81Å; S245-F248 PolarHBondContact O-N 3.46Å; S245-T249 PolarHBondContact N-O 2.89Å; S245-V271 PolarHBondContact O-N 3.33Å
246	A	96.4	Very high	94.7	Very high	20 Å²	20	30 Å²	30	17%	0.165	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-12	166	0	0	0	0	0	113.8	A228 F230 F248 W270	A228-A246 HydrophobicContact CB-CB 4.33Å; A228-A246 PolarHBondContact O-N 2.9Å; F230-A246 HydrophobicContact CD2-CB 4.4Å; F230-A246 HydrophobicContact CE2-CB 3.53Å; F230-A246 HydrophobicContact CZ-CB 3.77Å; A246-F248 WeakPolarHBondContact O-CD1 3.49Å; A246-F248 PolarHBondContact O-N 3.35Å; A246-W270 HydrophobicContact CB-CG 4.19Å; A246-W270 PolarHBondContact O-NE1 3.26Å
247	D	97.1	Very high	94.8	Very high	27 Å²	27	30.1 Å²	30.1	14%	0.144	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	8.3	173	68.2	17.6	0	0	0	114.2	H225 T226 S245 T249	H225-D247 VanDerWaalsContact CA-OD2 3.26Å; H225-D247 WeakPolarHBondContact CA-OD2 3.47Å; H225-D247 WeakPolarHBondContact CB-OD2 3.4Å; H225-D247 IonicContact CE1-OD1 3.63Å; H225-D247 IonicContact CE1-OD2 3.92Å; H225-D247 IonicContact CG-OD2 2.57Å; H225-D247 IonicContact ND1-OD1 3.79Å; H225-D247 PolarHBondContact ND1-OD1 3.42Å; H225-D247 IonicContact ND1-OD2 3.85Å; H225-D247 PolarHBondContact ND1-OD2 2.73Å; T226-D247 PolarHBondContact N-OD2 2.84Å; T226-D247 VanDerWaalsContact OG1-CB 3.24Å; T226-D247 WeakPolarHBondContact OG1-CB 3.37Å; S245-D247 VanDerWaalsContact CB-OD1 3.3Å; S245-D247 WeakPolarHBondContact CB-OD1 3.27Å; S245-D247 PolarHBondContact O-N 2.89Å; S245-D247 VanDerWaalsContact OG-CG 3.28Å; S245-D247 PolarHBondContact OG-N 2.71Å; S245-D247 VanDerWaalsContact OG-N 3.08Å; S245-D247 PolarHBondContact OG-OD1 2.89Å; S245-D247 PolarHBondContact OG-OD2 2.81Å; D247-T249 VanDerWaalsContact CG-OG1 3.31Å; D247-T249 PolarHBondContact O-N 3.26Å; D247-T249 WeakPolarHBondContact OD1-CA 3.46Å; D247-T249 WeakPolarHBondContact OD1-CB 3.46Å; D247-T249 PolarHBondContact OD1-N 2.87Å; D247-T249 PolarHBondContact OD1-OG1 3.32Å; D247-T249 PolarHBondContact OD2-OG1 3.05Å
248	F	96.6	Very high	95	Very high	84 Å²	84	23.8 Å²	23.8	37%	0.368	14%	0.138	S	C	.	.	S	Bend	trans	66.2	14.5	-179.7	-43.8	-32.6	0	0	0	114.1	S245 A246 H267 E269 W270	S245-F248 PolarHBondContact O-N 3.46Å; A246-F248 WeakPolarHBondContact O-CD1 3.49Å; A246-F248 PolarHBondContact O-N 3.35Å; F248-H267 WeakPolarHBondContact O-CB 3.09Å; F248-E269 WeakPolarHBondContact CD1-O 3.31Å; F248-E269 VanDerWaalsContact CE1-C 3.48Å; F248-W270 AromaticContact CD1-CD1 3.79Å; F248-W270 AromaticContact CE1-CD1 3.34Å; F248-W270 HydrophobicContact CE1-CG 4.32Å; F248-W270 AromaticContact CE1-NE1 3.86Å
249	T	96.8	Very high	95.3	Very high	22 Å²	22	24.6 Å²	24.6	14%	0.135	15%	0.146	C	C	.	.			trans	-114.8	157.3	177.4	74	0	0	0	0	111.9	S245 D247 T263 T265	S245-T249 PolarHBondContact N-O 2.89Å; D247-T249 VanDerWaalsContact CG-OG1 3.31Å; D247-T249 PolarHBondContact O-N 3.26Å; D247-T249 WeakPolarHBondContact OD1-CA 3.46Å; D247-T249 WeakPolarHBondContact OD1-CB 3.46Å; D247-T249 PolarHBondContact OD1-N 2.87Å; D247-T249 PolarHBondContact OD1-OG1 3.32Å; D247-T249 PolarHBondContact OD2-OG1 3.05Å; T249-T263 HydrophobicContact CG2-CG2 4.03Å; T249-T265 HydrophobicContact CG2-CG2 4.24Å
250	V	96.9	Very high	95.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.1	162.9	-178.8	0	0	0	0	108.2	S243 L264 V271 V274 L293	S243-V250 CarbonylContact O-C 3.41Å; S243-V250 VanDerWaalsContact O-CA 3.24Å; S243-V250 WeakPolarHBondContact O-CA 3.24Å; S243-V250 WeakPolarHBondContact O-CG1 3.44Å; V250-L264 HydrophobicContact CB-CB 4.13Å; V250-L264 HydrophobicContact CB-CD1 4.26Å; V250-L264 HydrophobicContact CG1-CD1 4.19Å; V250-L264 PolarHBondContact N-O 3.23Å; V250-L264 WeakPolarHBondContact O-CB 3.21Å; V250-L264 PolarHBondContact O-N 3.06Å; V250-V271 HydrophobicContact CG2-CB 4.37Å; V250-V271 HydrophobicContact CG2-CG1 3.8Å; V250-V271 HydrophobicContact CG2-CG2 4.05Å; V250-V274 HydrophobicContact CG1-CG1 4.05Å; V250-V274 HydrophobicContact CG2-CG1 4.13Å; V250-L293 HydrophobicContact CG1-CD2 3.92Å
251	K	95.9	Very high	95.3	Very high	22 Å²	22	27 Å²	27	10%	0.096	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140.6	175	-71.8	178.8	-175.4	-77.9	0	110.6	G224 V242 S243 W253 N262 T263	G224-K251 VanDerWaalsContact C-CE 3.49Å; G224-K251 WeakPolarHBondContact O-CE 3.26Å; V242-K251 CarbonylContact C-O 3.48Å; V242-K251 VanDerWaalsContact CA-O 3.28Å; V242-K251 WeakPolarHBondContact CA-O 3.27Å; S243-K251 PolarHBondContact N-O 2.91Å; S243-K251 PolarHBondContact O-N 2.73Å; K251-W253 HydrophobicContact CB-CD2 4.38Å; K251-W253 VanDerWaalsContact CB-CE2 3.47Å; K251-W253 HydrophobicContact CB-CH2 4.36Å; K251-W253 HydrophobicContact CB-CZ2 3.47Å; K251-W253 VanDerWaalsContact CB-CZ2 3.47Å; K251-W253 HydrophobicContact CD-CH2 3.59Å; K251-W253 HydrophobicContact CD-CZ2 3.36Å; K251-W253 HydrophobicContact CG-CZ2 4.03Å; K251-W253 PolarHBondContact O-NE1 2.86Å; K251-N262 WeakPolarHBondContact CA-O 3.47Å; K251-T263 HydrophobicContact CG-CG2 4.23Å; K251-T263 PolarHBondContact NZ-OG1 3.27Å
252	V	95.5	Very high	95.2	Very high	6 Å²	6	28.5 Å²	28.5	4%	0.036	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.9	173.4	-172.9	0	0	0	0	106.8	I240 L241 V242 L261 N262 L264 I306	I240-V252 HydrophobicContact CD1-CG1 4.49Å; I240-V252 HydrophobicContact CG2-CG1 3.72Å; L241-V252 CarbonylContact O-C 3.55Å; L241-V252 WeakPolarHBondContact O-CA 3.38Å; V242-V252 HydrophobicContact CG1-CG1 4.38Å; V242-V252 HydrophobicContact CG1-CG2 4.25Å; V252-L261 PolarHBondContact O-N 2.72Å; V252-N262 HydrophobicContact CB-CB 4.28Å; V252-N262 HydrophobicContact CG2-CB 4.46Å; V252-N262 PolarHBondContact N-O 2.9Å; V252-N262 PolarHBondContact O-N 2.77Å; V252-N262 VanDerWaalsContact O-N 3.16Å; V252-L264 HydrophobicContact CG2-CD1 4.01Å; V252-L264 HydrophobicContact CG2-CG 4.25Å; V252-I306 HydrophobicContact CG2-CD1 4.31Å
253	W	95.6	Very high	95.1	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.4	-174.7	-42.6	81	0	0	0	110.1	F222 R223 H225 I240 L241 S243 K251 L255 T259 C260	F222-W253 HydrophobicContact CB-CD2 4.01Å; F222-W253 HydrophobicContact CB-CE3 3.85Å; F222-W253 HydrophobicContact CB-CH2 4.28Å; F222-W253 HydrophobicContact CB-CZ2 4.4Å; F222-W253 HydrophobicContact CB-CZ3 3.99Å; F222-W253 HydrophobicContact CD1-CB 3.58Å; F222-W253 AromaticContact CD1-CD2 3.82Å; F222-W253 HydrophobicContact CD1-CD2 3.82Å; F222-W253 AromaticContact CD1-CE3 3.88Å; F222-W253 HydrophobicContact CD1-CE3 3.88Å; F222-W253 AromaticContact CD1-CG 3.71Å; F222-W253 HydrophobicContact CD1-CG 3.71Å; F222-W253 HydrophobicContact CE1-CB 3.75Å; F222-W253 HydrophobicContact CE1-CG 4.3Å; F222-W253 HydrophobicContact CG-CD2 4.32Å; F222-W253 HydrophobicContact CG-CE3 4.36Å; F222-W253 HydrophobicContact CG-CG 4.49Å; R223-W253 WeakPolarHBondContact O-CZ3 3.37Å; H225-W253 AromaticContact CD2-CZ2 3.83Å; I240-W253 WeakPolarHBondContact CA-O 3.22Å; L241-W253 HydrophobicContact CB-CB 4.29Å; L241-W253 HydrophobicContact CD2-CG 4.12Å; L241-W253 PolarHBondContact N-O 2.88Å; L241-W253 PolarHBondContact O-N 2.85Å; S243-W253 PolarHBondContact OG-NE1 3.18Å; K251-W253 HydrophobicContact CB-CD2 4.38Å; K251-W253 VanDerWaalsContact CB-CE2 3.47Å; K251-W253 HydrophobicContact CB-CH2 4.36Å; K251-W253 HydrophobicContact CB-CZ2 3.47Å; K251-W253 VanDerWaalsContact CB-CZ2 3.47Å; K251-W253 HydrophobicContact CD-CH2 3.59Å; K251-W253 HydrophobicContact CD-CZ2 3.36Å; K251-W253 HydrophobicContact CG-CZ2 4.03Å; K251-W253 PolarHBondContact O-NE1 2.86Å; W253-L255 PolarHBondContact O-N 2.72Å; W253-T259 CarbonylContact C-O 3.54Å; W253-T259 VanDerWaalsContact CA-O 3.25Å; W253-T259 WeakPolarHBondContact CA-O 3.46Å; W253-C260 HydrophobicContact CD2-CB 4.48Å; W253-C260 HydrophobicContact CE3-CB 3.63Å; W253-C260 HydrophobicContact CH2-CB 4.39Å; W253-C260 HydrophobicContact CZ3-CB 3.57Å
254	A	94.4	Very high	95	Very high	7 Å²	7	31 Å²	31	6%	0.058	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	118.3	162.9	0	0	0	0	0	107.8	D239 S256 T257 G258 T259 L261	D239-A254 WeakPolarHBondContact O-CA 3.49Å; A254-S256 VanDerWaalsContact C-N 3.34Å; A254-S256 PolarHBondContact O-N 2.76Å; A254-T257 VanDerWaalsContact CB-OG1 3.23Å; A254-T257 WeakPolarHBondContact CB-OG1 3.49Å; A254-G258 WeakPolarHBondContact O-CA 3.42Å; A254-G258 PolarHBondContact O-N 2.83Å; A254-T259 WeakPolarHBondContact CB-OG1 3.49Å; A254-T259 PolarHBondContact N-O 3.17Å; A254-L261 HydrophobicContact CB-CD1 4.02Å; A254-L261 HydrophobicContact CB-CD2 4.08Å; A254-L261 HydrophobicContact CB-CG 4.07Å
255	L	93.6	Very high	94.8	Very high	8 Å²	8	35.7 Å²	35.7	4%	0.042	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-39.4	-172.9	171.9	69.6	0	0	0	111.4	K198 F222 Y234 D236 D239 L241 W253	K198-L255 VanDerWaalsContact NZ-CD2 3.34Å; F222-L255 HydrophobicContact CZ-CD1 4.47Å; Y234-L255 HydrophobicContact CD2-CD2 4.29Å; D236-L255 WeakPolarHBondContact OD1-CD2 3.45Å; D239-L255 PolarHBondContact O-N 2.8Å; D239-L255 WeakPolarHBondContact OD1-CB 3.11Å; D239-L255 PolarHBondContact OD1-N 3.26Å; L241-L255 HydrophobicContact CB-CB 4.44Å; L241-L255 HydrophobicContact CB-CD1 4.17Å; L241-L255 HydrophobicContact CD1-CD1 3.99Å; W253-L255 PolarHBondContact O-N 2.72Å
256	S	93	Very high	94.5	Very high	66 Å²	66	37.8 Å²	37.8	46%	0.462	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-42.2	-178.6	63.3	0	0	0	0	113.6	D239 A254	D239-S256 VanDerWaalsContact OD1-CB 3.22Å; D239-S256 WeakPolarHBondContact OD1-CB 3.33Å; D239-S256 PolarHBondContact OD1-N 3.43Å; D239-S256 PolarHBondContact OD1-OG 2.57Å; D239-S256 WeakPolarHBondContact OD2-CB 3.44Å; D239-S256 PolarHBondContact OD2-OG 2.91Å; A254-S256 VanDerWaalsContact C-N 3.34Å; A254-S256 PolarHBondContact O-N 2.76Å
257	T	92.3	Very high	94.4	Very high	92 Å²	92	37.4 Å²	37.4	56%	0.564	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-19	-172.1	65.9	0	0	0	0	113.8	A254 T259	A254-T257 VanDerWaalsContact CB-OG1 3.23Å; A254-T257 WeakPolarHBondContact CB-OG1 3.49Å; T257-T259 VanDerWaalsContact C-N 3.28Å; T257-T259 PolarHBondContact O-N 3.46Å; T257-T259 WeakPolarHBondContact OG1-CG2 3.2Å; T257-T259 PolarHBondContact OG1-N 2.74Å; T257-T259 PolarHBondContact OG1-OG1 2.82Å
258	G	93.3	Very high	94.3	Very high	13 Å²	13	38.9 Å²	38.9	13%	0.134	24%	0.24	C	C	.	.			trans	80.5	2.1	-173.5	0	0	0	0	0	114.8	F222 A254	F222-G258 VanDerWaalsContact CE1-CA 3.47Å; A254-G258 WeakPolarHBondContact O-CA 3.42Å; A254-G258 PolarHBondContact O-N 2.83Å
259	T	93.9	Very high	94.1	Very high	73 Å²	73	38 Å²	38	45%	0.448	24%	0.237	S	C	.	.			trans	-77.9	135.9	-174.6	59.2	0	0	0	0	112	W253 A254 T257 L261	W253-T259 CarbonylContact C-O 3.54Å; W253-T259 VanDerWaalsContact CA-O 3.25Å; W253-T259 WeakPolarHBondContact CA-O 3.46Å; A254-T259 WeakPolarHBondContact CB-OG1 3.49Å; A254-T259 PolarHBondContact N-O 3.17Å; T257-T259 VanDerWaalsContact C-N 3.28Å; T257-T259 PolarHBondContact O-N 3.46Å; T257-T259 WeakPolarHBondContact OG1-CG2 3.2Å; T257-T259 PolarHBondContact OG1-N 2.74Å; T257-T259 PolarHBondContact OG1-OG1 2.82Å; T259-L261 PolarHBondContact O-N 2.78Å
260	C	94.6	Very high	94	Very high	55 Å²	55	42.8 Å²	42.8	37%	0.372	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	112.4	171	-171.4	0	0	0	0	109.5	W253	W253-C260 HydrophobicContact CD2-CB 4.48Å; W253-C260 HydrophobicContact CE3-CB 3.63Å; W253-C260 HydrophobicContact CH2-CB 4.39Å; W253-C260 HydrophobicContact CZ3-CB 3.57Å
261	L	92.8	Very high	93.9	Very high	71 Å²	71	42.8 Å²	42.8	37%	0.372	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-41.2	178.7	-62.5	175.6	0	0	0	111.4	V252 A254 T259 I310	V252-L261 PolarHBondContact O-N 2.72Å; A254-L261 HydrophobicContact CB-CD1 4.02Å; A254-L261 HydrophobicContact CB-CD2 4.08Å; A254-L261 HydrophobicContact CB-CG 4.07Å; T259-L261 PolarHBondContact O-N 2.78Å; L261-I310 VanDerWaalsContact O-CG2 3.27Å; L261-I310 WeakPolarHBondContact O-CG2 3.43Å
262	N	92.9	Very high	93.8	Very high	31 Å²	31	42.7 Å²	42.7	17%	0.166	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	152.6	-179.3	-164.3	0.3	0	0	0	111.8	K251 V252 L264 I310 C312	K251-N262 WeakPolarHBondContact CA-O 3.47Å; V252-N262 HydrophobicContact CB-CB 4.28Å; V252-N262 HydrophobicContact CG2-CB 4.46Å; V252-N262 PolarHBondContact N-O 2.9Å; V252-N262 PolarHBondContact O-N 2.77Å; V252-N262 VanDerWaalsContact O-N 3.16Å; N262-L264 WeakPolarHBondContact ND2-CD2 3.26Å; N262-I310 VanDerWaalsContact CG-O 3.29Å; N262-I310 PolarHBondContact ND2-O 2.77Å; N262-C312 PolarHBondContact ND2-N 3.3Å
263	T	94.6	Very high	93.6	Very high	49 Å²	49	44.7 Å²	44.7	30%	0.301	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	109.4	169.8	-60	0	0	0	0	108.8	T249 K251 T265	T249-T263 HydrophobicContact CG2-CG2 4.03Å; K251-T263 HydrophobicContact CG-CG2 4.23Å; K251-T263 PolarHBondContact NZ-OG1 3.27Å; T263-T265 HydrophobicContact CG2-CG2 4.21Å
264	L	94.4	Very high	93.6	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	113.5	178.5	-47.4	177.1	0	0	0	108.8	V250 V252 N262 L293 W304 C312	V250-L264 HydrophobicContact CB-CB 4.13Å; V250-L264 HydrophobicContact CB-CD1 4.26Å; V250-L264 HydrophobicContact CG1-CD1 4.19Å; V250-L264 PolarHBondContact N-O 3.23Å; V250-L264 WeakPolarHBondContact O-CB 3.21Å; V250-L264 PolarHBondContact O-N 3.06Å; V252-L264 HydrophobicContact CG2-CD1 4.01Å; V252-L264 HydrophobicContact CG2-CG 4.25Å; N262-L264 WeakPolarHBondContact ND2-CD2 3.26Å; L264-L293 HydrophobicContact CD1-CD2 3.6Å; L264-W304 HydrophobicContact CB-CD2 4.34Å; L264-W304 HydrophobicContact CB-CE3 4.11Å; L264-W304 HydrophobicContact CB-CH2 3.86Å; L264-W304 HydrophobicContact CB-CZ2 4.06Å; L264-W304 HydrophobicContact CB-CZ3 3.87Å; L264-W304 HydrophobicContact CD1-CB 4.24Å; L264-W304 HydrophobicContact CD1-CD2 3.75Å; L264-W304 HydrophobicContact CD1-CE3 3.97Å; L264-W304 HydrophobicContact CD1-CG 3.86Å; L264-W304 HydrophobicContact CD2-CE3 4.03Å; L264-W304 HydrophobicContact CD2-CZ3 4.24Å; L264-W304 HydrophobicContact CG-CD2 4.46Å; L264-W304 HydrophobicContact CG-CE3 4.26Å; L264-W304 HydrophobicContact CG-CZ3 4.45Å; L264-C312 HydrophobicContact CD2-CB 3.95Å
265	T	93.8	Very high	93.5	Very high	98 Å²	98	45.5 Å²	45.5	60%	0.601	27%	0.267	S	S	*	.			trans	-106.7	154.3	-179.6	58.7	0	0	0	0	111	T249 T263	T249-T265 HydrophobicContact CG2-CG2 4.24Å; T263-T265 HydrophobicContact CG2-CG2 4.21Å
266	G	91.1	Very high	93.4	Very high	43 Å²	43	46 Å²	46	44%	0.443	27%	0.269	S	S	.	.			trans	136.3	-11.3	171.5	0	0	0	0	0	114.2	K302	G266-K302 VanDerWaalsContact C-CE 3.43Å; G266-K302 VanDerWaalsContact O-CE 3.24Å; G266-K302 WeakPolarHBondContact O-CE 3.36Å
267	H	94.3	Very high	93.2	Very high	12 Å²	12	45.5 Å²	45.5	6%	0.056	26%	0.26	C	S	.	.			trans	-68.1	147.9	167.1	-79.8	-69.6	0	0	0	110.5	F248 V271 S295 D297 E300	F248-H267 WeakPolarHBondContact O-CB 3.09Å; H267-V271 HydrophobicContact CB-CG2 4.04Å; H267-S295 WeakPolarHBondContact NE2-CB 3.22Å; H267-S295 PolarHBondContact NE2-OG 2.83Å; H267-D297 IonicContact CE1-OD2 2.8Å; H267-D297 IonicContact CG-OD2 2.73Å; H267-D297 VanDerWaalsContact ND1-CG 3.3Å; H267-D297 IonicContact ND1-OD2 3.78Å; H267-D297 PolarHBondContact ND1-OD2 2.79Å; H267-E300 WeakPolarHBondContact CA-OE1 3.26Å; H267-E300 IonicContact ND1-OE1 3.15Å; H267-E300 PolarHBondContact ND1-OE1 2.98Å
268	T	93.2	Very high	92.9	Very high	59 Å²	59	45.1 Å²	45.1	36%	0.362	25%	0.25	S	S	.	.	S	Bend	trans	-107.6	-3.8	-179.5	59.2	0	0	0	0	113.2
269	E	93.8	Very high	92.3	Very high	65 Å²	65	44.6 Å²	44.6	30%	0.304	25%	0.245	S	C	.	.	S	Bend	trans	-141.7	174.6	-178.8	-77.3	-65.6	163.4	0	0	110.6	F248 V271 D297 K298 Y299	F248-E269 WeakPolarHBondContact CD1-O 3.31Å; F248-E269 VanDerWaalsContact CE1-C 3.48Å; E269-V271 PolarHBondContact O-N 2.92Å; E269-D297 HydrophobicContact CB-CB 4.03Å; E269-K298 HydrophobicContact CB-CB 4.3Å; E269-K298 HydrophobicContact CG-CB 4.39Å; E269-Y299 HydrophobicContact CG-CD2 3.86Å; E269-Y299 HydrophobicContact CG-CE2 3.8Å
270	W	94.5	Very high	91.7	Very high	122 Å²	122	47.9 Å²	47.9	46%	0.462	25%	0.253	S	S	.	.			trans	-54.2	128.6	177.9	-64.9	-19.8	0	0	0	111.5	F230 A246 F248 T272 D297	F230-W270 HydrophobicContact CD2-CB 4.23Å; F230-W270 HydrophobicContact CE2-CB 3.92Å; F230-W270 AromaticContact CE2-CD2 3.81Å; F230-W270 HydrophobicContact CE2-CD2 3.81Å; F230-W270 AromaticContact CE2-CE3 3.86Å; F230-W270 HydrophobicContact CE2-CE3 3.86Å; F230-W270 AromaticContact CE2-CG 3.85Å; F230-W270 HydrophobicContact CE2-CG 3.85Å; F230-W270 HydrophobicContact CZ-CD2 4.39Å; F230-W270 HydrophobicContact CZ-CE3 4.25Å; A246-W270 HydrophobicContact CB-CG 4.19Å; A246-W270 PolarHBondContact O-NE1 3.26Å; F248-W270 AromaticContact CD1-CD1 3.79Å; F248-W270 AromaticContact CE1-CD1 3.34Å; F248-W270 HydrophobicContact CE1-CG 4.32Å; F248-W270 AromaticContact CE1-NE1 3.86Å; W270-T272 PolarHBondContact O-N 2.71Å; W270-T272 VanDerWaalsContact O-N 3.15Å; W270-D297 WeakPolarHBondContact O-CA 3.32Å; W270-D297 WeakPolarHBondContact O-CB 3.33Å
271	V	95	Very high	90.9	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.			trans	-77.4	106.5	172.9	-172.8	0	0	0	0	108.1	G244 S245 V250 H267 E269 V274	G244-V271 CarbonylContact C-O 3.57Å; S245-V271 PolarHBondContact O-N 3.33Å; V250-V271 HydrophobicContact CG2-CB 4.37Å; V250-V271 HydrophobicContact CG2-CG1 3.8Å; V250-V271 HydrophobicContact CG2-CG2 4.05Å; H267-V271 HydrophobicContact CB-CG2 4.04Å; E269-V271 PolarHBondContact O-N 2.92Å; V271-V274 HydrophobicContact CG1-CG1 4.12Å
272	T	92.7	Very high	90.3	Very high	21 Å²	21	51.5 Å²	51.5	13%	0.129	26%	0.262	C	S	.	.			trans	-90.9	-24.1	-173.1	60.2	0	0	0	0	113.2	W270 A296	W270-T272 PolarHBondContact O-N 2.71Å; W270-T272 VanDerWaalsContact O-N 3.15Å; T272-A296 PolarHBondContact N-O 3.26Å; T272-A296 PolarHBondContact OG1-O 3.1Å
273	K	92.9	Very high	89.6	Confident	48 Å²	48	51.5 Å²	51.5	21%	0.209	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	137.3	-178.2	-157.3	74.1	-179.3	175.8	0	111.1	V275 S295 A296 L332	K273-V275 HydrophobicContact CG-CG2 4.31Å; K273-S295 CarbonylContact O-C 3.56Å; K273-S295 WeakPolarHBondContact O-CA 3.39Å; K273-A296 HydrophobicContact CB-CB 4.24Å; K273-A296 PolarHBondContact N-O 3.47Å; K273-A296 PolarHBondContact O-N 3.48Å; K273-L332 HydrophobicContact CG-CB 4.12Å
274	V	94.6	Very high	88.4	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.018	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142	164	-65	0	0	0	0	109.2	S231 D233 V242 V250 V271 L293 L294	S231-V274 WeakPolarHBondContact OG-CG2 3.07Å; S231-V274 PolarHBondContact OG-N 2.8Å; D233-V274 HydrophobicContact CB-CG2 4.26Å; V242-V274 HydrophobicContact CG2-CB 4.36Å; V242-V274 HydrophobicContact CG2-CG2 4.06Å; V250-V274 HydrophobicContact CG1-CG1 4.05Å; V250-V274 HydrophobicContact CG2-CG1 4.13Å; V271-V274 HydrophobicContact CG1-CG1 4.12Å; V274-L293 HydrophobicContact CB-CD1 4.06Å; V274-L293 HydrophobicContact CG1-CD1 4.49Å; V274-L294 CarbonylContact C-O 3.56Å; V274-L294 VanDerWaalsContact CA-O 3.26Å; V274-L294 WeakPolarHBondContact CA-O 3.44Å
275	V	93.2	Very high	87.3	Confident	23 Å²	23	62.7 Å²	62.7	14%	0.139	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	122.7	176.4	-179.2	0	0	0	0	108.2	D233 K273 L293 L294 L332	D233-V275 WeakPolarHBondContact OD2-CA 3.36Å; K273-V275 HydrophobicContact CG-CG2 4.31Å; V275-L293 CarbonylContact O-C 3.6Å; V275-L293 WeakPolarHBondContact O-CA 3.47Å; V275-L294 HydrophobicContact CB-CB 4.43Å; V275-L294 PolarHBondContact N-O 3.26Å; V275-L294 PolarHBondContact O-N 2.6Å; V275-L332 HydrophobicContact CG2-CD2 4.26Å
276	L	91.4	Very high	86.5	Confident	17 Å²	17	58.5 Å²	58.5	9%	0.089	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.8	176.6	-179.5	64.3	0	0	0	109.2	D233 N235 I240 V242 L293 I306	D233-L276 HydrophobicContact CB-CB 4.2Å; D233-L276 PolarHBondContact OD2-N 3.03Å; N235-L276 HydrophobicContact CB-CD2 3.72Å; I240-L276 HydrophobicContact CG2-CD2 4.23Å; V242-L276 HydrophobicContact CG2-CB 4.21Å; L276-L293 HydrophobicContact CD1-CB 4.31Å; L276-I306 HydrophobicContact CD1-CB 4.16Å; L276-I306 HydrophobicContact CD1-CG1 4.01Å; L276-I306 HydrophobicContact CD1-CG2 4.3Å
277	Q	87.9	Confident	85.8	Confident	56 Å²	56	59 Å²	59	26%	0.262	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	150.9	-175.5	-169.4	169.9	3.4	0	0	112.5	I292 F334	Q277-I292 PolarHBondContact N-O 3.06Å; Q277-I292 PolarHBondContact O-N 3.28Å; Q277-F334 HydrophobicContact CB-CD1 3.87Å; Q277-F334 HydrophobicContact CB-CE1 3.97Å; Q277-F334 HydrophobicContact CG-CD1 4.28Å; Q277-F334 HydrophobicContact CG-CE1 4.36Å; Q277-F334 PolarHBondContact OE1-O 2.96Å
278	K	85.4	Confident	85.1	Confident	84 Å²	84	61.9 Å²	61.9	37%	0.365	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	132.4	171.6	-68	-177.8	-177.2	172.7	0	110.3	E237 Y291	E237-K278 IonicContact OE1-NZ 2.76Å; E237-K278 IonicContact OE2-NZ 3.01Å; E237-K278 PolarHBondContact OE2-NZ 2.74Å; K278-Y291 HydrophobicContact CD-CE1 4.27Å; K278-Y291 HydrophobicContact CD-CE2 4.39Å; K278-Y291 VanDerWaalsContact CE-CE2 3.48Å; K278-Y291 WeakPolarHBondContact CE-OH 3.08Å; K278-Y291 HydrophobicContact CG-CD1 3.79Å; K278-Y291 HydrophobicContact CG-CD2 4.3Å; K278-Y291 HydrophobicContact CG-CE1 3.51Å; K278-Y291 HydrophobicContact CG-CE2 4.1Å; K278-Y291 HydrophobicContact CG-CG 4.21Å; K278-Y291 PolarHBondContact NZ-OH 2.91Å
279	C	81.1	Confident	84.3	Confident	3 Å²	3	61 Å²	61	2%	0.02	31%	0.312	C	S	.	.			trans	-68.6	139.5	170.2	-170	0	0	0	0	110.9	V281 H286 G289 D290 I292 F352	C279-V281 PolarHBondContact SG-N 2.92Å; C279-V281 PolarHBondContact SG-O 3.2Å; C279-H286 VanDerWaalsContact SG-CE1 3.55Å; C279-H286 PolarHBondContact SG-ND1 2.6Å; C279-G289 PolarHBondContact O-N 3.3Å; C279-D290 PolarHBondContact N-O 3.29Å; C279-I292 HydrophobicContact CB-CD1 3.66Å; C279-I292 HydrophobicContact CB-CG1 4.32Å; C279-F352 HydrophobicContact CB-CE1 4.3Å; C279-F352 VanDerWaalsContact SG-CD1 3.59Å; C279-F352 WeakPolarHBondContact SG-CE1 3.34Å
280	K	80.8	Confident	83.8	Confident	142 Å²	142	61.2 Å²	61.2	62%	0.617	32%	0.315	S	S	*	.			trans	-102.1	-10.9	174	-65.4	178.8	-176.8	162.3	0	113.1	D335 G336	K280-D335 WeakPolarHBondContact CD-O 3.36Å; K280-D335 WeakPolarHBondContact CE-O 3.21Å; K280-D335 PolarHBondContact NZ-O 2.78Å; K280-G336 PolarHBondContact N-O 3Å
281	V	79.2	Confident	83.5	Confident	35 Å²	35	56.6 Å²	56.6	21%	0.212	30%	0.297	C	S	.	.	S	Bend	trans	-115.9	141.6	-170.1	-171.9	0	0	0	0	111	C279 H286 K337 A353	C279-V281 PolarHBondContact SG-N 2.92Å; C279-V281 PolarHBondContact SG-O 3.2Å; V281-H286 PolarHBondContact O-CE1 3.2Å; V281-H286 PolarHBondContact O-ND1 2.98Å; V281-K337 HydrophobicContact CG2-CB 3.91Å; V281-K337 HydrophobicContact CG2-CG 3.9Å; V281-A353 HydrophobicContact CG1-CB 3.68Å
282	K	78.9	Confident	83.2	Confident	167 Å²	167	56.6 Å²	56.6	73%	0.726	30%	0.298	S	S	*	.			trans	-84.6	127.1	172.4	-171.5	177.3	179.4	179.4	0	109.5	P288	K282-P288 HydrophobicContact CB-CG 4.01Å
283	S	78.3	Confident	83.2	Confident	31 Å²	31	55.6 Å²	55.6	22%	0.217	29%	0.292	C	S	.	.			trans	-127.2	178.6	170	-178.2	0	0	0	0	109.9	M285 H286 A353	S283-M285 PolarHBondContact O-N 3.26Å; S283-H286 WeakPolarHBondContact CB-CE1 3.5Å; S283-H286 VanDerWaalsContact CB-NE2 3.26Å; S283-H286 WeakPolarHBondContact CB-NE2 3.36Å; S283-H286 PolarHBondContact N-O 3.46Å; S283-H286 VanDerWaalsContact O-O 3.13Å; S283-A353 WeakPolarHBondContact CB-O 3.4Å; S283-A353 PolarHBondContact OG-O 2.92Å
284	L	70.9	Confident	83.2	Confident	170 Å²	170	53.3 Å²	53.3	89%	0.89	28%	0.282	S	S	*	.	S	Bend	trans	-63	-27.7	168.8	-131.3	104.4	0	0	0	111.9
285	M	70.4	Confident	83.2	Confident	118 Å²	118	53.2 Å²	53.2	58%	0.581	28%	0.281	S	S	*	.	S	Bend	trans	-103.9	-16.7	-171.1	-62.5	-65.2	-178.4	0	0	114.5	S283 L315	S283-M285 PolarHBondContact O-N 3.26Å; M285-L315 HydrophobicContact CB-CD2 4.43Å
286	H	77.3	Confident	83.3	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.046	28%	0.276	C	S	.	.			trans	-151.8	152.7	-178.4	53.7	77.8	0	0	0	111.5	C279 V281 S283 I292 F352 Y355	C279-H286 VanDerWaalsContact SG-CE1 3.55Å; C279-H286 PolarHBondContact SG-ND1 2.6Å; V281-H286 PolarHBondContact O-CE1 3.2Å; V281-H286 PolarHBondContact O-ND1 2.98Å; S283-H286 WeakPolarHBondContact CB-CE1 3.5Å; S283-H286 VanDerWaalsContact CB-NE2 3.26Å; S283-H286 WeakPolarHBondContact CB-NE2 3.36Å; S283-H286 PolarHBondContact N-O 3.46Å; S283-H286 VanDerWaalsContact O-O 3.13Å; H286-I292 HydrophobicContact CB-CD1 3.89Å; H286-F352 AromaticContact CD2-CE1 3.66Å; H286-F352 AromaticContact CE1-CD1 3.43Å; H286-F352 VanDerWaalsContact CE1-CD1 3.43Å; H286-F352 WeakPolarHBondContact CE1-CD1 3.42Å; H286-F352 AromaticContact CE1-CE1 3.26Å; H286-F352 WeakPolarHBondContact CE1-CE1 3.22Å; H286-F352 AromaticContact CG-CE1 3.97Å; H286-F352 AromaticContact ND1-CE1 3.76Å; H286-F352 AromaticContact NE2-CD1 3.57Å; H286-F352 AromaticContact NE2-CE1 3.19Å; H286-F352 WeakPolarHBondContact NE2-CE1 3.35Å; H286-F352 AromaticContact NE2-CZ 3.89Å; H286-F352 PolarHBondContact NE2-O 2.94Å; H286-Y355 PolarHBondContact CD2-OH 3.26Å; H286-Y355 PolarHBondContact NE2-OH 3.28Å
287	S	76.3	Confident	83.3	Confident	53 Å²	53	51.7 Å²	51.7	37%	0.371	27%	0.273	S	S	.	.			trans	-109.5	153.3	177.3	69.9	0	0	0	0	111.6	G289 D290	S287-G289 PolarHBondContact O-N 2.82Å; S287-D290 WeakPolarHBondContact CA-OD2 3.23Å; S287-D290 WeakPolarHBondContact CB-OD2 3.45Å; S287-D290 PolarHBondContact N-OD2 2.98Å; S287-D290 WeakPolarHBondContact O-CB 3.28Å; S287-D290 PolarHBondContact O-N 3.03Å; S287-D290 VanDerWaalsContact O-N 3.08Å; S287-D290 PolarHBondContact OG-OD1 2.91Å; S287-D290 PolarHBondContact OG-OD2 3.36Å
288	P	78.9	Confident	83.3	Confident	73 Å²	73	53.4 Å²	53.4	47%	0.474	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	126.9	172.8	-21.5	32.9	0	0	0	110.2	K282	K282-P288 HydrophobicContact CB-CG 4.01Å
289	G	77.6	Confident	83.5	Confident	40 Å²	40	51.4 Å²	51.4	41%	0.412	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.1	-16	-175.4	0	0	0	0	0	114.8	C279 S287	C279-G289 PolarHBondContact O-N 3.3Å; S287-G289 PolarHBondContact O-N 2.82Å
290	D	83.6	Confident	84.1	Confident	70 Å²	70	52.6 Å²	52.6	37%	0.374	28%	0.275	S	S	.	.			trans	-67.1	139.2	171.6	-68.7	-29.8	0	0	0	110.4	C279 S287	C279-D290 PolarHBondContact N-O 3.29Å; S287-D290 WeakPolarHBondContact CA-OD2 3.23Å; S287-D290 WeakPolarHBondContact CB-OD2 3.45Å; S287-D290 PolarHBondContact N-OD2 2.98Å; S287-D290 WeakPolarHBondContact O-CB 3.28Å; S287-D290 PolarHBondContact O-N 3.03Å; S287-D290 VanDerWaalsContact O-N 3.08Å; S287-D290 PolarHBondContact OG-OD1 2.91Å; S287-D290 PolarHBondContact OG-OD2 3.36Å
291	Y	86.9	Confident	84.7	Confident	24 Å²	24	45.9 Å²	45.9	9%	0.094	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	133.2	175.3	-78	-90.2	0	0	0	110.5	N235 E237 L238 K278 I306	N235-Y291 HydrophobicContact CB-CE1 4.46Å; N235-Y291 WeakPolarHBondContact ND2-CE1 3.49Å; N235-Y291 PolarHBondContact ND2-OH 3.04Å; N235-Y291 PolarHBondContact OD1-OH 3.31Å; E237-Y291 PolarHBondContact OE2-OH 3.15Å; L238-Y291 HydrophobicContact CD1-CD1 3.66Å; L238-Y291 HydrophobicContact CD1-CD2 3.36Å; L238-Y291 HydrophobicContact CD1-CE1 3.9Å; L238-Y291 HydrophobicContact CD1-CE2 3.58Å; L238-Y291 HydrophobicContact CD1-CG 3.33Å; L238-Y291 HydrophobicContact CD2-CD2 3.85Å; L238-Y291 HydrophobicContact CD2-CE2 3.68Å; L238-Y291 HydrophobicContact CG-CD2 3.85Å; L238-Y291 HydrophobicContact CG-CE1 4.39Å; L238-Y291 HydrophobicContact CG-CE2 3.58Å; L238-Y291 HydrophobicContact CG-CG 4.28Å; K278-Y291 HydrophobicContact CD-CE1 4.27Å; K278-Y291 HydrophobicContact CD-CE2 4.39Å; K278-Y291 VanDerWaalsContact CE-CE2 3.48Å; K278-Y291 WeakPolarHBondContact CE-OH 3.08Å; K278-Y291 HydrophobicContact CG-CD1 3.79Å; K278-Y291 HydrophobicContact CG-CD2 4.3Å; K278-Y291 HydrophobicContact CG-CE1 3.51Å; K278-Y291 HydrophobicContact CG-CE2 4.1Å; K278-Y291 HydrophobicContact CG-CG 4.21Å; K278-Y291 PolarHBondContact NZ-OH 2.91Å; Y291-I306 WeakPolarHBondContact CB-O 3.43Å; Y291-I306 PolarHBondContact O-N 3.08Å
292	I	89.7	Confident	85.4	Confident	1 Å²	1	45 Å²	45	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.9	-176.3	-58.9	-176.5	0	0	0	108.1	Q277 C279 H286 L294 I303 F352	Q277-I292 PolarHBondContact N-O 3.06Å; Q277-I292 PolarHBondContact O-N 3.28Å; C279-I292 HydrophobicContact CB-CD1 3.66Å; C279-I292 HydrophobicContact CB-CG1 4.32Å; H286-I292 HydrophobicContact CB-CD1 3.89Å; I292-L294 HydrophobicContact CG2-CD2 4.39Å; I292-I303 HydrophobicContact CG2-CG2 3.52Å; I292-F352 HydrophobicContact CB-CZ 4.41Å; I292-F352 HydrophobicContact CD1-CE1 3.35Å; I292-F352 HydrophobicContact CD1-CZ 3.25Å; I292-F352 HydrophobicContact CG1-CZ 4.36Å; I292-F352 HydrophobicContact CG2-CE2 4.36Å; I292-F352 HydrophobicContact CG2-CZ 3.87Å
293	L	92.2	Very high	86.1	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.3	172.5	169.2	65.4	0	0	0	108.6	V242 V250 L264 V274 V275 L276 W304 I306	V242-L293 HydrophobicContact CB-CD1 4.12Å; V242-L293 HydrophobicContact CB-CD2 4.43Å; V242-L293 HydrophobicContact CG1-CD1 4.21Å; V242-L293 HydrophobicContact CG1-CD2 4.02Å; V242-L293 HydrophobicContact CG2-CD1 3.82Å; V250-L293 HydrophobicContact CG1-CD2 3.92Å; L264-L293 HydrophobicContact CD1-CD2 3.6Å; V274-L293 HydrophobicContact CB-CD1 4.06Å; V274-L293 HydrophobicContact CG1-CD1 4.49Å; V275-L293 CarbonylContact O-C 3.6Å; V275-L293 WeakPolarHBondContact O-CA 3.47Å; L276-L293 HydrophobicContact CD1-CB 4.31Å; L293-W304 HydrophobicContact CB-CB 4.13Å; L293-W304 HydrophobicContact CD2-CB 4.37Å; L293-W304 HydrophobicContact CD2-CG 4.41Å; L293-W304 HydrophobicContact CG-CB 4.46Å; L293-W304 PolarHBondContact N-O 2.9Å; L293-W304 PolarHBondContact O-N 3.41Å; L293-I306 HydrophobicContact CB-CD1 3.97Å; L293-I306 HydrophobicContact CB-CG1 3.45Å; L293-I306 VanDerWaalsContact CB-CG1 3.45Å; L293-I306 HydrophobicContact CD2-CD1 3.94Å; L293-I306 HydrophobicContact CD2-CG1 4.29Å
294	L	93.8	Very high	86.7	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.6	166.5	-59.3	175.9	0	0	0	108.6	V274 V275 I292 K302 I303 L332 F334 I339 F352	V274-L294 CarbonylContact C-O 3.56Å; V274-L294 VanDerWaalsContact CA-O 3.26Å; V274-L294 WeakPolarHBondContact CA-O 3.44Å; V275-L294 HydrophobicContact CB-CB 4.43Å; V275-L294 PolarHBondContact N-O 3.26Å; V275-L294 PolarHBondContact O-N 2.6Å; I292-L294 HydrophobicContact CG2-CD2 4.39Å; L294-K302 WeakPolarHBondContact CA-O 3.2Å; L294-I303 HydrophobicContact CD2-CB 4.11Å; L294-I303 HydrophobicContact CD2-CD1 4.23Å; L294-I303 HydrophobicContact CD2-CG1 3.63Å; L294-I303 HydrophobicContact CD2-CG2 3.97Å; L294-L332 HydrophobicContact CB-CD2 3.76Å; L294-L332 HydrophobicContact CD1-CD2 4.18Å; L294-F334 HydrophobicContact CD1-CB 3.62Å; L294-F334 HydrophobicContact CD1-CD1 3.71Å; L294-F334 HydrophobicContact CD1-CD2 3.81Å; L294-F334 HydrophobicContact CD1-CE1 4.29Å; L294-F334 HydrophobicContact CD1-CE2 4.39Å; L294-F334 HydrophobicContact CD1-CG 3.44Å; L294-F334 VanDerWaalsContact CD1-CG 3.44Å; L294-I339 HydrophobicContact CD1-CD1 3.96Å; L294-I339 HydrophobicContact CD1-CG1 3.92Å; L294-I339 HydrophobicContact CD2-CD1 3.77Å; L294-F352 HydrophobicContact CD2-CE2 4.37Å
295	S	94.2	Very high	87.5	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135	171.1	62.5	0	0	0	0	110.3	H267 K273 I301 K302 W304	H267-S295 WeakPolarHBondContact NE2-CB 3.22Å; H267-S295 PolarHBondContact NE2-OG 2.83Å; K273-S295 CarbonylContact O-C 3.56Å; K273-S295 WeakPolarHBondContact O-CA 3.39Å; S295-I301 CarbonylContact O-C 3.59Å; S295-I301 VanDerWaalsContact O-CA 3.3Å; S295-I301 WeakPolarHBondContact O-CA 3.3Å; S295-K302 PolarHBondContact N-O 3.24Å; S295-K302 PolarHBondContact O-N 3.11Å; S295-W304 PolarHBondContact OG-NE1 2.82Å
296	A	93.9	Very high	88.1	Confident	6 Å²	6	24.8 Å²	24.8	5%	0.05	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.8	-177.8	0	0	0	0	0	111.1	T272 K273 E300 I301 L332	T272-A296 PolarHBondContact N-O 3.26Å; T272-A296 PolarHBondContact OG1-O 3.1Å; K273-A296 HydrophobicContact CB-CB 4.24Å; K273-A296 PolarHBondContact N-O 3.47Å; K273-A296 PolarHBondContact O-N 3.48Å; A296-E300 WeakPolarHBondContact CA-O 3.33Å; A296-I301 HydrophobicContact CB-CG1 3.99Å; A296-L332 HydrophobicContact CB-CD2 4.33Å
297	D	91.6	Very high	87.8	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.011	16%	0.162	C	C	.	.			trans	-104.3	-164.9	163	73.6	24.8	0	0	0	110.3	H267 E269 W270 Y299 E300	H267-D297 IonicContact CE1-OD2 2.8Å; H267-D297 IonicContact CG-OD2 2.73Å; H267-D297 VanDerWaalsContact ND1-CG 3.3Å; H267-D297 IonicContact ND1-OD2 3.78Å; H267-D297 PolarHBondContact ND1-OD2 2.79Å; E269-D297 HydrophobicContact CB-CB 4.03Å; W270-D297 WeakPolarHBondContact O-CA 3.32Å; W270-D297 WeakPolarHBondContact O-CB 3.33Å; D297-Y299 PolarHBondContact O-N 2.96Å; D297-Y299 PolarHBondContact OD1-N 3.34Å; D297-E300 VanDerWaalsContact CG-CG 3.44Å; D297-E300 PolarHBondContact N-O 3.39Å; D297-E300 WeakPolarHBondContact OD1-CG 3.16Å; D297-E300 PolarHBondContact OD1-N 2.78Å; D297-E300 WeakPolarHBondContact OD2-CG 3.45Å
298	K	88.8	Confident	86.9	Confident	93 Å²	93	36.1 Å²	36.1	40%	0.404	19%	0.19	S	C	.	.	S	Bend	trans	-65.4	-22	-178.8	-173.2	179.7	172.8	-158.6	0	113.9	E269 S327 L328	E269-K298 HydrophobicContact CB-CB 4.3Å; E269-K298 HydrophobicContact CG-CB 4.39Å; K298-S327 CarbonylContact O-C 3.57Å; K298-S327 VanDerWaalsContact O-CA 3.28Å; K298-S327 WeakPolarHBondContact O-CA 3.26Å; K298-S327 WeakPolarHBondContact O-CB 3.21Å; K298-L328 PolarHBondContact O-N 3.5Å
299	Y	89.9	Confident	86	Confident	42 Å²	42	40.2 Å²	40.2	17%	0.165	20%	0.203	C	C	.	.	S	Bend	trans	-127.3	-28.5	-168.3	-62.3	-60.5	0	0	0	113.7	E269 D297 R324	E269-Y299 HydrophobicContact CG-CD2 3.86Å; E269-Y299 HydrophobicContact CG-CE2 3.8Å; D297-Y299 PolarHBondContact O-N 2.96Å; D297-Y299 PolarHBondContact OD1-N 3.34Å; Y299-R324 HydrophobicContact CE1-CB 4.14Å; Y299-R324 WeakPolarHBondContact CE1-O 3.39Å; Y299-R324 PolarHBondContact OH-O 2.61Å; Y299-R324 VanDerWaalsContact OH-O 3.14Å
300	E	92.5	Very high	85	Confident	28 Å²	28	43.5 Å²	43.5	13%	0.131	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	148.1	-171.4	51.9	175.7	-165.3	0	0	112.9	H267 A296 D297 K302 T317 L318	H267-E300 WeakPolarHBondContact CA-OE1 3.26Å; H267-E300 IonicContact ND1-OE1 3.15Å; H267-E300 PolarHBondContact ND1-OE1 2.98Å; A296-E300 WeakPolarHBondContact CA-O 3.33Å; D297-E300 VanDerWaalsContact CG-CG 3.44Å; D297-E300 PolarHBondContact N-O 3.39Å; D297-E300 WeakPolarHBondContact OD1-CG 3.16Å; D297-E300 PolarHBondContact OD1-N 2.78Å; D297-E300 WeakPolarHBondContact OD2-CG 3.45Å; E300-K302 VanDerWaalsContact CD-CE 3.41Å; E300-K302 WeakPolarHBondContact OE1-CE 3.28Å; E300-K302 IonicContact OE1-NZ 2.77Å; E300-K302 PolarHBondContact OE1-NZ 2.86Å; E300-K302 IonicContact OE2-NZ 3.74Å; E300-K302 PolarHBondContact OE2-NZ 2.92Å; E300-T317 HydrophobicContact CB-CG2 3.76Å; E300-T317 HydrophobicContact CG-CG2 4.45Å; E300-T317 WeakPolarHBondContact OE2-CG2 3.18Å; E300-L318 CarbonylContact C-O 3.44Å; E300-L318 VanDerWaalsContact CA-O 3.28Å; E300-L318 WeakPolarHBondContact CA-O 3.44Å
301	I	94.4	Very high	84	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.3	169.2	-59.5	156.7	0	0	0	107	S295 A296 T317 L318 L328 L332 I339 C341 W350	S295-I301 CarbonylContact O-C 3.59Å; S295-I301 VanDerWaalsContact O-CA 3.3Å; S295-I301 WeakPolarHBondContact O-CA 3.3Å; A296-I301 HydrophobicContact CB-CG1 3.99Å; I301-T317 CarbonylContact O-C 3.54Å; I301-T317 WeakPolarHBondContact O-CA 3.34Å; I301-L318 HydrophobicContact CB-CB 4.28Å; I301-L318 PolarHBondContact N-O 2.91Å; I301-L318 PolarHBondContact O-N 2.93Å; I301-L328 HydrophobicContact CD1-CD1 3.96Å; I301-L328 HydrophobicContact CG1-CD1 3.71Å; I301-L332 HydrophobicContact CD1-CD1 3.59Å; I301-L332 HydrophobicContact CG1-CD1 4.12Å; I301-L332 HydrophobicContact CG2-CD1 4.38Å; I301-L332 HydrophobicContact CG2-CD2 4.32Å; I301-I339 HydrophobicContact CD1-CG2 4.27Å; I301-C341 HydrophobicContact CD1-CB 4.06Å; I301-W350 HydrophobicContact CD1-CH2 4.43Å; I301-W350 HydrophobicContact CD1-CZ3 4.31Å
302	K	93.9	Very high	83.1	Confident	16 Å²	16	46.4 Å²	46.4	7%	0.07	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	141.6	175.8	-65.8	-172.8	-168.8	-62.9	0	110.5	G266 L294 S295 E300 W304 K316 T317	G266-K302 VanDerWaalsContact C-CE 3.43Å; G266-K302 VanDerWaalsContact O-CE 3.24Å; G266-K302 WeakPolarHBondContact O-CE 3.36Å; L294-K302 WeakPolarHBondContact CA-O 3.2Å; S295-K302 PolarHBondContact N-O 3.24Å; S295-K302 PolarHBondContact O-N 3.11Å; E300-K302 VanDerWaalsContact CD-CE 3.41Å; E300-K302 WeakPolarHBondContact OE1-CE 3.28Å; E300-K302 IonicContact OE1-NZ 2.77Å; E300-K302 PolarHBondContact OE1-NZ 2.86Å; E300-K302 IonicContact OE2-NZ 3.74Å; E300-K302 PolarHBondContact OE2-NZ 2.92Å; K302-W304 HydrophobicContact CB-CZ2 3.81Å; K302-W304 HydrophobicContact CD-CH2 4.21Å; K302-W304 HydrophobicContact CD-CZ2 3.59Å; K302-W304 HydrophobicContact CG-CZ2 4.35Å; K302-K316 WeakPolarHBondContact CA-O 2.98Å; K302-T317 HydrophobicContact CG-CG2 4.3Å; K302-T317 PolarHBondContact NZ-OG1 2.79Å; K302-T317 VanDerWaalsContact NZ-OG1 3.11Å
303	I	92.9	Very high	82.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.6	-178.9	-48.4	-175.6	0	0	0	108.2	I292 L294 L315 K316 L318 I339 F352 Y355	I292-I303 HydrophobicContact CG2-CG2 3.52Å; L294-I303 HydrophobicContact CD2-CB 4.11Å; L294-I303 HydrophobicContact CD2-CD1 4.23Å; L294-I303 HydrophobicContact CD2-CG1 3.63Å; L294-I303 HydrophobicContact CD2-CG2 3.97Å; I303-L315 HydrophobicContact CG2-CD1 4.32Å; I303-L315 PolarHBondContact O-N 3.25Å; I303-K316 HydrophobicContact CD1-CB 4.22Å; I303-K316 HydrophobicContact CG1-CB 4.49Å; I303-K316 PolarHBondContact N-O 3.5Å; I303-L318 HydrophobicContact CD1-CD1 4.02Å; I303-L318 HydrophobicContact CD1-CD2 4.5Å; I303-L318 HydrophobicContact CD1-CG 4.2Å; I303-I339 HydrophobicContact CD1-CD1 3.98Å; I303-F352 HydrophobicContact CD1-CE2 4.03Å; I303-F352 HydrophobicContact CG2-CE2 4.1Å; I303-F352 HydrophobicContact CG2-CZ 4.21Å; I303-Y355 HydrophobicContact CD1-CD1 3.53Å; I303-Y355 HydrophobicContact CD1-CE1 3.33Å
304	W	91	Very high	82.5	Confident	9 Å²	9	56.9 Å²	56.9	3%	0.034	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.1	-177.2	-44.8	85.5	0	0	0	109.6	L264 L293 S295 K302 I306 C314	L264-W304 HydrophobicContact CB-CD2 4.34Å; L264-W304 HydrophobicContact CB-CE3 4.11Å; L264-W304 HydrophobicContact CB-CH2 3.86Å; L264-W304 HydrophobicContact CB-CZ2 4.06Å; L264-W304 HydrophobicContact CB-CZ3 3.87Å; L264-W304 HydrophobicContact CD1-CB 4.24Å; L264-W304 HydrophobicContact CD1-CD2 3.75Å; L264-W304 HydrophobicContact CD1-CE3 3.97Å; L264-W304 HydrophobicContact CD1-CG 3.86Å; L264-W304 HydrophobicContact CD2-CE3 4.03Å; L264-W304 HydrophobicContact CD2-CZ3 4.24Å; L264-W304 HydrophobicContact CG-CD2 4.46Å; L264-W304 HydrophobicContact CG-CE3 4.26Å; L264-W304 HydrophobicContact CG-CZ3 4.45Å; L293-W304 HydrophobicContact CB-CB 4.13Å; L293-W304 HydrophobicContact CD2-CB 4.37Å; L293-W304 HydrophobicContact CD2-CG 4.41Å; L293-W304 HydrophobicContact CG-CB 4.46Å; L293-W304 PolarHBondContact N-O 2.9Å; L293-W304 PolarHBondContact O-N 3.41Å; S295-W304 PolarHBondContact OG-NE1 2.82Å; K302-W304 HydrophobicContact CB-CZ2 3.81Å; K302-W304 HydrophobicContact CD-CH2 4.21Å; K302-W304 HydrophobicContact CD-CZ2 3.59Å; K302-W304 HydrophobicContact CG-CZ2 4.35Å; W304-I306 PolarHBondContact O-N 2.87Å; W304-C314 HydrophobicContact CD2-CB 4.36Å; W304-C314 HydrophobicContact CE3-CB 3.83Å; W304-C314 HydrophobicContact CH2-CB 3.82Å; W304-C314 HydrophobicContact CZ2-CB 4.36Å; W304-C314 HydrophobicContact CZ3-CB 3.54Å
305	P	88.6	Confident	82.2	Confident	46 Å²	46	59.7 Å²	59.7	30%	0.299	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	122.9	172.3	27.5	-17.8	0	0	0	107.9	C312 K313 L315	P305-C312 WeakPolarHBondContact O-CB 3.42Å; P305-C312 PolarHBondContact O-SG 2.98Å; P305-K313 WeakPolarHBondContact CD-O 3.24Å; P305-L315 HydrophobicContact CB-CD1 3.9Å; P305-L315 HydrophobicContact CB-CG 4.39Å; P305-L315 HydrophobicContact CG-CD1 3.87Å; P305-L315 HydrophobicContact CG-CD2 4.17Å; P305-L315 HydrophobicContact CG-CG 3.8Å
306	I	83.3	Confident	82	Confident	7 Å²	7	64.4 Å²	64.4	4%	0.036	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	95.5	174.2	-60	-57.5	0	0	0	106.9	L238 I240 V252 L276 Y291 L293 W304 C312	L238-I306 HydrophobicContact CD1-CG2 4.31Å; I240-I306 HydrophobicContact CD1-CG2 3.53Å; V252-I306 HydrophobicContact CG2-CD1 4.31Å; L276-I306 HydrophobicContact CD1-CB 4.16Å; L276-I306 HydrophobicContact CD1-CG1 4.01Å; L276-I306 HydrophobicContact CD1-CG2 4.3Å; Y291-I306 WeakPolarHBondContact CB-O 3.43Å; Y291-I306 PolarHBondContact O-N 3.08Å; L293-I306 HydrophobicContact CB-CD1 3.97Å; L293-I306 HydrophobicContact CB-CG1 3.45Å; L293-I306 VanDerWaalsContact CB-CG1 3.45Å; L293-I306 HydrophobicContact CD2-CD1 3.94Å; L293-I306 HydrophobicContact CD2-CG1 4.29Å; W304-I306 PolarHBondContact O-N 2.87Å; I306-C312 HydrophobicContact CD1-CB 4.49Å
307	G	70.8	Confident	81.9	Confident	45 Å²	45	66.8 Å²	66.8	46%	0.464	33%	0.328	S	S	.	.	S	Bend	trans	-111.8	-164.6	173.9	0	0	0	0	0	111.4	E309	G307-E309 PolarHBondContact O-N 3.16Å
308	R	57.5	Low	81.8	Confident	256 Å²	256	67 Å²	67	97%	0.966	33%	0.329	S	S	*	.	S	Bend	trans	-70.3	-14.2	171.2	-67.6	-177	-178.7	-177.5	0.2	113.2
309	E	58.8	Low	81.8	Confident	159 Å²	159	65.3 Å²	65.3	74%	0.743	33%	0.33	S	S	*	.			trans	-81.8	131.5	179.1	-67.1	-172.9	-179.9	0	0	111.4	G307 N311	G307-E309 PolarHBondContact O-N 3.16Å; E309-N311 VanDerWaalsContact C-N 3.31Å; E309-N311 PolarHBondContact O-N 2.77Å
310	I	56	Low	81.4	Confident	109 Å²	109	64.4 Å²	64.4	56%	0.559	33%	0.328	S	S	*	.	S	Bend	trans	-73.2	-24.7	-174.4	-59.3	169.3	0	0	0	111.4	L261 N262 C312	L261-I310 VanDerWaalsContact O-CG2 3.27Å; L261-I310 WeakPolarHBondContact O-CG2 3.43Å; N262-I310 VanDerWaalsContact CG-O 3.29Å; N262-I310 PolarHBondContact ND2-O 2.77Å; I310-C312 PolarHBondContact O-N 2.78Å
311	N	63	Low	80.8	Confident	135 Å²	135	65.5 Å²	65.5	72%	0.722	34%	0.339	S	S	*	.			trans	-95.5	75.9	-177.3	-83.8	-17.1	0	0	0	112.8	E309 K313	E309-N311 VanDerWaalsContact C-N 3.31Å; E309-N311 PolarHBondContact O-N 2.77Å; N311-K313 PolarHBondContact O-N 2.95Å
312	C	69.3	Low	80	Confident	20 Å²	20	74.6 Å²	74.6	14%	0.135	38%	0.381	C	S	.	.			trans	-75.3	109.1	175.1	-43.3	0	0	0	0	110.2	N262 L264 P305 I306 I310	N262-C312 PolarHBondContact ND2-N 3.3Å; L264-C312 HydrophobicContact CD2-CB 3.95Å; P305-C312 WeakPolarHBondContact O-CB 3.42Å; P305-C312 PolarHBondContact O-SG 2.98Å; I306-C312 HydrophobicContact CD1-CB 4.49Å; I310-C312 PolarHBondContact O-N 2.78Å
313	K	82.1	Confident	79.3	Confident	176 Å²	176	78 Å²	78	77%	0.765	40%	0.4	S	S	*	.			trans	-84.3	149.2	167.1	-71.5	-175.8	179.3	178.4	0	110.1	P305 N311 L315	P305-K313 WeakPolarHBondContact CD-O 3.24Å; N311-K313 PolarHBondContact O-N 2.95Å; K313-L315 PolarHBondContact O-N 2.86Å
314	C	87.2	Confident	78.7	Confident	46 Å²	46	85.3 Å²	85.3	31%	0.311	43%	0.428	S	S	.	.			trans	-63.4	122	174.2	-174.7	0	0	0	0	109.6	W304 K316	W304-C314 HydrophobicContact CD2-CB 4.36Å; W304-C314 HydrophobicContact CE3-CB 3.83Å; W304-C314 HydrophobicContact CH2-CB 3.82Å; W304-C314 HydrophobicContact CZ2-CB 4.36Å; W304-C314 HydrophobicContact CZ3-CB 3.54Å; C314-K316 PolarHBondContact SG-O 3.33Å; C314-K316 VanDerWaalsContact SG-O 3.32Å
315	L	86.3	Confident	78.1	Confident	58 Å²	58	89 Å²	89	30%	0.304	46%	0.455	S	S	.	.			trans	-72.2	-47.5	176.6	-75.8	169.7	0	0	0	110.9	M285 I303 P305 K313	M285-L315 HydrophobicContact CB-CD2 4.43Å; I303-L315 HydrophobicContact CG2-CD1 4.32Å; I303-L315 PolarHBondContact O-N 3.25Å; P305-L315 HydrophobicContact CB-CD1 3.9Å; P305-L315 HydrophobicContact CB-CG 4.39Å; P305-L315 HydrophobicContact CG-CD1 3.87Å; P305-L315 HydrophobicContact CG-CD2 4.17Å; P305-L315 HydrophobicContact CG-CG 3.8Å; K313-L315 PolarHBondContact O-N 2.86Å
316	K	89.4	Confident	77.8	Confident	99 Å²	99	88 Å²	88	43%	0.43	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	144.8	-175	-164.7	69.2	175.6	-173	0	110.4	K302 I303 C314 L318 Y355	K302-K316 WeakPolarHBondContact CA-O 2.98Å; I303-K316 HydrophobicContact CD1-CB 4.22Å; I303-K316 HydrophobicContact CG1-CB 4.49Å; I303-K316 PolarHBondContact N-O 3.5Å; C314-K316 PolarHBondContact SG-O 3.33Å; C314-K316 VanDerWaalsContact SG-O 3.32Å; K316-L318 HydrophobicContact CG-CD2 3.82Å; K316-Y355 HydrophobicContact CB-CD2 4.29Å; K316-Y355 HydrophobicContact CB-CE2 4.38Å; K316-Y355 HydrophobicContact CB-CG 4.4Å; K316-Y355 HydrophobicContact CD-CD2 4.42Å; K316-Y355 HydrophobicContact CG-CD2 4.08Å; K316-Y355 HydrophobicContact CG-CG 4.01Å
317	T	92.1	Very high	77.8	Confident	57 Å²	57	89.5 Å²	89.5	35%	0.35	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.7	167.2	-62.8	0	0	0	0	107.5	E300 I301 K302	E300-T317 HydrophobicContact CB-CG2 3.76Å; E300-T317 HydrophobicContact CG-CG2 4.45Å; E300-T317 WeakPolarHBondContact OE2-CG2 3.18Å; I301-T317 CarbonylContact O-C 3.54Å; I301-T317 WeakPolarHBondContact O-CA 3.34Å; K302-T317 HydrophobicContact CG-CG2 4.3Å; K302-T317 PolarHBondContact NZ-OG1 2.79Å; K302-T317 VanDerWaalsContact NZ-OG1 3.11Å
318	L	90.3	Very high	78.5	Confident	6 Å²	6	88 Å²	88	3%	0.031	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	134.5	175	-50	179.6	0	0	0	108.7	E300 I301 I303 K316 I339 W350 Y355	E300-L318 CarbonylContact C-O 3.44Å; E300-L318 VanDerWaalsContact CA-O 3.28Å; E300-L318 WeakPolarHBondContact CA-O 3.44Å; I301-L318 HydrophobicContact CB-CB 4.28Å; I301-L318 PolarHBondContact N-O 2.91Å; I301-L318 PolarHBondContact O-N 2.93Å; I303-L318 HydrophobicContact CD1-CD1 4.02Å; I303-L318 HydrophobicContact CD1-CD2 4.5Å; I303-L318 HydrophobicContact CD1-CG 4.2Å; K316-L318 HydrophobicContact CG-CD2 3.82Å; L318-I339 HydrophobicContact CD1-CD1 3.77Å; L318-W350 HydrophobicContact CD1-CB 4.37Å; L318-W350 HydrophobicContact CD1-CD2 4.35Å; L318-W350 HydrophobicContact CD1-CG 4.06Å; L318-Y355 HydrophobicContact CD2-CD1 4.47Å; L318-Y355 HydrophobicContact CD2-CG 4.49Å
319	S	88	Confident	79.7	Confident	58 Å²	58	76.6 Å²	76.6	41%	0.406	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154.7	171.4	57.7	0	0	0	0	109.2
320	V	83.1	Confident	80.5	Confident	23 Å²	23	70.1 Å²	70.1	14%	0.139	37%	0.368	C	S	.	.	S	Bend	trans	-82	-35	177	162	0	0	0	0	111.5	I326 L328 Y348 W350	V320-I326 HydrophobicContact CG1-CG2 4.03Å; V320-L328 HydrophobicContact CB-CD2 4.35Å; V320-L328 HydrophobicContact CG2-CD2 3.49Å; V320-L328 VanDerWaalsContact CG2-CD2 3.49Å; V320-Y348 HydrophobicContact CB-CD1 4.49Å; V320-Y348 HydrophobicContact CB-CE1 4.32Å; V320-Y348 HydrophobicContact CG1-CD1 4.12Å; V320-Y348 HydrophobicContact CG1-CD2 4.15Å; V320-Y348 HydrophobicContact CG1-CE1 3.52Å; V320-Y348 HydrophobicContact CG1-CE2 3.61Å; V320-Y348 HydrophobicContact CG1-CG 4.4Å; V320-Y348 WeakPolarHBondContact CG1-OH 3.45Å; V320-Y348 HydrophobicContact CG2-CD1 3.89Å; V320-Y348 HydrophobicContact CG2-CD2 3.8Å; V320-Y348 HydrophobicContact CG2-CE1 4.17Å; V320-Y348 HydrophobicContact CG2-CE2 4.14Å; V320-Y348 HydrophobicContact CG2-CG 3.69Å; V320-W350 HydrophobicContact CG2-CH2 3.56Å; V320-W350 HydrophobicContact CG2-CZ2 3.65Å
321	S	79.1	Confident	81.8	Confident	50 Å²	50	66.2 Å²	66.2	35%	0.35	35%	0.347	S	S	.	.			trans	-152.8	154.6	-178.3	-175.1	0	0	0	0	109.2	D323	S321-D323 PolarHBondContact OG-N 2.71Å; S321-D323 VanDerWaalsContact OG-N 3.07Å
322	E	76.6	Confident	83	Confident	191 Å²	191	60.5 Å²	60.5	89%	0.893	32%	0.316	S	S	*	.	S	Bend	trans	-72.7	-21	166.6	-63.5	-174.7	171.2	0	0	111.5	R324	E322-R324 PolarHBondContact O-N 3.37Å
323	D	79.9	Confident	83.9	Confident	87 Å²	87	61.1 Å²	61.1	47%	0.465	32%	0.317	S	S	.	.			trans	-75.6	113.4	176.2	-175.9	9.2	0	0	0	111.4	S321 S325 I326	S321-D323 PolarHBondContact OG-N 2.71Å; S321-D323 VanDerWaalsContact OG-N 3.07Å; D323-S325 PolarHBondContact O-N 3.44Å; D323-S325 VanDerWaalsContact O-N 3.12Å; D323-S325 WeakPolarHBondContact OD1-CB 3.28Å; D323-S325 PolarHBondContact OD1-N 2.74Å; D323-S325 PolarHBondContact OD1-OG 3.48Å; D323-S325 WeakPolarHBondContact OD2-CB 3.44Å; D323-S325 PolarHBondContact OD2-OG 2.99Å; D323-I326 HydrophobicContact CB-CD1 4.4Å; D323-I326 PolarHBondContact O-N 2.96Å; D323-I326 VanDerWaalsContact O-N 3.15Å
324	R	80.1	Confident	84.1	Confident	154 Å²	154	53.4 Å²	53.4	58%	0.581	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	3.7	177.1	-65.9	-172.8	174.1	-153	-4.9	114	Y299 E322 I326	Y299-R324 HydrophobicContact CE1-CB 4.14Å; Y299-R324 WeakPolarHBondContact CE1-O 3.39Å; Y299-R324 PolarHBondContact OH-O 2.61Å; Y299-R324 VanDerWaalsContact OH-O 3.14Å; E322-R324 PolarHBondContact O-N 3.37Å; R324-I326 VanDerWaalsContact C-N 3.3Å
325	S	79.3	Confident	83.9	Confident	86 Å²	86	53 Å²	53	60%	0.601	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.9	165.6	81.7	0	0	0	0	112.1	D323	D323-S325 PolarHBondContact O-N 3.44Å; D323-S325 VanDerWaalsContact O-N 3.12Å; D323-S325 WeakPolarHBondContact OD1-CB 3.28Å; D323-S325 PolarHBondContact OD1-N 2.74Å; D323-S325 PolarHBondContact OD1-OG 3.48Å; D323-S325 WeakPolarHBondContact OD2-CB 3.44Å; D323-S325 PolarHBondContact OD2-OG 2.99Å
326	I	81.1	Confident	83.4	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.138	26%	0.264	C	S	.	.	S	Bend	trans	-94.3	110.4	-177.4	-60.7	151.8	0	0	0	109	V320 D323 R324 L345	V320-I326 HydrophobicContact CG1-CG2 4.03Å; D323-I326 HydrophobicContact CB-CD1 4.4Å; D323-I326 PolarHBondContact O-N 2.96Å; D323-I326 VanDerWaalsContact O-N 3.15Å; R324-I326 VanDerWaalsContact C-N 3.3Å; I326-L345 HydrophobicContact CD1-CD1 3.46Å; I326-L345 VanDerWaalsContact CD1-CD1 3.46Å; I326-L345 HydrophobicContact CD1-CG 4.24Å; I326-L345 HydrophobicContact CG1-CD1 3.96Å; I326-L345 HydrophobicContact CG1-CG 4.19Å; I326-L345 HydrophobicContact CG2-CD1 4.22Å; I326-L345 HydrophobicContact CG2-CG 4.18Å
327	S	83.6	Confident	83.1	Confident	37 Å²	37	50.2 Å²	50.2	26%	0.259	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-96.4	142.7	175.4	60.1	0	0	0	0	112.4	K298 S343	K298-S327 CarbonylContact O-C 3.57Å; K298-S327 VanDerWaalsContact O-CA 3.28Å; K298-S327 WeakPolarHBondContact O-CA 3.26Å; K298-S327 WeakPolarHBondContact O-CB 3.21Å; S327-S343 WeakPolarHBondContact O-CA 3.35Å; S327-S343 WeakPolarHBondContact O-CB 3.34Å
328	L	84.8	Confident	83	Confident	13 Å²	13	50 Å²	50	7%	0.068	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	144.8	159.8	-63.4	177.5	0	0	0	109.9	K298 I301 V320 C341 W350	K298-L328 PolarHBondContact O-N 3.5Å; I301-L328 HydrophobicContact CD1-CD1 3.96Å; I301-L328 HydrophobicContact CG1-CD1 3.71Å; V320-L328 HydrophobicContact CB-CD2 4.35Å; V320-L328 HydrophobicContact CG2-CD2 3.49Å; V320-L328 VanDerWaalsContact CG2-CD2 3.49Å; L328-C341 HydrophobicContact CD2-CB 4.45Å; L328-W350 HydrophobicContact CD2-CH2 4.49Å
329	Q	84.2	Confident	83	Confident	17 Å²	17	49.8 Å²	49.8	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	153.9	172.3	-68.2	-179.7	-7.1	0	0	109.6	R331 C341 S342 N368 V369 S370	Q329-R331 PolarHBondContact O-N 2.78Å; Q329-C341 PolarHBondContact O-SG 3.43Å; Q329-C341 VanDerWaalsContact O-SG 3.39Å; Q329-S342 WeakPolarHBondContact CB-O 3.46Å; Q329-S342 WeakPolarHBondContact CB-OG 3.22Å; Q329-S342 PolarHBondContact N-O 2.68Å; Q329-S342 VanDerWaalsContact OE1-CB 3.23Å; Q329-S342 PolarHBondContact OE1-OG 2.9Å; Q329-N368 PolarHBondContact NE2-OD1 3.35Å; Q329-V369 PolarHBondContact NE2-O 2.64Å; Q329-V369 PolarHBondContact OE1-O 3.35Å; Q329-S370 PolarHBondContact NE2-OG 3.38Å; Q329-S370 PolarHBondContact OE1-OG 3.25Å
330	P	74.6	Confident	83.2	Confident	23 Å²	23	47 Å²	47	15%	0.149	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	-2.3	-164.2	26	-37.1	0	0	0	115.6	R411 G412	P330-R411 VanDerWaalsContact CB-O 3.26Å; P330-R411 WeakPolarHBondContact CB-O 3.45Å; P330-G412 VanDerWaalsContact CG-N 3.34Å
331	R	84.3	Confident	83.5	Confident	28 Å²	28	46 Å²	46	11%	0.106	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	118.2	179.2	-78.9	-77.4	169.2	-175.2	-5	110.1	Q329 C341 L371 F415	Q329-R331 PolarHBondContact O-N 2.78Å; R331-C341 PolarHBondContact O-SG 3.15Å; R331-C341 VanDerWaalsContact O-SG 3.32Å; R331-L371 WeakPolarHBondContact CB-O 3.21Å; R331-L371 VanDerWaalsContact CG-O 3.29Å; R331-L371 WeakPolarHBondContact CG-O 3.3Å; R331-F415 HydrophobicContact CG-CE2 3.72Å; R331-F415 HydrophobicContact CG-CZ 4.33Å; R331-F415 PolarHBondContact NH2-O 3.08Å
332	L	87.3	Confident	83.8	Confident	15 Å²	15	43.6 Å²	43.6	8%	0.079	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.8	173	-174.4	67.2	0	0	0	108.4	K273 V275 L294 A296 I301 I339 C341	K273-L332 HydrophobicContact CG-CB 4.12Å; V275-L332 HydrophobicContact CG2-CD2 4.26Å; L294-L332 HydrophobicContact CB-CD2 3.76Å; L294-L332 HydrophobicContact CD1-CD2 4.18Å; A296-L332 HydrophobicContact CB-CD2 4.33Å; I301-L332 HydrophobicContact CD1-CD1 3.59Å; I301-L332 HydrophobicContact CG1-CD1 4.12Å; I301-L332 HydrophobicContact CG2-CD1 4.38Å; I301-L332 HydrophobicContact CG2-CD2 4.32Å; L332-I339 HydrophobicContact CD1-CG2 3.6Å; L332-C341 HydrophobicContact CD1-CB 4.21Å
333	H	88.3	Confident	84.3	Confident	33 Å²	33	34.6 Å²	34.6	15%	0.153	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.4	171.2	-179.9	89.1	0	0	0	109.5	I339 V340 L371 F374	H333-I339 WeakPolarHBondContact O-CA 3.27Å; H333-V340 HydrophobicContact CB-CB 4.33Å; H333-V340 PolarHBondContact N-O 2.83Å; H333-V340 PolarHBondContact O-N 3.38Å; H333-L371 HydrophobicContact CB-CD2 3.94Å; H333-F374 HydrophobicContact CB-CB 4.44Å; H333-F374 PolarHBondContact CE1-O 2.77Å; H333-F374 PolarHBondContact NE2-O 2.91Å
334	F	87.6	Confident	84.2	Confident	13 Å²	13	32.9 Å²	32.9	6%	0.057	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	125	174	-177.5	-128.8	0	0	0	108.6	Q277 L294 Y338 I339 F352	Q277-F334 HydrophobicContact CB-CD1 3.87Å; Q277-F334 HydrophobicContact CB-CE1 3.97Å; Q277-F334 HydrophobicContact CG-CD1 4.28Å; Q277-F334 HydrophobicContact CG-CE1 4.36Å; Q277-F334 PolarHBondContact OE1-O 2.96Å; L294-F334 HydrophobicContact CD1-CB 3.62Å; L294-F334 HydrophobicContact CD1-CD1 3.71Å; L294-F334 HydrophobicContact CD1-CD2 3.81Å; L294-F334 HydrophobicContact CD1-CE1 4.29Å; L294-F334 HydrophobicContact CD1-CE2 4.39Å; L294-F334 HydrophobicContact CD1-CG 3.44Å; L294-F334 VanDerWaalsContact CD1-CG 3.44Å; F334-Y338 WeakPolarHBondContact CD2-O 3.42Å; F334-I339 HydrophobicContact CD2-CG1 3.61Å; F334-I339 HydrophobicContact CE2-CG1 4Å; F334-F352 HydrophobicContact CD2-CD2 4.44Å; F334-F352 HydrophobicContact CE2-CB 4.13Å; F334-F352 HydrophobicContact CE2-CD1 4.18Å; F334-F352 AromaticContact CE2-CD2 3.45Å; F334-F352 HydrophobicContact CE2-CD2 3.45Å; F334-F352 VanDerWaalsContact CE2-CD2 3.45Å; F334-F352 AromaticContact CE2-CE2 3.92Å; F334-F352 HydrophobicContact CE2-CE2 3.92Å; F334-F352 AromaticContact CE2-CG 3.62Å; F334-F352 HydrophobicContact CE2-CG 3.62Å; F334-F352 HydrophobicContact CZ-CD1 4.11Å; F334-F352 AromaticContact CZ-CD2 3.87Å; F334-F352 HydrophobicContact CZ-CD2 3.87Å; F334-F352 HydrophobicContact CZ-CE1 4.17Å; F334-F352 AromaticContact CZ-CE2 3.91Å; F334-F352 HydrophobicContact CZ-CE2 3.91Å; F334-F352 AromaticContact CZ-CG 3.99Å; F334-F352 HydrophobicContact CZ-CG 3.99Å; F334-F352 HydrophobicContact CZ-CZ 4.1Å
335	D	81.2	Confident	84.2	Confident	39 Å²	39	29.5 Å²	29.5	21%	0.209	16%	0.162	C	C	.	.			trans	-108.9	2.4	-180	64.8	1.3	0	0	0	112.7	K280 K337 Y338	K280-D335 WeakPolarHBondContact CD-O 3.36Å; K280-D335 WeakPolarHBondContact CE-O 3.21Å; K280-D335 PolarHBondContact NZ-O 2.78Å; D335-K337 WeakPolarHBondContact OD1-CA 3.12Å; D335-K337 PolarHBondContact OD1-N 2.86Å; D335-Y338 PolarHBondContact N-O 2.79Å; D335-Y338 PolarHBondContact OD1-N 3.45Å
336	G	77.5	Confident	84.5	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	93.2	-8.2	-174	0	0	0	0	0	114.7	K280	K280-G336 PolarHBondContact N-O 3Å
337	K	83.3	Confident	84.9	Confident	97 Å²	97	24.8 Å²	24.8	42%	0.422	13%	0.132	S	C	.	.	S	Bend	trans	-123.3	-38.5	179.2	-178.1	178	-176.7	-171.3	0	112.7	V281 D335 F352	V281-K337 HydrophobicContact CG2-CB 3.91Å; V281-K337 HydrophobicContact CG2-CG 3.9Å; D335-K337 WeakPolarHBondContact OD1-CA 3.12Å; D335-K337 PolarHBondContact OD1-N 2.86Å; K337-F352 WeakPolarHBondContact O-CB 3.46Å; K337-F352 PolarHBondContact O-N 2.57Å
338	Y	89.1	Confident	85.2	Confident	54 Å²	54	23.8 Å²	23.8	21%	0.212	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.2	-178.9	-53.4	-60.2	0	0	0	110.5	F334 D335 Q349 W350 L358	F334-Y338 WeakPolarHBondContact CD2-O 3.42Å; D335-Y338 PolarHBondContact N-O 2.79Å; D335-Y338 PolarHBondContact OD1-N 3.45Å; Y338-Q349 HydrophobicContact CD1-CG 4.36Å; Y338-Q349 HydrophobicContact CG-CG 4.36Å; Y338-W350 WeakPolarHBondContact CA-O 3.31Å; Y338-L358 HydrophobicContact CD1-CD1 3.69Å; Y338-L358 HydrophobicContact CE1-CD1 3.44Å; Y338-L358 VanDerWaalsContact CE1-CD1 3.44Å
339	I	90.6	Very high	85.5	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129.7	164.5	-62.5	170	0	0	0	106.6	L294 I301 I303 L318 L332 H333 F334 Q349 W350 F352	L294-I339 HydrophobicContact CD1-CD1 3.96Å; L294-I339 HydrophobicContact CD1-CG1 3.92Å; L294-I339 HydrophobicContact CD2-CD1 3.77Å; I301-I339 HydrophobicContact CD1-CG2 4.27Å; I303-I339 HydrophobicContact CD1-CD1 3.98Å; L318-I339 HydrophobicContact CD1-CD1 3.77Å; L332-I339 HydrophobicContact CD1-CG2 3.6Å; H333-I339 WeakPolarHBondContact O-CA 3.27Å; F334-I339 HydrophobicContact CD2-CG1 3.61Å; F334-I339 HydrophobicContact CE2-CG1 4Å; I339-Q349 WeakPolarHBondContact O-CA 3.47Å; I339-W350 HydrophobicContact CB-CB 4.32Å; I339-W350 HydrophobicContact CB-CE3 4.48Å; I339-W350 HydrophobicContact CG2-CE3 4.2Å; I339-W350 PolarHBondContact N-O 3.4Å; I339-W350 VanDerWaalsContact N-O 3.1Å; I339-W350 PolarHBondContact O-N 2.75Å; I339-F352 HydrophobicContact CD1-CD2 3.59Å; I339-F352 HydrophobicContact CD1-CE2 3.95Å; I339-F352 HydrophobicContact CG1-CD2 3.92Å
340	V	90.8	Very high	85.9	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.2	177.1	-166.1	0	0	0	0	110.2	H333 Y348 Q349 L371 F374	H333-V340 HydrophobicContact CB-CB 4.33Å; H333-V340 PolarHBondContact N-O 2.83Å; H333-V340 PolarHBondContact O-N 3.38Å; V340-Y348 WeakPolarHBondContact CA-O 3.44Å; V340-Y348 WeakPolarHBondContact CG1-O 3.44Å; V340-Q349 HydrophobicContact CG2-CB 4.3Å; V340-Q349 HydrophobicContact CG2-CG 4.1Å; V340-L371 HydrophobicContact CB-CD2 3.97Å; V340-L371 HydrophobicContact CG1-CD2 3.74Å; V340-L371 WeakPolarHBondContact O-CD2 3.37Å; V340-F374 HydrophobicContact CB-CB 4.49Å; V340-F374 HydrophobicContact CB-CD2 4.4Å; V340-F374 HydrophobicContact CB-CG 4.26Å; V340-F374 HydrophobicContact CG1-CD2 3.78Å; V340-F374 HydrophobicContact CG1-CE2 4Å; V340-F374 HydrophobicContact CG1-CG 4.14Å; V340-F374 HydrophobicContact CG2-CB 4.45Å; V340-F374 HydrophobicContact CG2-CD1 3.75Å; V340-F374 HydrophobicContact CG2-CD2 4.27Å; V340-F374 HydrophobicContact CG2-CE1 3.95Å; V340-F374 HydrophobicContact CG2-CE2 4.44Å; V340-F374 HydrophobicContact CG2-CG 3.91Å; V340-F374 HydrophobicContact CG2-CZ 4.28Å
341	C	90	Very high	86.6	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.014	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	146	176.1	-168.4	0	0	0	0	110.2	I301 L328 Q329 R331 L332 Y348 W350	I301-C341 HydrophobicContact CD1-CB 4.06Å; L328-C341 HydrophobicContact CD2-CB 4.45Å; Q329-C341 PolarHBondContact O-SG 3.43Å; Q329-C341 VanDerWaalsContact O-SG 3.39Å; R331-C341 PolarHBondContact O-SG 3.15Å; R331-C341 VanDerWaalsContact O-SG 3.32Å; L332-C341 HydrophobicContact CD1-CB 4.21Å; C341-Y348 PolarHBondContact N-O 2.62Å; C341-Y348 VanDerWaalsContact N-O 3.1Å; C341-Y348 PolarHBondContact O-N 3.15Å; C341-W350 HydrophobicContact CB-CH2 4.4Å; C341-W350 HydrophobicContact CB-CZ3 3.9Å
342	S	86.8	Confident	86.8	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	146.6	172.4	46.5	0	0	0	0	111.2	Q329 L371	Q329-S342 WeakPolarHBondContact CB-O 3.46Å; Q329-S342 WeakPolarHBondContact CB-OG 3.22Å; Q329-S342 PolarHBondContact N-O 2.68Å; Q329-S342 VanDerWaalsContact OE1-CB 3.23Å; Q329-S342 PolarHBondContact OE1-OG 2.9Å; S342-L371 PolarHBondContact OG-N 2.88Å
343	S	86.1	Confident	86.7	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.007	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	179.3	166.9	76	0	0	0	0	110	S327 L345 G346 Y348	S327-S343 WeakPolarHBondContact O-CA 3.35Å; S327-S343 WeakPolarHBondContact O-CB 3.34Å; S343-L345 PolarHBondContact O-N 3.19Å; S343-L345 VanDerWaalsContact O-N 3.13Å; S343-L345 PolarHBondContact OG-N 3.05Å; S343-G346 PolarHBondContact N-O 3.18Å; S343-G346 PolarHBondContact O-N 3.29Å; S343-G346 PolarHBondContact OG-O 2.87Å; S343-Y348 WeakPolarHBondContact OG-CE2 3.23Å
344	A	78.5	Confident	86.6	Confident	51 Å²	51	23.5 Å²	23.5	42%	0.421	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.7	173.6	0	0	0	0	0	113.7
345	L	79.9	Confident	86.6	Confident	83 Å²	83	24.1 Å²	24.1	44%	0.435	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.9	-176.2	-63.4	-176	0	0	0	114.5	I326 S343 Y348	I326-L345 HydrophobicContact CD1-CD1 3.46Å; I326-L345 VanDerWaalsContact CD1-CD1 3.46Å; I326-L345 HydrophobicContact CD1-CG 4.24Å; I326-L345 HydrophobicContact CG1-CD1 3.96Å; I326-L345 HydrophobicContact CG1-CG 4.19Å; I326-L345 HydrophobicContact CG2-CD1 4.22Å; I326-L345 HydrophobicContact CG2-CG 4.18Å; S343-L345 PolarHBondContact O-N 3.19Å; S343-L345 VanDerWaalsContact O-N 3.13Å; S343-L345 PolarHBondContact OG-N 3.05Å; L345-Y348 HydrophobicContact CB-CE2 4.37Å
346	G	85.4	Confident	86.9	Confident	8 Å²	8	27.2 Å²	27.2	8%	0.082	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.8	-169.9	-176	0	0	0	0	0	113.3	S343 Y348 I361	S343-G346 PolarHBondContact N-O 3.18Å; S343-G346 PolarHBondContact O-N 3.29Å; S343-G346 PolarHBondContact OG-O 2.87Å; G346-Y348 WeakPolarHBondContact O-CD2 3.25Å; G346-I361 WeakPolarHBondContact CA-O 3.37Å
347	L	88.3	Confident	87.5	Confident	6 Å²	6	30.7 Å²	30.7	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.7	176.1	-65.2	156.7	0	0	0	109.8	V360 I361 L371 L381	L347-V360 CarbonylContact O-C 3.58Å; L347-V360 WeakPolarHBondContact O-CA 3.36Å; L347-I361 HydrophobicContact CB-CB 4.2Å; L347-I361 HydrophobicContact CD1-CB 4.45Å; L347-I361 PolarHBondContact N-O 3.27Å; L347-I361 PolarHBondContact O-N 3.38Å; L347-L371 HydrophobicContact CD2-CB 3.76Å; L347-L371 HydrophobicContact CD2-CD1 3.98Å; L347-L371 HydrophobicContact CD2-CG 4.3Å; L347-L381 HydrophobicContact CD1-CD1 3.75Å; L347-L381 HydrophobicContact CD1-CD2 3.53Å; L347-L381 HydrophobicContact CD1-CG 4.26Å; L347-L381 HydrophobicContact CD2-CD2 3.83Å; L347-L381 HydrophobicContact CG-CD2 4.24Å
348	Y	90.6	Very high	87.7	Confident	17 Å²	17	30.6 Å²	30.6	7%	0.067	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.8	-179.7	-70.3	-102.7	0	0	0	108.4	V320 V340 C341 S343 L345 G346 W350 I357 V360	V320-Y348 HydrophobicContact CB-CD1 4.49Å; V320-Y348 HydrophobicContact CB-CE1 4.32Å; V320-Y348 HydrophobicContact CG1-CD1 4.12Å; V320-Y348 HydrophobicContact CG1-CD2 4.15Å; V320-Y348 HydrophobicContact CG1-CE1 3.52Å; V320-Y348 HydrophobicContact CG1-CE2 3.61Å; V320-Y348 HydrophobicContact CG1-CG 4.4Å; V320-Y348 WeakPolarHBondContact CG1-OH 3.45Å; V320-Y348 HydrophobicContact CG2-CD1 3.89Å; V320-Y348 HydrophobicContact CG2-CD2 3.8Å; V320-Y348 HydrophobicContact CG2-CE1 4.17Å; V320-Y348 HydrophobicContact CG2-CE2 4.14Å; V320-Y348 HydrophobicContact CG2-CG 3.69Å; V340-Y348 WeakPolarHBondContact CA-O 3.44Å; V340-Y348 WeakPolarHBondContact CG1-O 3.44Å; C341-Y348 PolarHBondContact N-O 2.62Å; C341-Y348 VanDerWaalsContact N-O 3.1Å; C341-Y348 PolarHBondContact O-N 3.15Å; S343-Y348 WeakPolarHBondContact OG-CE2 3.23Å; L345-Y348 HydrophobicContact CB-CE2 4.37Å; G346-Y348 WeakPolarHBondContact O-CD2 3.25Å; Y348-W350 HydrophobicContact CD1-CZ2 4.46Å; Y348-W350 HydrophobicContact CG-CH2 4.05Å; Y348-W350 HydrophobicContact CG-CZ2 4.35Å; Y348-W350 VanDerWaalsContact O-CZ3 3.26Å; Y348-W350 WeakPolarHBondContact O-CZ3 2.93Å; Y348-I357 HydrophobicContact CD1-CD1 4.17Å; Y348-I357 HydrophobicContact CD1-CG2 4.42Å; Y348-V360 HydrophobicContact CD1-CG1 4.33Å; Y348-V360 HydrophobicContact CD1-CG2 3.77Å; Y348-V360 HydrophobicContact CE1-CG1 3.91Å; Y348-V360 HydrophobicContact CE1-CG2 3.75Å; Y348-V360 HydrophobicContact CE2-CG1 4.25Å
349	Q	92	Very high	87.6	Confident	14 Å²	14	32.6 Å²	32.6	7%	0.065	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116	175.1	178.9	179.9	5.8	0	0	108.4	Y338 I339 V340 L358 R359	Y338-Q349 HydrophobicContact CD1-CG 4.36Å; Y338-Q349 HydrophobicContact CG-CG 4.36Å; I339-Q349 WeakPolarHBondContact O-CA 3.47Å; V340-Q349 HydrophobicContact CG2-CB 4.3Å; V340-Q349 HydrophobicContact CG2-CG 4.1Å; Q349-L358 PolarHBondContact O-N 3.13Å; Q349-R359 HydrophobicContact CB-CB 4.1Å; Q349-R359 PolarHBondContact N-O 2.77Å; Q349-R359 PolarHBondContact O-N 3.29Å
350	W	92.1	Very high	87.5	Confident	6 Å²	6	35.3 Å²	35.3	2%	0.023	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	140.6	172.9	-65.3	-96.8	0	0	0	110.2	I301 L318 V320 L328 Y338 I339 C341 Y348 D356 I357	I301-W350 HydrophobicContact CD1-CH2 4.43Å; I301-W350 HydrophobicContact CD1-CZ3 4.31Å; L318-W350 HydrophobicContact CD1-CB 4.37Å; L318-W350 HydrophobicContact CD1-CD2 4.35Å; L318-W350 HydrophobicContact CD1-CG 4.06Å; V320-W350 HydrophobicContact CG2-CH2 3.56Å; V320-W350 HydrophobicContact CG2-CZ2 3.65Å; L328-W350 HydrophobicContact CD2-CH2 4.49Å; Y338-W350 WeakPolarHBondContact CA-O 3.31Å; I339-W350 HydrophobicContact CB-CB 4.32Å; I339-W350 HydrophobicContact CB-CE3 4.48Å; I339-W350 HydrophobicContact CG2-CE3 4.2Å; I339-W350 PolarHBondContact N-O 3.4Å; I339-W350 VanDerWaalsContact N-O 3.1Å; I339-W350 PolarHBondContact O-N 2.75Å; C341-W350 HydrophobicContact CB-CH2 4.4Å; C341-W350 HydrophobicContact CB-CZ3 3.9Å; Y348-W350 HydrophobicContact CD1-CZ2 4.46Å; Y348-W350 HydrophobicContact CG-CH2 4.05Å; Y348-W350 HydrophobicContact CG-CZ2 4.35Å; Y348-W350 VanDerWaalsContact O-CZ3 3.26Å; Y348-W350 WeakPolarHBondContact O-CZ3 2.93Å; W350-D356 CarbonylContact C-O 3.52Å; W350-D356 VanDerWaalsContact CA-O 3.3Å; W350-D356 WeakPolarHBondContact CA-O 3.5Å; W350-I357 HydrophobicContact CG-CG1 4.39Å; W350-I357 VanDerWaalsContact NE1-CG1 3.26Å
351	D	89.8	Confident	87.2	Confident	29 Å²	29	35.5 Å²	35.5	16%	0.155	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	128.4	162.9	-172.6	33.5	0	0	0	109	A353 S354 Y355 D356 L358	D351-A353 VanDerWaalsContact C-N 3.29Å; D351-A353 PolarHBondContact O-N 3.24Å; D351-A353 WeakPolarHBondContact OD2-CB 3.4Å; D351-A353 PolarHBondContact OD2-N 3.28Å; D351-S354 PolarHBondContact OD2-N 3.48Å; D351-Y355 WeakPolarHBondContact O-CA 3.49Å; D351-Y355 PolarHBondContact O-N 3.47Å; D351-D356 PolarHBondContact N-O 2.76Å; D351-L358 HydrophobicContact CB-CD1 3.6Å; D351-L358 HydrophobicContact CB-CD2 3.95Å; D351-L358 HydrophobicContact CB-CG 3.64Å
352	F	86.8	Confident	86.9	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-27.7	177.9	-169.8	-106.7	0	0	0	112.3	C279 H286 I292 L294 I303 F334 K337 I339 Y355	C279-F352 HydrophobicContact CB-CE1 4.3Å; C279-F352 VanDerWaalsContact SG-CD1 3.59Å; C279-F352 WeakPolarHBondContact SG-CE1 3.34Å; H286-F352 AromaticContact CD2-CE1 3.66Å; H286-F352 AromaticContact CE1-CD1 3.43Å; H286-F352 VanDerWaalsContact CE1-CD1 3.43Å; H286-F352 WeakPolarHBondContact CE1-CD1 3.42Å; H286-F352 AromaticContact CE1-CE1 3.26Å; H286-F352 WeakPolarHBondContact CE1-CE1 3.22Å; H286-F352 AromaticContact CG-CE1 3.97Å; H286-F352 AromaticContact ND1-CE1 3.76Å; H286-F352 AromaticContact NE2-CD1 3.57Å; H286-F352 AromaticContact NE2-CE1 3.19Å; H286-F352 WeakPolarHBondContact NE2-CE1 3.35Å; H286-F352 AromaticContact NE2-CZ 3.89Å; H286-F352 PolarHBondContact NE2-O 2.94Å; I292-F352 HydrophobicContact CB-CZ 4.41Å; I292-F352 HydrophobicContact CD1-CE1 3.35Å; I292-F352 HydrophobicContact CD1-CZ 3.25Å; I292-F352 HydrophobicContact CG1-CZ 4.36Å; I292-F352 HydrophobicContact CG2-CE2 4.36Å; I292-F352 HydrophobicContact CG2-CZ 3.87Å; L294-F352 HydrophobicContact CD2-CE2 4.37Å; I303-F352 HydrophobicContact CD1-CE2 4.03Å; I303-F352 HydrophobicContact CG2-CE2 4.1Å; I303-F352 HydrophobicContact CG2-CZ 4.21Å; F334-F352 HydrophobicContact CD2-CD2 4.44Å; F334-F352 HydrophobicContact CE2-CB 4.13Å; F334-F352 HydrophobicContact CE2-CD1 4.18Å; F334-F352 AromaticContact CE2-CD2 3.45Å; F334-F352 HydrophobicContact CE2-CD2 3.45Å; F334-F352 VanDerWaalsContact CE2-CD2 3.45Å; F334-F352 AromaticContact CE2-CE2 3.92Å; F334-F352 HydrophobicContact CE2-CE2 3.92Å; F334-F352 AromaticContact CE2-CG 3.62Å; F334-F352 HydrophobicContact CE2-CG 3.62Å; F334-F352 HydrophobicContact CZ-CD1 4.11Å; F334-F352 AromaticContact CZ-CD2 3.87Å; F334-F352 HydrophobicContact CZ-CD2 3.87Å; F334-F352 HydrophobicContact CZ-CE1 4.17Å; F334-F352 AromaticContact CZ-CE2 3.91Å; F334-F352 HydrophobicContact CZ-CE2 3.91Å; F334-F352 AromaticContact CZ-CG 3.99Å; F334-F352 HydrophobicContact CZ-CG 3.99Å; F334-F352 HydrophobicContact CZ-CZ 4.1Å; K337-F352 WeakPolarHBondContact O-CB 3.46Å; K337-F352 PolarHBondContact O-N 2.57Å; I339-F352 HydrophobicContact CD1-CD2 3.59Å; I339-F352 HydrophobicContact CD1-CE2 3.95Å; I339-F352 HydrophobicContact CG1-CD2 3.92Å; F352-Y355 HydrophobicContact CD2-CE1 4.19Å; F352-Y355 AromaticContact CE2-CE1 3.99Å; F352-Y355 HydrophobicContact CE2-CE1 3.99Å; F352-Y355 HydrophobicContact CZ-CE1 4.3Å; F352-Y355 WeakPolarHBondContact O-CD1 3.21Å; F352-Y355 WeakPolarHBondContact O-CE1 3.31Å
353	A	86.4	Confident	86	Confident	21 Å²	21	43.2 Å²	43.2	17%	0.174	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-45.1	-177.8	0	0	0	0	0	112.6	V281 S283 D351	V281-A353 HydrophobicContact CG1-CB 3.68Å; S283-A353 WeakPolarHBondContact CB-O 3.4Å; S283-A353 PolarHBondContact OG-O 2.92Å; D351-A353 VanDerWaalsContact C-N 3.29Å; D351-A353 PolarHBondContact O-N 3.24Å; D351-A353 WeakPolarHBondContact OD2-CB 3.4Å; D351-A353 PolarHBondContact OD2-N 3.28Å
354	S	85.8	Confident	84.7	Confident	53 Å²	53	48.3 Å²	48.3	37%	0.371	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-20.4	-179.8	85.6	0	0	0	0	114.2	D351 D356	D351-S354 PolarHBondContact OD2-N 3.48Å; S354-D356 VanDerWaalsContact CB-OD2 3.26Å; S354-D356 WeakPolarHBondContact CB-OD2 3.4Å; S354-D356 PolarHBondContact O-N 3.1Å; S354-D356 WeakPolarHBondContact OG-CB 3.46Å; S354-D356 VanDerWaalsContact OG-CG 3.31Å; S354-D356 PolarHBondContact OG-N 2.94Å; S354-D356 VanDerWaalsContact OG-N 3.11Å; S354-D356 PolarHBondContact OG-OD2 3.14Å
355	Y	86.9	Confident	83.9	Confident	25 Å²	25	51.6 Å²	51.6	10%	0.098	28%	0.275	C	S	.	.			trans	67	9.8	-169.3	-52.3	-57.9	0	0	0	115.3	H286 I303 K316 L318 D351 F352	H286-Y355 PolarHBondContact CD2-OH 3.26Å; H286-Y355 PolarHBondContact NE2-OH 3.28Å; I303-Y355 HydrophobicContact CD1-CD1 3.53Å; I303-Y355 HydrophobicContact CD1-CE1 3.33Å; K316-Y355 HydrophobicContact CB-CD2 4.29Å; K316-Y355 HydrophobicContact CB-CE2 4.38Å; K316-Y355 HydrophobicContact CB-CG 4.4Å; K316-Y355 HydrophobicContact CD-CD2 4.42Å; K316-Y355 HydrophobicContact CG-CD2 4.08Å; K316-Y355 HydrophobicContact CG-CG 4.01Å; L318-Y355 HydrophobicContact CD2-CD1 4.47Å; L318-Y355 HydrophobicContact CD2-CG 4.49Å; D351-Y355 WeakPolarHBondContact O-CA 3.49Å; D351-Y355 PolarHBondContact O-N 3.47Å; F352-Y355 HydrophobicContact CD2-CE1 4.19Å; F352-Y355 AromaticContact CE2-CE1 3.99Å; F352-Y355 HydrophobicContact CE2-CE1 3.99Å; F352-Y355 HydrophobicContact CZ-CE1 4.3Å; F352-Y355 WeakPolarHBondContact O-CD1 3.21Å; F352-Y355 WeakPolarHBondContact O-CE1 3.31Å
356	D	87.9	Confident	83.1	Confident	104 Å²	104	51 Å²	51	56%	0.556	27%	0.269	S	S	*	.			trans	-84.9	153.8	177.4	-57.8	-54	0	0	0	111.6	W350 D351 S354 L358	W350-D356 CarbonylContact C-O 3.52Å; W350-D356 VanDerWaalsContact CA-O 3.3Å; W350-D356 WeakPolarHBondContact CA-O 3.5Å; D351-D356 PolarHBondContact N-O 2.76Å; S354-D356 VanDerWaalsContact CB-OD2 3.26Å; S354-D356 WeakPolarHBondContact CB-OD2 3.4Å; S354-D356 PolarHBondContact O-N 3.1Å; S354-D356 WeakPolarHBondContact OG-CB 3.46Å; S354-D356 VanDerWaalsContact OG-CG 3.31Å; S354-D356 PolarHBondContact OG-N 2.94Å; S354-D356 VanDerWaalsContact OG-N 3.11Å; S354-D356 PolarHBondContact OG-OD2 3.14Å; D356-L358 PolarHBondContact O-N 2.84Å
357	I	89.7	Confident	81.9	Confident	73 Å²	73	56.2 Å²	56.2	37%	0.374	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	112.7	172.6	-62.8	166.9	0	0	0	108.1	Y348 W350 V360	Y348-I357 HydrophobicContact CD1-CD1 4.17Å; Y348-I357 HydrophobicContact CD1-CG2 4.42Å; W350-I357 HydrophobicContact CG-CG1 4.39Å; W350-I357 VanDerWaalsContact NE1-CG1 3.26Å; I357-V360 HydrophobicContact CG2-CG2 3.53Å
358	L	88.6	Confident	81	Confident	96 Å²	96	60.5 Å²	60.5	50%	0.503	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-42.4	175.6	-70.9	175.6	0	0	0	112	Y338 Q349 D351 D356	Y338-L358 HydrophobicContact CD1-CD1 3.69Å; Y338-L358 HydrophobicContact CE1-CD1 3.44Å; Y338-L358 VanDerWaalsContact CE1-CD1 3.44Å; Q349-L358 PolarHBondContact O-N 3.13Å; D351-L358 HydrophobicContact CB-CD1 3.6Å; D351-L358 HydrophobicContact CB-CD2 3.95Å; D351-L358 HydrophobicContact CB-CG 3.64Å; D356-L358 PolarHBondContact O-N 2.84Å
359	R	86.4	Confident	80.5	Confident	96 Å²	96	60.4 Å²	60.4	36%	0.362	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	138	-171.1	-162.1	-176.1	-68.2	-166.2	1.9	110.8	Q349 I361 L392 E395	Q349-R359 HydrophobicContact CB-CB 4.1Å; Q349-R359 PolarHBondContact N-O 2.77Å; Q349-R359 PolarHBondContact O-N 3.29Å; R359-I361 HydrophobicContact CG-CG1 3.88Å; R359-L392 PolarHBondContact NH1-O 3Å; R359-E395 IonicContact NH1-OE1 3.5Å
360	V	88.4	Confident	80.1	Confident	57 Å²	57	59.8 Å²	59.8	35%	0.345	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	105.9	169.4	-176.4	0	0	0	0	108	L347 Y348 I357 K362	L347-V360 CarbonylContact O-C 3.58Å; L347-V360 WeakPolarHBondContact O-CA 3.36Å; Y348-V360 HydrophobicContact CD1-CG1 4.33Å; Y348-V360 HydrophobicContact CD1-CG2 3.77Å; Y348-V360 HydrophobicContact CE1-CG1 3.91Å; Y348-V360 HydrophobicContact CE1-CG2 3.75Å; Y348-V360 HydrophobicContact CE2-CG1 4.25Å; I357-V360 HydrophobicContact CG2-CG2 3.53Å; V360-K362 HydrophobicContact CG1-CG 4.28Å
361	I	84.9	Confident	80	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.015	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.7	-179.8	-52.4	171.9	0	0	0	108	G346 L347 R359 P363 F374 M390 L392 E395	G346-I361 WeakPolarHBondContact CA-O 3.37Å; L347-I361 HydrophobicContact CB-CB 4.2Å; L347-I361 HydrophobicContact CD1-CB 4.45Å; L347-I361 PolarHBondContact N-O 3.27Å; L347-I361 PolarHBondContact O-N 3.38Å; R359-I361 HydrophobicContact CG-CG1 3.88Å; I361-P363 WeakPolarHBondContact O-CD 3.33Å; I361-F374 HydrophobicContact CD1-CE2 4.47Å; I361-M390 HydrophobicContact CG2-CE 4.33Å; I361-M390 HydrophobicContact CG2-SD 3.76Å; I361-L392 HydrophobicContact CD1-CD2 3.59Å; I361-E395 HydrophobicContact CG2-CB 4.42Å; I361-E395 HydrophobicContact CG2-CG 4.39Å
362	K	82.9	Confident	80	Confident	138 Å²	138	58.6 Å²	58.6	60%	0.6	32%	0.319	S	S	*	.			trans	-105.7	103.1	176.1	-63.2	-172.2	179.5	176.3	0	108.7	V360 P364	V360-K362 HydrophobicContact CG1-CG 4.28Å; K362-P364 WeakPolarHBondContact O-CD 3.43Å
363	P	68.4	Low	80.1	Confident	27 Å²	27	58.6 Å²	58.6	18%	0.175	32%	0.319	C	S	.	.			trans	-60.9	125.5	176.4	18.7	-24.4	0	0	0	109.2	I361 D365 V369 M390	I361-P363 WeakPolarHBondContact O-CD 3.33Å; P363-D365 VanDerWaalsContact C-N 3.26Å; P363-D365 PolarHBondContact O-N 3.1Å; P363-V369 HydrophobicContact CG-CG2 4.37Å; P363-M390 HydrophobicContact CB-CE 4.05Å
364	P	59	Low	80.3	Confident	107 Å²	107	58.1 Å²	58.1	70%	0.695	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-24.1	-170.7	21.6	-31.3	0	0	0	114	K362	K362-P364 WeakPolarHBondContact O-CD 3.43Å
365	D	62	Low	80.5	Confident	121 Å²	121	55.9 Å²	55.9	65%	0.647	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-8.8	-163.9	-61.4	-35.3	0	0	0	115.3	P363	P363-D365 VanDerWaalsContact C-N 3.26Å; P363-D365 PolarHBondContact O-N 3.1Å
366	F	61.8	Low	80.5	Confident	71 Å²	71	61.8 Å²	61.8	31%	0.311	33%	0.327	S	S	.	.			trans	-142.2	125.5	-171.9	-55.3	-74	0	0	0	112.9	V369 Y388	F366-V369 HydrophobicContact CB-CG2 3.46Å; F366-V369 VanDerWaalsContact CB-CG2 3.46Å; F366-V369 HydrophobicContact CG-CG2 4.34Å; F366-Y388 HydrophobicContact CD2-CE1 4Å; F366-Y388 HydrophobicContact CE1-CE1 4.4Å; F366-Y388 WeakPolarHBondContact CE1-OH 3.42Å; F366-Y388 HydrophobicContact CE2-CD1 4.29Å; F366-Y388 AromaticContact CE2-CE1 3.49Å; F366-Y388 HydrophobicContact CE2-CE1 3.49Å; F366-Y388 VanDerWaalsContact CE2-CE1 3.49Å; F366-Y388 AromaticContact CE2-CZ 3.92Å; F366-Y388 AromaticContact CZ-CE1 3.73Å; F366-Y388 HydrophobicContact CZ-CE1 3.73Å
367	S	60.3	Low	80.6	Confident	117 Å²	117	58 Å²	58	82%	0.818	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	137.3	166.2	56.2	0	0	0	0	109.9
368	N	70.8	Confident	80.7	Confident	96 Å²	96	54.7 Å²	54.7	51%	0.513	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	34.2	170	-152.3	17.9	0	0	0	117.3	Q329	Q329-N368 PolarHBondContact NE2-OD1 3.35Å
369	V	79.8	Confident	80.9	Confident	14 Å²	14	50.1 Å²	50.1	9%	0.085	27%	0.266	C	S	.	.			trans	-69.6	144.2	169.7	-176.4	0	0	0	0	110.7	Q329 P363 F366 L381 Y388	Q329-V369 PolarHBondContact NE2-O 2.64Å; Q329-V369 PolarHBondContact OE1-O 3.35Å; P363-V369 HydrophobicContact CG-CG2 4.37Å; F366-V369 HydrophobicContact CB-CG2 3.46Å; F366-V369 VanDerWaalsContact CB-CG2 3.46Å; F366-V369 HydrophobicContact CG-CG2 4.34Å; V369-L381 HydrophobicContact CG1-CB 3.56Å; V369-L381 HydrophobicContact CG1-CD1 4.15Å; V369-L381 HydrophobicContact CG1-CG 4.33Å; V369-Y388 HydrophobicContact CG1-CD2 4.43Å
370	S	84.2	Confident	81.1	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.014	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142.6	178.5	-67.3	0	0	0	0	114.2	Q329 L381 F382 K408	Q329-S370 PolarHBondContact NE2-OG 3.38Å; Q329-S370 PolarHBondContact OE1-OG 3.25Å; S370-L381 CarbonylContact O-C 3.46Å; S370-L381 VanDerWaalsContact O-CA 3.23Å; S370-L381 WeakPolarHBondContact O-CA 3.45Å; S370-F382 PolarHBondContact N-O 2.85Å; S370-F382 VanDerWaalsContact O-CD1 3.3Å; S370-F382 WeakPolarHBondContact O-CD1 3.25Å; S370-F382 PolarHBondContact O-N 3.47Å; S370-K408 PolarHBondContact OG-NZ 2.9Å
371	L	89.6	Confident	81.3	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130	171.3	-175.9	63.7	0	0	0	110.1	R331 H333 V340 S342 L347 G373 F374 L381	R331-L371 WeakPolarHBondContact CB-O 3.21Å; R331-L371 VanDerWaalsContact CG-O 3.29Å; R331-L371 WeakPolarHBondContact CG-O 3.3Å; H333-L371 HydrophobicContact CB-CD2 3.94Å; V340-L371 HydrophobicContact CB-CD2 3.97Å; V340-L371 HydrophobicContact CG1-CD2 3.74Å; V340-L371 WeakPolarHBondContact O-CD2 3.37Å; S342-L371 PolarHBondContact OG-N 2.88Å; L347-L371 HydrophobicContact CD2-CB 3.76Å; L347-L371 HydrophobicContact CD2-CD1 3.98Å; L347-L371 HydrophobicContact CD2-CG 4.3Å; L371-G373 WeakPolarHBondContact CD1-O 3.29Å; L371-F374 HydrophobicContact CD1-CB 4.18Å; L371-F374 HydrophobicContact CD1-CD2 4.22Å; L371-L381 HydrophobicContact CD1-CD2 3.81Å
372	L	88.5	Confident	81.5	Confident	8 Å²	8	43 Å²	43	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-47.6	170.6	-170.3	57	0	0	0	110.8	L380 F382 L387 F415 A417 F436	L372-L380 WeakPolarHBondContact CA-O 3.39Å; L372-L380 HydrophobicContact CB-CB 4.4Å; L372-L380 HydrophobicContact CB-CD2 4.28Å; L372-L380 HydrophobicContact CB-CG 4.15Å; L372-L380 VanDerWaalsContact CB-O 3.32Å; L372-L380 WeakPolarHBondContact CB-O 3.4Å; L372-L380 HydrophobicContact CD2-CD2 3.43Å; L372-L380 VanDerWaalsContact CD2-CD2 3.43Å; L372-L380 HydrophobicContact CD2-CG 3.85Å; L372-L380 HydrophobicContact CG-CD2 3.98Å; L372-L380 HydrophobicContact CG-CG 4.36Å; L372-L380 PolarHBondContact N-O 2.96Å; L372-F382 HydrophobicContact CB-CD1 3.79Å; L372-F382 HydrophobicContact CB-CE1 4.31Å; L372-F382 HydrophobicContact CD1-CD1 4.33Å; L372-F382 HydrophobicContact CD1-CE1 4.31Å; L372-F382 HydrophobicContact CG-CD1 4.44Å; L372-L387 HydrophobicContact CD2-CD2 3.72Å; L372-F415 HydrophobicContact CD1-CD2 4.09Å; L372-A417 HydrophobicContact CD1-CB 4.06Å; L372-A417 HydrophobicContact CG-CB 3.75Å; L372-F436 HydrophobicContact CD1-CD2 4.02Å; L372-F436 HydrophobicContact CD1-CE2 4.1Å; L372-F436 HydrophobicContact CD2-CB 4.28Å; L372-F436 HydrophobicContact CD2-CD2 3.29Å; L372-F436 HydrophobicContact CD2-CE2 3.87Å; L372-F436 HydrophobicContact CD2-CG 4.15Å; L372-F436 HydrophobicContact CG-CD2 4.28Å
373	G	88.7	Confident	81.6	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	152.1	176.4	0	0	0	0	0	111.2	L371 L380	L371-G373 WeakPolarHBondContact CD1-O 3.29Å; G373-L380 PolarHBondContact N-O 2.95Å; G373-L380 PolarHBondContact O-N 2.94Å
374	F	91	Very high	82.4	Confident	11 Å²	11	40.8 Å²	40.8	5%	0.048	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.2	178.4	-161.4	-93.9	0	0	0	108.5	H333 V340 I361 L371 A379 L392	H333-F374 HydrophobicContact CB-CB 4.44Å; H333-F374 PolarHBondContact CE1-O 2.77Å; H333-F374 PolarHBondContact NE2-O 2.91Å; V340-F374 HydrophobicContact CB-CB 4.49Å; V340-F374 HydrophobicContact CB-CD2 4.4Å; V340-F374 HydrophobicContact CB-CG 4.26Å; V340-F374 HydrophobicContact CG1-CD2 3.78Å; V340-F374 HydrophobicContact CG1-CE2 4Å; V340-F374 HydrophobicContact CG1-CG 4.14Å; V340-F374 HydrophobicContact CG2-CB 4.45Å; V340-F374 HydrophobicContact CG2-CD1 3.75Å; V340-F374 HydrophobicContact CG2-CD2 4.27Å; V340-F374 HydrophobicContact CG2-CE1 3.95Å; V340-F374 HydrophobicContact CG2-CE2 4.44Å; V340-F374 HydrophobicContact CG2-CG 3.91Å; V340-F374 HydrophobicContact CG2-CZ 4.28Å; I361-F374 HydrophobicContact CD1-CE2 4.47Å; L371-F374 HydrophobicContact CD1-CB 4.18Å; L371-F374 HydrophobicContact CD1-CD2 4.22Å; F374-A379 HydrophobicContact CD2-CB 3.94Å; F374-A379 HydrophobicContact CE2-CB 4.33Å; F374-L392 HydrophobicContact CD1-CD1 4.33Å; F374-L392 HydrophobicContact CD2-CD1 4.2Å; F374-L392 HydrophobicContact CD2-CD2 4.39Å; F374-L392 HydrophobicContact CE1-CD1 3.89Å; F374-L392 HydrophobicContact CE2-CD1 3.76Å; F374-L392 HydrophobicContact CE2-CD2 3.53Å; F374-L392 HydrophobicContact CE2-CG 4.31Å; F374-L392 HydrophobicContact CG-CD1 4.48Å; F374-L392 HydrophobicContact CZ-CD1 3.59Å; F374-L392 HydrophobicContact CZ-CD2 3.84Å; F374-L392 HydrophobicContact CZ-CG 4.36Å
375	G	90.1	Very high	83.7	Confident	6 Å²	6	43.9 Å²	43.9	6%	0.062	22%	0.224	C	C	.	.			trans	-141	-164.7	173.7	0	0	0	0	0	111.1	F378 L392 N424	G375-F378 PolarHBondContact N-O 2.79Å; G375-L392 WeakPolarHBondContact O-CD1 3.48Å; G375-N424 WeakPolarHBondContact CA-OD1 3.5Å
376	E	88.3	Confident	85	Confident	150 Å²	150	41.5 Å²	41.5	70%	0.701	21%	0.206	S	C	*	.	S	Bend	trans	-76.2	-34.1	-179.8	-63.9	-172.9	166.6	0	0	113.5	L423 N424	E376-L423 PolarHBondContact N-O 2.89Å; E376-N424 HydrophobicContact CB-CB 4.43Å; E376-N424 HydrophobicContact CG-CB 4.41Å; E376-N424 PolarHBondContact N-OD1 3.37Å
377	I	89.3	Confident	86.3	Confident	25 Å²	25	38.2 Å²	38.2	13%	0.128	19%	0.192	C	C	.	.	S	Bend	trans	-112.2	-42	-171.8	-56.7	-168.1	0	0	0	111.3	L392 L423	I377-L392 WeakPolarHBondContact O-CB 3.32Å; I377-L392 PolarHBondContact O-N 2.87Å; I377-L423 PolarHBondContact N-O 3.49Å
378	F	92.1	Very high	87.8	Confident	3 Å²	3	32.8 Å²	32.8	1%	0.013	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150.5	-176.8	-52.4	-66.7	0	0	0	111.6	M130 G375 I389 M390 I398 W422 L423 L426	M130-F378 HydrophobicContact SD-CZ 4.45Å; G375-F378 PolarHBondContact N-O 2.79Å; F378-I389 HydrophobicContact CB-CG2 4.47Å; F378-I389 HydrophobicContact CD1-CG2 4.41Å; F378-M390 CarbonylContact C-O 3.58Å; F378-M390 VanDerWaalsContact CA-O 3.25Å; F378-M390 WeakPolarHBondContact CA-O 3.48Å; F378-I398 HydrophobicContact CD1-CD1 3.54Å; F378-I398 HydrophobicContact CE1-CD1 3.4Å; F378-I398 VanDerWaalsContact CE1-CD1 3.4Å; F378-W422 HydrophobicContact CB-CZ3 4.36Å; F378-W422 HydrophobicContact CD2-CE3 4.26Å; F378-W422 HydrophobicContact CD2-CZ3 4.36Å; F378-W422 HydrophobicContact CG-CZ3 4.5Å; F378-L423 HydrophobicContact CB-CD2 3.86Å; F378-L423 PolarHBondContact N-O 2.86Å; F378-L426 HydrophobicContact CE2-CD1 4.34Å; F378-L426 HydrophobicContact CE2-CG 4.23Å
379	A	91.8	Very high	88.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.6	163.6	0	0	0	0	0	109.7	F374 L381 M390 L392	F374-A379 HydrophobicContact CD2-CB 3.94Å; F374-A379 HydrophobicContact CE2-CB 4.33Å; A379-L381 HydrophobicContact CB-CD2 4.44Å; A379-L381 HydrophobicContact CB-CG 4.45Å; A379-M390 PolarHBondContact N-O 2.87Å; A379-M390 PolarHBondContact O-N 3.33Å; A379-L392 HydrophobicContact CB-CD1 4.17Å; A379-L392 HydrophobicContact CB-CD2 3.79Å; A379-L392 HydrophobicContact CB-CG 4.04Å
380	L	92.4	Very high	89.3	Confident	3 Å²	3	28 Å²	28	2%	0.016	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	118.4	172.8	-170.8	67	0	0	0	108.5	L372 G373 I389 W422 L423 V435	L372-L380 WeakPolarHBondContact CA-O 3.39Å; L372-L380 HydrophobicContact CB-CB 4.4Å; L372-L380 HydrophobicContact CB-CD2 4.28Å; L372-L380 HydrophobicContact CB-CG 4.15Å; L372-L380 VanDerWaalsContact CB-O 3.32Å; L372-L380 WeakPolarHBondContact CB-O 3.4Å; L372-L380 HydrophobicContact CD2-CD2 3.43Å; L372-L380 VanDerWaalsContact CD2-CD2 3.43Å; L372-L380 HydrophobicContact CD2-CG 3.85Å; L372-L380 HydrophobicContact CG-CD2 3.98Å; L372-L380 HydrophobicContact CG-CG 4.36Å; L372-L380 PolarHBondContact N-O 2.96Å; G373-L380 PolarHBondContact N-O 2.95Å; G373-L380 PolarHBondContact O-N 2.94Å; L380-I389 HydrophobicContact CD1-CG1 3.88Å; L380-W422 HydrophobicContact CD1-CH2 4.35Å; L380-W422 HydrophobicContact CD1-CZ2 4.43Å; L380-W422 HydrophobicContact CD2-CZ2 4.43Å; L380-L423 HydrophobicContact CB-CD1 4.33Å; L380-L423 HydrophobicContact CB-CD2 4.08Å; L380-V435 HydrophobicContact CD2-CG1 4Å
381	L	90.8	Very high	89.6	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	161.3	-175.5	-58.5	179.8	0	0	0	109.3	L347 V369 S370 L371 A379 L387 Y388 M390	L347-L381 HydrophobicContact CD1-CD1 3.75Å; L347-L381 HydrophobicContact CD1-CD2 3.53Å; L347-L381 HydrophobicContact CD1-CG 4.26Å; L347-L381 HydrophobicContact CD2-CD2 3.83Å; L347-L381 HydrophobicContact CG-CD2 4.24Å; V369-L381 HydrophobicContact CG1-CB 3.56Å; V369-L381 HydrophobicContact CG1-CD1 4.15Å; V369-L381 HydrophobicContact CG1-CG 4.33Å; S370-L381 CarbonylContact O-C 3.46Å; S370-L381 VanDerWaalsContact O-CA 3.23Å; S370-L381 WeakPolarHBondContact O-CA 3.45Å; L371-L381 HydrophobicContact CD1-CD2 3.81Å; A379-L381 HydrophobicContact CB-CD2 4.44Å; A379-L381 HydrophobicContact CB-CG 4.45Å; L381-L387 CarbonylContact O-C 3.59Å; L381-L387 WeakPolarHBondContact O-CA 3.43Å; L381-Y388 PolarHBondContact N-O 3.04Å; L381-Y388 PolarHBondContact O-N 3.3Å; L381-M390 HydrophobicContact CD1-CB 4.26Å; L381-M390 HydrophobicContact CD1-CE 3.86Å; L381-M390 HydrophobicContact CD1-SD 4.2Å
382	F	88.9	Confident	89.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	156.2	-179.3	80.3	-73.9	0	0	0	113.3	S370 L372 Y386 L387 Y406 K408 F415	S370-F382 PolarHBondContact N-O 2.85Å; S370-F382 VanDerWaalsContact O-CD1 3.3Å; S370-F382 WeakPolarHBondContact O-CD1 3.25Å; S370-F382 PolarHBondContact O-N 3.47Å; L372-F382 HydrophobicContact CB-CD1 3.79Å; L372-F382 HydrophobicContact CB-CE1 4.31Å; L372-F382 HydrophobicContact CD1-CD1 4.33Å; L372-F382 HydrophobicContact CD1-CE1 4.31Å; L372-F382 HydrophobicContact CG-CD1 4.44Å; F382-Y386 CarbonylContact C-O 3.54Å; F382-Y386 VanDerWaalsContact CA-O 3.27Å; F382-Y386 WeakPolarHBondContact CA-O 3.31Å; F382-L387 HydrophobicContact CB-CD2 3.69Å; F382-Y406 WeakPolarHBondContact CD2-OH 3.32Å; F382-Y406 WeakPolarHBondContact CE2-OH 3.31Å; F382-K408 HydrophobicContact CE2-CD 4.4Å; F382-F415 HydrophobicContact CE1-CD2 4.03Å; F382-F415 AromaticContact CE1-CE2 3.63Å; F382-F415 HydrophobicContact CE1-CE2 3.63Å; F382-F415 HydrophobicContact CE1-CZ 4.17Å; F382-F415 HydrophobicContact CE2-CD1 4.24Å; F382-F415 HydrophobicContact CE2-CD2 4.07Å; F382-F415 HydrophobicContact CE2-CE1 4.21Å; F382-F415 HydrophobicContact CE2-CE2 4.07Å; F382-F415 HydrophobicContact CE2-CG 4.18Å; F382-F415 HydrophobicContact CE2-CZ 4.15Å; F382-F415 HydrophobicContact CZ-CD1 4.19Å; F382-F415 AromaticContact CZ-CD2 3.54Å; F382-F415 HydrophobicContact CZ-CD2 3.54Å; F382-F415 AromaticContact CZ-CE1 3.85Å; F382-F415 HydrophobicContact CZ-CE1 3.85Å; F382-F415 AromaticContact CZ-CE2 3.15Å; F382-F415 HydrophobicContact CZ-CE2 3.15Å; F382-F415 HydrophobicContact CZ-CG 4.06Å; F382-F415 AromaticContact CZ-CZ 3.34Å; F382-F415 HydrophobicContact CZ-CZ 3.34Å
383	D	86.8	Confident	89.6	Confident	35 Å²	35	33.6 Å²	33.6	19%	0.187	15%	0.149	C	C	.	.			trans	-128.8	-161.1	165.2	74.6	3.6	0	0	0	110.5	R385 Y386 Y388 Y406	D383-R385 PolarHBondContact O-N 2.75Å; D383-R385 WeakPolarHBondContact OD1-CA 3.25Å; D383-R385 PolarHBondContact OD1-N 3.34Å; D383-Y386 PolarHBondContact N-O 3.01Å; D383-Y386 PolarHBondContact OD1-N 3.43Å; D383-Y388 HydrophobicContact CB-CE2 4.29Å; D383-Y388 PolarHBondContact OD2-OH 3.46Å; D383-Y406 PolarHBondContact O-OH 2.78Å
384	N	83.4	Confident	89.4	Confident	84 Å²	84	37.5 Å²	37.5	45%	0.449	17%	0.173	S	C	.	.	S	Bend	trans	-74.2	-9	-179.6	-65.2	-9.1	0	0	0	113.5	K408	N384-K408 WeakPolarHBondContact OD1-CB 3.14Å; N384-K408 WeakPolarHBondContact OD1-CD 3.38Å
385	R	86.3	Confident	89.2	Confident	172 Å²	172	40.7 Å²	40.7	65%	0.649	19%	0.188	S	C	*	.	S	Bend	trans	-127.2	-24.6	-170.8	-64	-175.7	-176.1	-179.2	2	113.6	D383 L403	D383-R385 PolarHBondContact O-N 2.75Å; D383-R385 WeakPolarHBondContact OD1-CA 3.25Å; D383-R385 PolarHBondContact OD1-N 3.34Å; R385-L403 PolarHBondContact O-N 3.1Å
386	Y	89.3	Confident	89.1	Confident	71 Å²	71	47.5 Å²	47.5	28%	0.278	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	144.6	-173.7	-59.6	-80.1	0	0	0	112.2	F382 D383 R400 W401 P402	F382-Y386 CarbonylContact C-O 3.54Å; F382-Y386 VanDerWaalsContact CA-O 3.27Å; F382-Y386 WeakPolarHBondContact CA-O 3.31Å; D383-Y386 PolarHBondContact N-O 3.01Å; D383-Y386 PolarHBondContact OD1-N 3.43Å; Y386-R400 HydrophobicContact CD1-CB 4.26Å; Y386-R400 HydrophobicContact CD1-CG 4.31Å; Y386-W401 CarbonylContact C-O 3.12Å; Y386-W401 WeakPolarHBondContact CA-O 3.5Å; Y386-P402 HydrophobicContact CD1-CB 4.27Å; Y386-P402 HydrophobicContact CE1-CB 4.09Å
387	L	90.9	Very high	89.1	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	145.7	153.6	-61.2	164.7	0	0	0	108.1	L372 L381 F382 R400 W401 L403 F436 V448	L372-L387 HydrophobicContact CD2-CD2 3.72Å; L381-L387 CarbonylContact O-C 3.59Å; L381-L387 WeakPolarHBondContact O-CA 3.43Å; F382-L387 HydrophobicContact CB-CD2 3.69Å; L387-R400 CarbonylContact O-C 3.56Å; L387-R400 WeakPolarHBondContact O-CA 3.44Å; L387-W401 HydrophobicContact CB-CB 4.17Å; L387-W401 PolarHBondContact N-O 2.91Å; L387-W401 PolarHBondContact O-N 2.79Å; L387-L403 HydrophobicContact CD1-CD2 3.83Å; L387-L403 HydrophobicContact CD1-CG 4.49Å; L387-L403 HydrophobicContact CD2-CD1 4.02Å; L387-L403 HydrophobicContact CD2-CD2 4.48Å; L387-L403 HydrophobicContact CG-CD1 3.85Å; L387-L403 HydrophobicContact CG-CD2 3.79Å; L387-L403 HydrophobicContact CG-CG 3.92Å; L387-F436 HydrophobicContact CD1-CB 3.8Å; L387-F436 HydrophobicContact CD1-CD1 4.14Å; L387-F436 HydrophobicContact CD1-CG 4.09Å; L387-F436 HydrophobicContact CD2-CB 4.15Å; L387-F436 HydrophobicContact CD2-CD1 4.16Å; L387-F436 HydrophobicContact CD2-CD2 3.92Å; L387-F436 HydrophobicContact CD2-CE1 4.49Å; L387-F436 HydrophobicContact CD2-CE2 4.21Å; L387-F436 HydrophobicContact CD2-CG 3.83Å; L387-F436 HydrophobicContact CD2-CZ 4.49Å; L387-V448 HydrophobicContact CD1-CB 4.37Å; L387-V448 HydrophobicContact CD1-CG1 4.24Å; L387-V448 HydrophobicContact CD1-CG2 4.07Å
388	Y	91.1	Very high	89	Confident	3 Å²	3	43.7 Å²	43.7	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.7	-176.3	-67.7	-79.4	0	0	0	108.6	F366 V369 L381 D383 L397 S399 R400	F366-Y388 HydrophobicContact CD2-CE1 4Å; F366-Y388 HydrophobicContact CE1-CE1 4.4Å; F366-Y388 WeakPolarHBondContact CE1-OH 3.42Å; F366-Y388 HydrophobicContact CE2-CD1 4.29Å; F366-Y388 AromaticContact CE2-CE1 3.49Å; F366-Y388 HydrophobicContact CE2-CE1 3.49Å; F366-Y388 VanDerWaalsContact CE2-CE1 3.49Å; F366-Y388 AromaticContact CE2-CZ 3.92Å; F366-Y388 AromaticContact CZ-CE1 3.73Å; F366-Y388 HydrophobicContact CZ-CE1 3.73Å; V369-Y388 HydrophobicContact CG1-CD2 4.43Å; L381-Y388 PolarHBondContact N-O 3.04Å; L381-Y388 PolarHBondContact O-N 3.3Å; D383-Y388 HydrophobicContact CB-CE2 4.29Å; D383-Y388 PolarHBondContact OD2-OH 3.46Å; Y388-L397 HydrophobicContact CD1-CD1 3.66Å; Y388-L397 HydrophobicContact CD1-CD2 3.77Å; Y388-L397 HydrophobicContact CD1-CG 4.37Å; Y388-L397 HydrophobicContact CE1-CD2 4.24Å; Y388-L397 HydrophobicContact CG-CD1 4.09Å; Y388-S399 WeakPolarHBondContact CA-O 3.38Å; Y388-R400 HydrophobicContact CD1-CB 3.78Å; Y388-R400 HydrophobicContact CE1-CB 3.85Å
389	I	92	Very high	88.8	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118	175.3	-58.8	172.4	0	0	0	107.4	L133 F139 F378 L380 L397 I398 S399 W422	L133-I389 HydrophobicContact CD2-CD1 3.6Å; F139-I389 HydrophobicContact CE2-CD1 3.88Å; F139-I389 HydrophobicContact CZ-CD1 3.7Å; F378-I389 HydrophobicContact CB-CG2 4.47Å; F378-I389 HydrophobicContact CD1-CG2 4.41Å; L380-I389 HydrophobicContact CD1-CG1 3.88Å; I389-L397 WeakPolarHBondContact O-CD1 3.49Å; I389-I398 HydrophobicContact CG2-CB 4.48Å; I389-I398 HydrophobicContact CG2-CD1 4.18Å; I389-I398 PolarHBondContact O-N 2.85Å; I389-S399 PolarHBondContact N-O 3.16Å; I389-S399 PolarHBondContact O-N 2.97Å; I389-W422 HydrophobicContact CD1-CH2 4.06Å; I389-W422 HydrophobicContact CG1-CH2 4.26Å; I389-W422 HydrophobicContact CG2-CH2 4.42Å; I389-W422 HydrophobicContact CG2-CZ3 4.31Å
390	M	90.9	Very high	88.7	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.03	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	136.8	-179	-179.9	179.5	-77.1	0	0	110.1	I361 P363 F378 A379 L381	I361-M390 HydrophobicContact CG2-CE 4.33Å; I361-M390 HydrophobicContact CG2-SD 3.76Å; P363-M390 HydrophobicContact CB-CE 4.05Å; F378-M390 CarbonylContact C-O 3.58Å; F378-M390 VanDerWaalsContact CA-O 3.25Å; F378-M390 WeakPolarHBondContact CA-O 3.48Å; A379-M390 PolarHBondContact N-O 2.87Å; A379-M390 PolarHBondContact O-N 3.33Å; L381-M390 HydrophobicContact CD1-CB 4.26Å; L381-M390 HydrophobicContact CD1-CE 3.86Å; L381-M390 HydrophobicContact CD1-SD 4.2Å
391	D	90.2	Very high	88.6	Confident	13 Å²	13	50.8 Å²	50.8	7%	0.07	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	118.4	167.1	-169.4	-34.2	0	0	0	109	R393 E395 K396 I398	D391-R393 PolarHBondContact O-N 2.81Å; D391-R393 VanDerWaalsContact OD1-CB 3.28Å; D391-R393 WeakPolarHBondContact OD1-CB 3.44Å; D391-R393 IonicContact OD1-CZ 2.75Å; D391-R393 PolarHBondContact OD1-N 2.86Å; D391-R393 IonicContact OD1-NE 3.81Å; D391-R393 PolarHBondContact OD1-NE 2.88Å; D391-R393 IonicContact OD1-NH2 3.96Å; D391-R393 IonicContact OD2-CZ 3.41Å; D391-R393 IonicContact OD2-NE 3.54Å; D391-R393 IonicContact OD2-NH2 3Å; D391-R393 PolarHBondContact OD2-NH2 3.23Å; D391-E395 WeakPolarHBondContact O-CA 3.23Å; D391-E395 PolarHBondContact O-N 3.23Å; D391-K396 PolarHBondContact N-O 2.96Å; D391-I398 HydrophobicContact CB-CD1 3.8Å; D391-I398 HydrophobicContact CB-CG1 4.14Å
392	L	89.1	Confident	88.5	Confident	6 Å²	6	54 Å²	54	3%	0.031	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.7	-177.7	-69.9	172.4	0	0	0	113.7	R359 I361 F374 G375 I377 A379	R359-L392 PolarHBondContact NH1-O 3Å; I361-L392 HydrophobicContact CD1-CD2 3.59Å; F374-L392 HydrophobicContact CD1-CD1 4.33Å; F374-L392 HydrophobicContact CD2-CD1 4.2Å; F374-L392 HydrophobicContact CD2-CD2 4.39Å; F374-L392 HydrophobicContact CE1-CD1 3.89Å; F374-L392 HydrophobicContact CE2-CD1 3.76Å; F374-L392 HydrophobicContact CE2-CD2 3.53Å; F374-L392 HydrophobicContact CE2-CG 4.31Å; F374-L392 HydrophobicContact CG-CD1 4.48Å; F374-L392 HydrophobicContact CZ-CD1 3.59Å; F374-L392 HydrophobicContact CZ-CD2 3.84Å; F374-L392 HydrophobicContact CZ-CG 4.36Å; G375-L392 WeakPolarHBondContact O-CD1 3.48Å; I377-L392 WeakPolarHBondContact O-CB 3.32Å; I377-L392 PolarHBondContact O-N 2.87Å; A379-L392 HydrophobicContact CB-CD1 4.17Å; A379-L392 HydrophobicContact CB-CD2 3.79Å; A379-L392 HydrophobicContact CB-CG 4.04Å
393	R	87.6	Confident	88.5	Confident	110 Å²	110	54.8 Å²	54.8	42%	0.415	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-34.8	177.6	-55.4	167	-62.9	166	4.9	111.4	K103 N104 D391	K103-R393 PolarHBondContact O-NH1 2.91Å; N104-R393 PolarHBondContact O-NH1 3.07Å; N104-R393 PolarHBondContact O-NH2 3.4Å; D391-R393 PolarHBondContact O-N 2.81Å; D391-R393 VanDerWaalsContact OD1-CB 3.28Å; D391-R393 WeakPolarHBondContact OD1-CB 3.44Å; D391-R393 IonicContact OD1-CZ 2.75Å; D391-R393 PolarHBondContact OD1-N 2.86Å; D391-R393 IonicContact OD1-NE 3.81Å; D391-R393 PolarHBondContact OD1-NE 2.88Å; D391-R393 IonicContact OD1-NH2 3.96Å; D391-R393 IonicContact OD2-CZ 3.41Å; D391-R393 IonicContact OD2-NE 3.54Å; D391-R393 IonicContact OD2-NH2 3Å; D391-R393 PolarHBondContact OD2-NH2 3.23Å
394	T	86.3	Confident	88.5	Confident	82 Å²	82	55.2 Å²	55.2	50%	0.503	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-11.4	-179.7	65.7	0	0	0	0	113.4	K396	T394-K396 PolarHBondContact O-N 3.23Å
395	E	86.4	Confident	88.4	Confident	77 Å²	77	59.4 Å²	59.4	36%	0.36	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	22.4	-173.9	-56.9	-174.6	175.1	0	0	113.6	R359 I361 D391	R359-E395 IonicContact NH1-OE1 3.5Å; I361-E395 HydrophobicContact CG2-CB 4.42Å; I361-E395 HydrophobicContact CG2-CG 4.39Å; D391-E395 WeakPolarHBondContact O-CA 3.23Å; D391-E395 PolarHBondContact O-N 3.23Å
396	K	86.8	Confident	88.1	Confident	150 Å²	150	52 Å²	52	65%	0.652	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	148	178.6	-68.9	-176.8	-179.8	-179.1	0	111.4	D391 T394	D391-K396 PolarHBondContact N-O 2.96Å; T394-K396 PolarHBondContact O-N 3.23Å
397	L	88	Confident	87.2	Confident	69 Å²	69	56.9 Å²	56.9	36%	0.361	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	129.7	171.7	-169.8	74.7	0	0	0	110.2	Y388 I389 S399 R400	Y388-L397 HydrophobicContact CD1-CD1 3.66Å; Y388-L397 HydrophobicContact CD1-CD2 3.77Å; Y388-L397 HydrophobicContact CD1-CG 4.37Å; Y388-L397 HydrophobicContact CE1-CD2 4.24Å; Y388-L397 HydrophobicContact CG-CD1 4.09Å; I389-L397 WeakPolarHBondContact O-CD1 3.49Å; L397-S399 WeakPolarHBondContact CD1-O 3.45Å; L397-R400 HydrophobicContact CD2-CB 4.46Å
398	I	87.7	Confident	86.2	Confident	26 Å²	26	59.3 Å²	59.3	13%	0.133	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-46.9	173.4	-65.1	161.1	0	0	0	110.1	M130 L133 K134 F378 I389 D391	M130-I398 HydrophobicContact CE-CD1 4Å; M130-I398 HydrophobicContact CE-CG1 4.36Å; M130-I398 HydrophobicContact CE-CG2 3.83Å; L133-I398 HydrophobicContact CB-CG2 4.48Å; K134-I398 HydrophobicContact CG-CG2 4.24Å; F378-I398 HydrophobicContact CD1-CD1 3.54Å; F378-I398 HydrophobicContact CE1-CD1 3.4Å; F378-I398 VanDerWaalsContact CE1-CD1 3.4Å; I389-I398 HydrophobicContact CG2-CB 4.48Å; I389-I398 HydrophobicContact CG2-CD1 4.18Å; I389-I398 PolarHBondContact O-N 2.85Å; D391-I398 HydrophobicContact CB-CD1 3.8Å; D391-I398 HydrophobicContact CB-CG1 4.14Å
399	S	88.2	Confident	85.3	Confident	6 Å²	6	59.5 Å²	59.5	4%	0.042	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	159.2	-174.6	-176.5	0	0	0	0	112.2	L133 H136 Y388 I389 L397	L133-S399 WeakPolarHBondContact O-CB 3.42Å; L133-S399 PolarHBondContact O-OG 3.45Å; H136-S399 PolarHBondContact ND1-OG 2.89Å; Y388-S399 WeakPolarHBondContact CA-O 3.38Å; I389-S399 PolarHBondContact N-O 3.16Å; I389-S399 PolarHBondContact O-N 2.97Å; L397-S399 WeakPolarHBondContact CD1-O 3.45Å
400	R	89.6	Confident	84.3	Confident	115 Å²	115	68.9 Å²	68.9	43%	0.434	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.1	169.1	63.7	-177	-179.4	178.5	-1.5	110.2	H136 Y386 L387 Y388 L397	H136-R400 PolarHBondContact CE1-O 2.84Å; H136-R400 PolarHBondContact ND1-O 2.88Å; Y386-R400 HydrophobicContact CD1-CB 4.26Å; Y386-R400 HydrophobicContact CD1-CG 4.31Å; L387-R400 CarbonylContact O-C 3.56Å; L387-R400 WeakPolarHBondContact O-CA 3.44Å; Y388-R400 HydrophobicContact CD1-CB 3.78Å; Y388-R400 HydrophobicContact CE1-CB 3.85Å; L397-R400 HydrophobicContact CD2-CB 4.46Å
401	W	89.8	Confident	83.3	Confident	33 Å²	33	71.4 Å²	71.4	13%	0.125	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.6	176.4	-178.7	-91.9	0	0	0	110.2	H136 F139 T141 Y386 L387 L403	H136-W401 VanDerWaalsContact C-CZ3 3.47Å; H136-W401 HydrophobicContact CB-CE3 4.09Å; H136-W401 HydrophobicContact CB-CZ3 4.06Å; H136-W401 WeakPolarHBondContact O-CZ3 3.41Å; F139-W401 HydrophobicContact CB-CD2 4.06Å; F139-W401 HydrophobicContact CB-CE3 3.95Å; F139-W401 HydrophobicContact CB-CH2 3.84Å; F139-W401 HydrophobicContact CB-CZ2 3.95Å; F139-W401 HydrophobicContact CB-CZ3 3.79Å; F139-W401 HydrophobicContact CD2-CB 4.13Å; F139-W401 AromaticContact CD2-CD2 3.74Å; F139-W401 HydrophobicContact CD2-CD2 3.74Å; F139-W401 AromaticContact CD2-CE3 3.63Å; F139-W401 HydrophobicContact CD2-CE3 3.63Å; F139-W401 AromaticContact CD2-CG 3.94Å; F139-W401 HydrophobicContact CD2-CG 3.94Å; F139-W401 HydrophobicContact CD2-CZ3 4.26Å; F139-W401 HydrophobicContact CE2-CB 4.45Å; F139-W401 HydrophobicContact CG-CD2 4.4Å; F139-W401 HydrophobicContact CG-CE3 4.24Å; F139-W401 HydrophobicContact CG-CZ3 4.46Å; F139-W401 WeakPolarHBondContact O-CH2 3.27Å; T141-W401 HydrophobicContact CG2-CZ2 4.33Å; Y386-W401 CarbonylContact C-O 3.12Å; Y386-W401 WeakPolarHBondContact CA-O 3.5Å; L387-W401 HydrophobicContact CB-CB 4.17Å; L387-W401 PolarHBondContact N-O 2.91Å; L387-W401 PolarHBondContact O-N 2.79Å; W401-L403 PolarHBondContact O-N 3.07Å
402	P	89.8	Confident	82.4	Confident	71 Å²	71	71 Å²	71	46%	0.461	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.5	180	28.4	-33.5	0	0	0	111.3	Y386	Y386-P402 HydrophobicContact CD1-CB 4.27Å; Y386-P402 HydrophobicContact CE1-CB 4.09Å
403	L	88.3	Confident	81.6	Confident	16 Å²	16	71.7 Å²	71.7	8%	0.084	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-100.9	146.7	172.2	-69.4	177	0	0	0	110	R385 L387 W401 Y406 F436 V448	R385-L403 PolarHBondContact O-N 3.1Å; L387-L403 HydrophobicContact CD1-CD2 3.83Å; L387-L403 HydrophobicContact CD1-CG 4.49Å; L387-L403 HydrophobicContact CD2-CD1 4.02Å; L387-L403 HydrophobicContact CD2-CD2 4.48Å; L387-L403 HydrophobicContact CG-CD1 3.85Å; L387-L403 HydrophobicContact CG-CD2 3.79Å; L387-L403 HydrophobicContact CG-CG 3.92Å; W401-L403 PolarHBondContact O-N 3.07Å; L403-Y406 HydrophobicContact CB-CE1 4.14Å; L403-Y406 HydrophobicContact CD1-CE1 3.72Å; L403-F436 HydrophobicContact CD1-CE1 3.9Å; L403-F436 HydrophobicContact CD1-CZ 4.15Å; L403-F436 HydrophobicContact CD2-CD1 3.78Å; L403-F436 HydrophobicContact CD2-CE1 3.68Å; L403-F436 HydrophobicContact CG-CE1 4.45Å; L403-V448 HydrophobicContact CD2-CG2 4.14Å
404	P	86.1	Confident	81.2	Confident	44 Å²	44	66.5 Å²	66.5	29%	0.286	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-63.8	162.5	169.8	30.6	-35.9	0	0	0	110.2	Y406 M440 H446	P404-Y406 VanDerWaalsContact O-CD1 3.27Å; P404-Y406 WeakPolarHBondContact O-CD1 3.04Å; P404-Y406 PolarHBondContact O-N 2.97Å; P404-Y406 VanDerWaalsContact O-N 3.15Å; P404-M440 HydrophobicContact CB-CE 3.76Å; P404-M440 HydrophobicContact CG-CE 3.7Å; P404-M440 HydrophobicContact CG-SD 3.98Å; P404-H446 WeakPolarHBondContact CD-NE2 3.27Å
405	E	82.4	Confident	81.2	Confident	172 Å²	172	62.7 Å²	62.7	80%	0.804	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-67.6	117.3	173.7	-69.3	-165.6	158.5	0	0	110.4
406	Y	79.6	Confident	81.4	Confident	16 Å²	16	59.7 Å²	59.7	6%	0.063	27%	0.274	C	S	.	.			trans	-132.9	158.3	175.5	71	-82.3	0	0	0	111	F382 D383 L403 P404 K408 T438	F382-Y406 WeakPolarHBondContact CD2-OH 3.32Å; F382-Y406 WeakPolarHBondContact CE2-OH 3.31Å; D383-Y406 PolarHBondContact O-OH 2.78Å; L403-Y406 HydrophobicContact CB-CE1 4.14Å; L403-Y406 HydrophobicContact CD1-CE1 3.72Å; P404-Y406 VanDerWaalsContact O-CD1 3.27Å; P404-Y406 WeakPolarHBondContact O-CD1 3.04Å; P404-Y406 PolarHBondContact O-N 2.97Å; P404-Y406 VanDerWaalsContact O-N 3.15Å; Y406-K408 HydrophobicContact CE2-CB 4.44Å; Y406-K408 PolarHBondContact O-N 2.91Å; Y406-T438 HydrophobicContact CD1-CG2 4.24Å; Y406-T438 HydrophobicContact CD2-CG2 4.24Å; Y406-T438 WeakPolarHBondContact CD2-OG1 3.34Å; Y406-T438 WeakPolarHBondContact CE2-OG1 3.32Å; Y406-T438 HydrophobicContact CG-CG2 4.04Å
407	R	71.1	Confident	81.5	Confident	174 Å²	174	52.9 Å²	52.9	66%	0.657	25%	0.246	S	C	*	.			trans	-85.6	100.5	-179.2	-175.5	-178.8	-98.8	-171.8	-7.1	110.1	R150 S409	R150-R407 VanDerWaalsContact NH2-CD 3.34Å; R407-S409 PolarHBondContact O-N 2.76Å
408	K	69.8	Low	81.6	Confident	53 Å²	53	49.8 Å²	49.8	23%	0.23	23%	0.23	C	C	.	.			trans	-58.9	118	172.6	-174.1	170.2	179.4	174	0	111.2	S370 F382 N384 Y406 K410 F415	S370-K408 PolarHBondContact OG-NZ 2.9Å; F382-K408 HydrophobicContact CE2-CD 4.4Å; N384-K408 WeakPolarHBondContact OD1-CB 3.14Å; N384-K408 WeakPolarHBondContact OD1-CD 3.38Å; Y406-K408 HydrophobicContact CE2-CB 4.44Å; Y406-K408 PolarHBondContact O-N 2.91Å; K408-K410 PolarHBondContact O-N 2.87Å; K408-F415 HydrophobicContact CG-CE1 4.12Å
409	S	72.3	Confident	81.7	Confident	6 Å²	6	51.5 Å²	51.5	4%	0.042	24%	0.238	C	C	.	.			trans	-68.4	127.3	171.7	179.1	0	0	0	0	109.9	R407 R411 G412 S413 S414	R407-S409 PolarHBondContact O-N 2.76Å; S409-R411 PolarHBondContact O-N 2.86Å; S409-R411 VanDerWaalsContact O-N 3.1Å; S409-R411 PolarHBondContact OG-N 2.93Å; S409-G412 PolarHBondContact O-N 3.4Å; S409-S413 PolarHBondContact OG-OG 2.86Å; S409-S414 WeakPolarHBondContact CB-OG 3.26Å; S409-S414 PolarHBondContact N-OG 2.83Å
410	K	69.6	Low	81.7	Confident	202 Å²	202	54.8 Å²	54.8	88%	0.878	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.7	170.9	-69.1	-174.5	178.1	-178.4	0	112.5	K408	K408-K410 PolarHBondContact O-N 2.87Å
411	R	71.3	Confident	81.6	Confident	59 Å²	59	51.7 Å²	51.7	22%	0.223	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-5.2	-178.3	-58.6	175.2	-67.9	-143.7	4.4	113.6	P330 S409 S413	P330-R411 VanDerWaalsContact CB-O 3.26Å; P330-R411 WeakPolarHBondContact CB-O 3.45Å; S409-R411 PolarHBondContact O-N 2.86Å; S409-R411 VanDerWaalsContact O-N 3.1Å; S409-R411 PolarHBondContact OG-N 2.93Å; R411-S413 PolarHBondContact O-N 3.39Å
412	G	69.9	Low	81.7	Confident	4 Å²	4	50.2 Å²	50.2	4%	0.041	24%	0.244	C	C	.	.	S	Bend	trans	74	7.6	177.3	0	0	0	0	0	116.8	P330 S409	P330-G412 VanDerWaalsContact CG-N 3.34Å; S409-G412 PolarHBondContact O-N 3.4Å
413	S	73.4	Confident	81.7	Confident	20 Å²	20	46.9 Å²	46.9	14%	0.14	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-19.7	-172.6	67.5	0	0	0	0	114.2	Y152 A153 L154 S409 R411	Y152-S413 CarbonylContact O-C 3.56Å; Y152-S413 WeakPolarHBondContact O-CB 3.31Å; Y152-S413 PolarHBondContact O-OG 3.32Å; A153-S413 WeakPolarHBondContact CA-O 3.5Å; L154-S413 PolarHBondContact N-O 3.06Å; S409-S413 PolarHBondContact OG-OG 2.86Å; R411-S413 PolarHBondContact O-N 3.39Å
414	S	79	Confident	81.8	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.014	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.5	-171.5	68.3	0	0	0	0	115.1	L154 S409 T438 S439	L154-S414 WeakPolarHBondContact CD1-O 3.29Å; S409-S414 WeakPolarHBondContact CB-OG 3.26Å; S409-S414 PolarHBondContact N-OG 2.83Å; S414-T438 CarbonylContact O-C 3.56Å; S414-T438 WeakPolarHBondContact O-CA 3.41Å; S414-T438 PolarHBondContact O-OG1 3.48Å; S414-S439 PolarHBondContact O-N 2.55Å
415	F	86.8	Confident	81.9	Confident	1 Å²	1	46.8 Å²	46.8	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	156.2	-179.1	57.9	-98.7	0	0	0	109.2	R331 L372 F382 K408 F436 A437	R331-F415 HydrophobicContact CG-CE2 3.72Å; R331-F415 HydrophobicContact CG-CZ 4.33Å; R331-F415 PolarHBondContact NH2-O 3.08Å; L372-F415 HydrophobicContact CD1-CD2 4.09Å; F382-F415 HydrophobicContact CE1-CD2 4.03Å; F382-F415 AromaticContact CE1-CE2 3.63Å; F382-F415 HydrophobicContact CE1-CE2 3.63Å; F382-F415 HydrophobicContact CE1-CZ 4.17Å; F382-F415 HydrophobicContact CE2-CD1 4.24Å; F382-F415 HydrophobicContact CE2-CD2 4.07Å; F382-F415 HydrophobicContact CE2-CE1 4.21Å; F382-F415 HydrophobicContact CE2-CE2 4.07Å; F382-F415 HydrophobicContact CE2-CG 4.18Å; F382-F415 HydrophobicContact CE2-CZ 4.15Å; F382-F415 HydrophobicContact CZ-CD1 4.19Å; F382-F415 AromaticContact CZ-CD2 3.54Å; F382-F415 HydrophobicContact CZ-CD2 3.54Å; F382-F415 AromaticContact CZ-CE1 3.85Å; F382-F415 HydrophobicContact CZ-CE1 3.85Å; F382-F415 AromaticContact CZ-CE2 3.15Å; F382-F415 HydrophobicContact CZ-CE2 3.15Å; F382-F415 HydrophobicContact CZ-CG 4.06Å; F382-F415 AromaticContact CZ-CZ 3.34Å; F382-F415 HydrophobicContact CZ-CZ 3.34Å; K408-F415 HydrophobicContact CG-CE1 4.12Å; F415-F436 HydrophobicContact CB-CE2 3.75Å; F415-F436 HydrophobicContact CB-CZ 3.92Å; F415-A437 CarbonylContact C-O 3.6Å; F415-A437 WeakPolarHBondContact CA-O 3.42Å
416	L	90.1	Very high	82.1	Confident	15 Å²	15	38.6 Å²	38.6	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	148.2	-173.7	179.1	72.6	0	0	0	112.1	L154 Y156 L161 F436 A437	L154-L416 HydrophobicContact CB-CB 4.09Å; L154-L416 HydrophobicContact CB-CD2 4.31Å; Y156-L416 VanDerWaalsContact CB-CD2 3.41Å; L161-L416 HydrophobicContact CD1-CD2 4.21Å; L416-F436 WeakPolarHBondContact O-CA 3.41Å; L416-F436 WeakPolarHBondContact O-CD2 3.26Å; L416-A437 PolarHBondContact N-O 3.38Å; L416-A437 PolarHBondContact O-N 3.35Å
417	A	89.4	Confident	82.4	Confident	7 Å²	7	40.9 Å²	40.9	6%	0.058	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	134.2	166.5	0	0	0	0	0	110.1	L372 M420	L372-A417 HydrophobicContact CD1-CB 4.06Å; L372-A417 HydrophobicContact CG-CB 3.75Å; A417-M420 HydrophobicContact CB-CG 4.04Å; A417-M420 HydrophobicContact CB-SD 3.92Å
418	G	89.5	Confident	82.8	Confident	4 Å²	4	34.6 Å²	34.6	4%	0.041	18%	0.184	C	C	.	.			trans	-78.1	-126.3	172.3	0	0	0	0	0	112	M420 L434 V435	G418-M420 PolarHBondContact O-N 2.99Å; G418-L434 CarbonylContact C-O 3.57Å; G418-L434 VanDerWaalsContact CA-O 3.26Å; G418-L434 WeakPolarHBondContact CA-O 3.19Å; G418-V435 PolarHBondContact N-O 3.49Å
419	E	88.8	Confident	83.4	Confident	61 Å²	61	40 Å²	40	29%	0.285	21%	0.21	S	C	.	.			trans	-62.6	129.1	173.2	-74.8	-59.2	152.6	0	0	111	Y156 W422 L434	Y156-E419 HydrophobicContact CE1-CG 3.93Å; E419-W422 VanDerWaalsContact O-CD1 3.26Å; E419-W422 PolarHBondContact O-NE1 2.93Å; E419-L434 PolarHBondContact N-O 3.21Å
420	M	89.1	Confident	84	Confident	75 Å²	75	40.6 Å²	40.6	37%	0.369	21%	0.213	S	C	.	.			trans	-114.5	-5.1	-177.7	-70.7	-179.2	-77.9	0	0	112.8	A417 G418 W422 L423	A417-M420 HydrophobicContact CB-CG 4.04Å; A417-M420 HydrophobicContact CB-SD 3.92Å; G418-M420 PolarHBondContact O-N 2.99Å; M420-W422 VanDerWaalsContact C-N 3.26Å; M420-W422 PolarHBondContact O-N 3.1Å; M420-L423 HydrophobicContact CB-CD1 4.07Å; M420-L423 HydrophobicContact CG-CD1 4.12Å; M420-L423 VanDerWaalsContact O-CB 3.24Å; M420-L423 WeakPolarHBondContact O-CB 3.34Å; M420-L423 WeakPolarHBondContact O-CG 3.16Å; M420-L423 PolarHBondContact O-N 3.12Å
421	S	87.9	Confident	84.6	Confident	51 Å²	51	31.3 Å²	31.3	36%	0.357	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-59.6	-35.2	-176.2	58	0	0	0	0	112.9	L423 N424	S421-L423 PolarHBondContact O-N 3.16Å; S421-N424 WeakPolarHBondContact O-CB 3.35Å; S421-N424 PolarHBondContact O-N 3.05Å; S421-N424 VanDerWaalsContact O-N 3.17Å
422	W	90.7	Very high	85.3	Confident	1 Å²	1	31.7 Å²	31.7	0%	0.004	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-64.9	-20	175.2	68.3	-88.9	0	0	0	114.4	F378 L380 I389 E419 M420 N424 G425 L426 N430 V435 W450	F378-W422 HydrophobicContact CB-CZ3 4.36Å; F378-W422 HydrophobicContact CD2-CE3 4.26Å; F378-W422 HydrophobicContact CD2-CZ3 4.36Å; F378-W422 HydrophobicContact CG-CZ3 4.5Å; L380-W422 HydrophobicContact CD1-CH2 4.35Å; L380-W422 HydrophobicContact CD1-CZ2 4.43Å; L380-W422 HydrophobicContact CD2-CZ2 4.43Å; I389-W422 HydrophobicContact CD1-CH2 4.06Å; I389-W422 HydrophobicContact CG1-CH2 4.26Å; I389-W422 HydrophobicContact CG2-CH2 4.42Å; I389-W422 HydrophobicContact CG2-CZ3 4.31Å; E419-W422 VanDerWaalsContact O-CD1 3.26Å; E419-W422 PolarHBondContact O-NE1 2.93Å; M420-W422 VanDerWaalsContact C-N 3.26Å; M420-W422 PolarHBondContact O-N 3.1Å; W422-N424 PolarHBondContact O-N 3.27Å; W422-G425 CarbonylContact O-C 3.5Å; W422-G425 WeakPolarHBondContact O-CA 3.33Å; W422-G425 PolarHBondContact O-N 3.11Å; W422-L426 HydrophobicContact CB-CD2 3.94Å; W422-L426 HydrophobicContact CE3-CD2 4.46Å; W422-N430 WeakPolarHBondContact CA-ND2 2.94Å; W422-N430 HydrophobicContact CB-CB 4.4Å; W422-N430 WeakPolarHBondContact CB-O 3.32Å; W422-V435 HydrophobicContact CZ2-CG1 4.32Å; W422-W450 AromaticContact CD1-NE1 3.79Å; W422-W450 AromaticContact CD2-CZ2 3.73Å; W422-W450 HydrophobicContact CD2-CZ2 3.73Å; W422-W450 AromaticContact CE2-CZ2 3.95Å; W422-W450 AromaticContact CE3-CZ2 3.86Å; W422-W450 HydrophobicContact CE3-CZ2 3.86Å; W422-W450 HydrophobicContact CG-CZ2 4.15Å; W422-W450 HydrophobicContact CH2-CZ2 4.38Å; W422-W450 HydrophobicContact CZ2-CZ2 4.28Å; W422-W450 HydrophobicContact CZ3-CZ2 4.18Å; W422-W450 AromaticContact NE1-NE1 3.78Å
423	L	90.9	Very high	86.2	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-66.5	-22	175	-61.3	177.6	0	0	0	112.1	E376 I377 F378 L380 M420 S421 G425	E376-L423 PolarHBondContact N-O 2.89Å; I377-L423 PolarHBondContact N-O 3.49Å; F378-L423 HydrophobicContact CB-CD2 3.86Å; F378-L423 PolarHBondContact N-O 2.86Å; L380-L423 HydrophobicContact CB-CD1 4.33Å; L380-L423 HydrophobicContact CB-CD2 4.08Å; M420-L423 HydrophobicContact CB-CD1 4.07Å; M420-L423 HydrophobicContact CG-CD1 4.12Å; M420-L423 VanDerWaalsContact O-CB 3.24Å; M420-L423 WeakPolarHBondContact O-CB 3.34Å; M420-L423 WeakPolarHBondContact O-CG 3.16Å; M420-L423 PolarHBondContact O-N 3.12Å; S421-L423 PolarHBondContact O-N 3.16Å; L423-G425 PolarHBondContact O-N 3.29Å
424	N	89.4	Confident	87.2	Confident	59 Å²	59	32 Å²	32	32%	0.316	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-81.8	5.7	172	-58.3	-35	0	0	0	112.8	Q108 G375 E376 S421 W422	Q108-N424 PolarHBondContact NE2-O 2.99Å; G375-N424 WeakPolarHBondContact CA-OD1 3.5Å; E376-N424 HydrophobicContact CB-CB 4.43Å; E376-N424 HydrophobicContact CG-CB 4.41Å; E376-N424 PolarHBondContact N-OD1 3.37Å; S421-N424 WeakPolarHBondContact O-CB 3.35Å; S421-N424 PolarHBondContact O-N 3.05Å; S421-N424 VanDerWaalsContact O-N 3.17Å; W422-N424 PolarHBondContact O-N 3.27Å
425	G	88	Confident	87.8	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.			trans	115.7	143.6	-176.7	0	0	0	0	0	112.1	G106 Q108 W422 L423 N430	G106-G425 CarbonylContact O-C 3.57Å; G106-G425 WeakPolarHBondContact O-CA 3.27Å; Q108-G425 PolarHBondContact NE2-O 3.28Å; W422-G425 CarbonylContact O-C 3.5Å; W422-G425 WeakPolarHBondContact O-CA 3.33Å; W422-G425 PolarHBondContact O-N 3.11Å; L423-G425 PolarHBondContact O-N 3.29Å; G425-N430 PolarHBondContact O-ND2 3.12Å
426	L	88.3	Confident	88.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-78	143.4	-179.3	-67.7	163.5	0	0	0	109.8	G106 W107 Q108 R129 M130 F378 W422 N430 D431 W450	G106-L426 PolarHBondContact O-N 3.37Å; W107-L426 CarbonylContact C-O 3.55Å; W107-L426 WeakPolarHBondContact CA-O 2.9Å; W107-L426 HydrophobicContact CD2-CB 3.73Å; W107-L426 HydrophobicContact CE3-CB 3.46Å; W107-L426 VanDerWaalsContact CE3-CB 3.46Å; W107-L426 HydrophobicContact CE3-CD1 3.99Å; W107-L426 HydrophobicContact CE3-CG 4.36Å; W107-L426 HydrophobicContact CH2-CB 3.66Å; W107-L426 HydrophobicContact CH2-CD1 3.97Å; W107-L426 HydrophobicContact CH2-CG 4.36Å; W107-L426 HydrophobicContact CZ2-CB 3.9Å; W107-L426 HydrophobicContact CZ3-CB 3.42Å; W107-L426 VanDerWaalsContact CZ3-CB 3.42Å; W107-L426 HydrophobicContact CZ3-CD1 3.38Å; W107-L426 HydrophobicContact CZ3-CG 4.01Å; W107-L426 PolarHBondContact NE1-O 2.85Å; Q108-L426 PolarHBondContact N-O 2.85Å; R129-L426 HydrophobicContact CG-CD1 4.19Å; M130-L426 HydrophobicContact SD-CD1 4.44Å; F378-L426 HydrophobicContact CE2-CD1 4.34Å; F378-L426 HydrophobicContact CE2-CG 4.23Å; W422-L426 HydrophobicContact CB-CD2 3.94Å; W422-L426 HydrophobicContact CE3-CD2 4.46Å; L426-N430 WeakPolarHBondContact CA-OD1 3.24Å; L426-D431 HydrophobicContact CD2-CB 3.7Å; L426-W450 HydrophobicContact CD2-CH2 4.42Å; L426-W450 HydrophobicContact CD2-CZ2 4.49Å
427	N	84.5	Confident	88.3	Confident	63 Å²	63	31.2 Å²	31.2	34%	0.337	18%	0.18	S	C	.	.			trans	-128.4	-0.9	173.9	66.2	15.9	0	0	0	113	Q108 Q429 N430	Q108-N427 HydrophobicContact CB-CB 4.23Å; N427-Q429 VanDerWaalsContact C-N 3.32Å; N427-Q429 WeakPolarHBondContact OD1-CA 3.27Å; N427-Q429 WeakPolarHBondContact OD1-CB 3.42Å; N427-Q429 PolarHBondContact OD1-N 2.93Å; N427-N430 PolarHBondContact N-OD1 2.75Å; N427-N430 PolarHBondContact OD1-N 3.46Å; N427-N430 PolarHBondContact OD1-OD1 3.23Å
428	G	80.2	Confident	88.5	Confident	43 Å²	43	30.9 Å²	30.9	44%	0.443	18%	0.177	S	C	.	.	S	Bend	trans	82.1	6.5	-177.6	0	0	0	0	0	114.4	D431	G428-D431 VanDerWaalsContact CA-OD1 3.25Å; G428-D431 WeakPolarHBondContact CA-OD1 3.35Å
429	Q	83.1	Confident	88.6	Confident	166 Å²	166	31 Å²	31	78%	0.776	18%	0.178	S	C	*	.	S	Bend	trans	-123.1	-28.2	170.7	-61.9	-179.6	-5.6	0	0	111.8	N427 D431	N427-Q429 VanDerWaalsContact C-N 3.32Å; N427-Q429 WeakPolarHBondContact OD1-CA 3.27Å; N427-Q429 WeakPolarHBondContact OD1-CB 3.42Å; N427-Q429 PolarHBondContact OD1-N 2.93Å; Q429-D431 PolarHBondContact N-OD1 3.18Å
430	N	84	Confident	88.8	Confident	18 Å²	18	29.4 Å²	29.4	10%	0.096	17%	0.17	C	C	.	.	S	Bend	trans	-89	-1	-177.8	64.3	-2.1	0	0	0	114.2	W422 G425 L426 N427 M432	W422-N430 WeakPolarHBondContact CA-ND2 2.94Å; W422-N430 HydrophobicContact CB-CB 4.4Å; W422-N430 WeakPolarHBondContact CB-O 3.32Å; G425-N430 PolarHBondContact O-ND2 3.12Å; L426-N430 WeakPolarHBondContact CA-OD1 3.24Å; N427-N430 PolarHBondContact N-OD1 2.75Å; N427-N430 PolarHBondContact OD1-N 3.46Å; N427-N430 PolarHBondContact OD1-OD1 3.23Å; N430-M432 VanDerWaalsContact C-N 3.26Å; N430-M432 PolarHBondContact O-N 3.25Å
431	D	81.9	Confident	88.7	Confident	7 Å²	7	29.9 Å²	29.9	4%	0.037	18%	0.179	C	C	.	.	S	Bend	trans	-91.7	45.2	176.6	57.8	-38.7	0	0	0	112.3	R129 L426 G428 Q429 W450	R129-D431 IonicContact CZ-OD2 2.6Å; R129-D431 IonicContact NE-OD2 2.74Å; R129-D431 PolarHBondContact NE-OD2 3.23Å; R129-D431 IonicContact NH2-OD2 2.87Å; R129-D431 PolarHBondContact NH2-OD2 3.38Å; L426-D431 HydrophobicContact CD2-CB 3.7Å; G428-D431 VanDerWaalsContact CA-OD1 3.25Å; G428-D431 WeakPolarHBondContact CA-OD1 3.35Å; Q429-D431 PolarHBondContact N-OD1 3.18Å; D431-W450 VanDerWaalsContact C-CG 3.41Å; D431-W450 HydrophobicContact CB-CD2 4.2Å; D431-W450 HydrophobicContact CB-CE3 4.29Å; D431-W450 HydrophobicContact CB-CH2 4.43Å; D431-W450 HydrophobicContact CB-CZ2 4.35Å; D431-W450 HydrophobicContact CB-CZ3 4.41Å; D431-W450 VanDerWaalsContact O-CB 3.22Å; D431-W450 WeakPolarHBondContact O-CB 3.49Å; D431-W450 VanDerWaalsContact O-CG 3.22Å
432	M	87.2	Confident	88.8	Confident	67 Å²	67	32.7 Å²	32.7	33%	0.33	19%	0.19	S	C	.	.			trans	-135.1	156.5	-175.4	-61.3	-65.3	-71.1	0	0	110.9	N430 E452	N430-M432 VanDerWaalsContact C-N 3.26Å; N430-M432 PolarHBondContact O-N 3.25Å; M432-E452 HydrophobicContact CE-CB 3.76Å; M432-E452 HydrophobicContact CE-CG 3.5Å; M432-E452 VanDerWaalsContact CE-CG 3.5Å
433	G	88.8	Confident	88.8	Confident	31 Å²	31	36 Å²	36	32%	0.32	21%	0.205	S	C	.	.	S	Bend	trans	82.3	-153.1	173.8	0	0	0	0	0	114.8	L449 W450	G433-L449 WeakPolarHBondContact O-CA 3.29Å; G433-W450 PolarHBondContact O-N 3.46Å
434	L	93.1	Very high	88.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	131.1	-171.9	-171.4	67.1	0	0	0	112.1	Y156 L161 V175 G418 E419 F436 A437 L447 L449	Y156-L434 HydrophobicContact CD1-CD2 4.46Å; Y156-L434 HydrophobicContact CD2-CB 4.31Å; Y156-L434 HydrophobicContact CD2-CD2 3.45Å; Y156-L434 VanDerWaalsContact CD2-CD2 3.45Å; Y156-L434 HydrophobicContact CE1-CB 4.42Å; Y156-L434 HydrophobicContact CE2-CB 3.81Å; Y156-L434 HydrophobicContact CE2-CD2 3.82Å; Y156-L434 HydrophobicContact CE2-CG 4.49Å; Y156-L434 HydrophobicContact CG-CD2 3.8Å; L161-L434 HydrophobicContact CD1-CD2 4.43Å; V175-L434 HydrophobicContact CG1-CB 4.26Å; V175-L434 HydrophobicContact CG1-CD1 4.35Å; G418-L434 CarbonylContact C-O 3.57Å; G418-L434 VanDerWaalsContact CA-O 3.26Å; G418-L434 WeakPolarHBondContact CA-O 3.19Å; E419-L434 PolarHBondContact N-O 3.21Å; L434-F436 WeakPolarHBondContact CD1-O 3.2Å; L434-A437 HydrophobicContact CD1-CB 4.4Å; L434-A437 HydrophobicContact CD2-CB 4.1Å; L434-L447 HydrophobicContact CD1-CB 3.94Å; L434-L447 HydrophobicContact CD1-CD2 3.84Å; L434-L447 HydrophobicContact CD1-CG 4.34Å; L434-L449 HydrophobicContact CB-CD2 4.28Å; L434-L449 HydrophobicContact CD1-CD2 3.78Å
435	V	92.7	Very high	89.1	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-47.9	171.9	-179.6	0	0	0	0	110.2	F139 L380 G418 W422 V448 W450	F139-V435 HydrophobicContact CD1-CG2 3.93Å; F139-V435 HydrophobicContact CE1-CG1 4.31Å; F139-V435 HydrophobicContact CE1-CG2 3.7Å; F139-V435 HydrophobicContact CZ-CG1 4.28Å; F139-V435 HydrophobicContact CZ-CG2 4.46Å; L380-V435 HydrophobicContact CD2-CG1 4Å; G418-V435 PolarHBondContact N-O 3.49Å; W422-V435 HydrophobicContact CZ2-CG1 4.32Å; V435-V448 WeakPolarHBondContact CA-O 3.42Å; V435-V448 HydrophobicContact CB-CG1 4.39Å; V435-V448 WeakPolarHBondContact CB-O 3.47Å; V435-V448 PolarHBondContact N-O 3.05Å; V435-W450 HydrophobicContact CG2-CD2 4.27Å; V435-W450 HydrophobicContact CG2-CG 3.9Å
436	F	93.8	Very high	89.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	140.9	-176.5	175.1	-110.6	0	0	0	111.2	L372 L387 L403 F415 L416 L434 T438 L447 V448	L372-F436 HydrophobicContact CD1-CD2 4.02Å; L372-F436 HydrophobicContact CD1-CE2 4.1Å; L372-F436 HydrophobicContact CD2-CB 4.28Å; L372-F436 HydrophobicContact CD2-CD2 3.29Å; L372-F436 HydrophobicContact CD2-CE2 3.87Å; L372-F436 HydrophobicContact CD2-CG 4.15Å; L372-F436 HydrophobicContact CG-CD2 4.28Å; L387-F436 HydrophobicContact CD1-CB 3.8Å; L387-F436 HydrophobicContact CD1-CD1 4.14Å; L387-F436 HydrophobicContact CD1-CG 4.09Å; L387-F436 HydrophobicContact CD2-CB 4.15Å; L387-F436 HydrophobicContact CD2-CD1 4.16Å; L387-F436 HydrophobicContact CD2-CD2 3.92Å; L387-F436 HydrophobicContact CD2-CE1 4.49Å; L387-F436 HydrophobicContact CD2-CE2 4.21Å; L387-F436 HydrophobicContact CD2-CG 3.83Å; L387-F436 HydrophobicContact CD2-CZ 4.49Å; L403-F436 HydrophobicContact CD1-CE1 3.9Å; L403-F436 HydrophobicContact CD1-CZ 4.15Å; L403-F436 HydrophobicContact CD2-CD1 3.78Å; L403-F436 HydrophobicContact CD2-CE1 3.68Å; L403-F436 HydrophobicContact CG-CE1 4.45Å; F415-F436 HydrophobicContact CB-CE2 3.75Å; F415-F436 HydrophobicContact CB-CZ 3.92Å; L416-F436 WeakPolarHBondContact O-CA 3.41Å; L416-F436 WeakPolarHBondContact O-CD2 3.26Å; L434-F436 WeakPolarHBondContact CD1-O 3.2Å; F436-T438 HydrophobicContact CD1-CG2 4.49Å; F436-T438 HydrophobicContact CE1-CG2 3.6Å; F436-T438 HydrophobicContact CZ-CG2 4.1Å; F436-L447 CarbonylContact O-C 3.5Å; F436-L447 WeakPolarHBondContact O-CA 3.17Å; F436-V448 HydrophobicContact CB-CB 4.08Å; F436-V448 HydrophobicContact CB-CG2 4.23Å; F436-V448 HydrophobicContact CD1-CG2 4.02Å; F436-V448 PolarHBondContact N-O 3.39Å; F436-V448 PolarHBondContact O-N 3.3Å
437	A	93.7	Very high	89.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	142.1	169.3	0	0	0	0	0	110.3	L154 L161 F415 L416 L434 I445 H446 L447	L154-A437 HydrophobicContact CD1-CB 4.36Å; L161-A437 HydrophobicContact CD1-CB 4.35Å; L161-A437 HydrophobicContact CD2-CB 4.33Å; F415-A437 CarbonylContact C-O 3.6Å; F415-A437 WeakPolarHBondContact CA-O 3.42Å; L416-A437 PolarHBondContact N-O 3.38Å; L416-A437 PolarHBondContact O-N 3.35Å; L434-A437 HydrophobicContact CD1-CB 4.4Å; L434-A437 HydrophobicContact CD2-CB 4.1Å; A437-I445 HydrophobicContact CB-CG2 4.44Å; A437-H446 CarbonylContact C-O 3.56Å; A437-H446 VanDerWaalsContact CA-O 3.28Å; A437-H446 WeakPolarHBondContact CA-O 3.49Å; A437-L447 HydrophobicContact CB-CD2 3.58Å
438	T	93.1	Very high	90.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	150.3	174.6	-168.6	0	0	0	0	112.3	Y406 S414 F436 M440 I445 H446	Y406-T438 HydrophobicContact CD1-CG2 4.24Å; Y406-T438 HydrophobicContact CD2-CG2 4.24Å; Y406-T438 WeakPolarHBondContact CD2-OG1 3.34Å; Y406-T438 WeakPolarHBondContact CE2-OG1 3.32Å; Y406-T438 HydrophobicContact CG-CG2 4.04Å; S414-T438 CarbonylContact O-C 3.56Å; S414-T438 WeakPolarHBondContact O-CA 3.41Å; S414-T438 PolarHBondContact O-OG1 3.48Å; F436-T438 HydrophobicContact CD1-CG2 4.49Å; F436-T438 HydrophobicContact CE1-CG2 3.6Å; F436-T438 HydrophobicContact CZ-CG2 4.1Å; T438-M440 HydrophobicContact CG2-SD 4.14Å; T438-I445 CarbonylContact O-C 3.46Å; T438-I445 WeakPolarHBondContact O-CA 3.39Å; T438-H446 HydrophobicContact CG2-CB 4Å; T438-H446 PolarHBondContact N-O 2.64Å; T438-H446 PolarHBondContact O-N 2.58Å
439	S	92.1	Very high	90.8	Very high	7 Å²	7	30.7 Å²	30.7	5%	0.049	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.8	171.8	175	0	0	0	0	111.1	V151 S414	V151-S439 WeakPolarHBondContact O-CB 3.28Å; V151-S439 PolarHBondContact O-OG 3.44Å; S414-S439 PolarHBondContact O-N 2.55Å
440	M	91.8	Very high	91.2	Very high	27 Å²	27	22.9 Å²	22.9	13%	0.133	13%	0.13	C	C	.	.			trans	-97.6	158.3	-179.9	-64.1	-56.8	-69.6	0	0	112.3	P404 T438 D442 H443 S444 H446	P404-M440 HydrophobicContact CB-CE 3.76Å; P404-M440 HydrophobicContact CG-CE 3.7Å; P404-M440 HydrophobicContact CG-SD 3.98Å; T438-M440 HydrophobicContact CG2-SD 4.14Å; M440-D442 WeakPolarHBondContact CB-OD1 3.25Å; M440-D442 PolarHBondContact O-N 3.09Å; M440-H443 PolarHBondContact O-N 3.46Å; M440-H443 VanDerWaalsContact O-N 3.07Å; M440-S444 WeakPolarHBondContact CB-O 3.46Å; M440-S444 WeakPolarHBondContact CB-OG 3.31Å; M440-S444 PolarHBondContact N-O 2.95Å; M440-H446 HydrophobicContact CG-CB 3.63Å; M440-H446 HydrophobicContact SD-CB 3.69Å
441	P	87.6	Confident	91.5	Very high	86 Å²	86	26.3 Å²	26.3	56%	0.558	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.1	178	-24.9	35.6	0	0	0	114.4	H443	P441-H443 PolarHBondContact O-CE1 3.27Å; P441-H443 PolarHBondContact O-N 3.35Å; P441-H443 PolarHBondContact O-ND1 3Å
442	D	89.3	Confident	90.9	Very high	109 Å²	109	32 Å²	32	58%	0.583	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	11.4	177.5	68.9	-10.9	0	0	0	113.7	M440 S444	M440-D442 WeakPolarHBondContact CB-OD1 3.25Å; M440-D442 PolarHBondContact O-N 3.09Å; D442-S444 VanDerWaalsContact CG-OG 3.32Å; D442-S444 PolarHBondContact O-N 2.88Å; D442-S444 VanDerWaalsContact OD1-CB 3.32Å; D442-S444 WeakPolarHBondContact OD1-CB 3.5Å; D442-S444 PolarHBondContact OD1-N 3.37Å; D442-S444 PolarHBondContact OD1-OG 3.45Å; D442-S444 PolarHBondContact OD2-OG 2.86Å
443	H	90.8	Very high	89.6	Confident	70 Å²	70	36.7 Å²	36.7	32%	0.324	19%	0.192	S	C	.	.	S	Bend	trans	72.5	0.4	179.7	-42.6	-35.2	0	0	0	114.8	A149 M440 P441	A149-H443 WeakPolarHBondContact O-CB 3.49Å; M440-H443 PolarHBondContact O-N 3.46Å; M440-H443 VanDerWaalsContact O-N 3.07Å; P441-H443 PolarHBondContact O-CE1 3.27Å; P441-H443 PolarHBondContact O-N 3.35Å; P441-H443 PolarHBondContact O-ND1 3Å
444	S	92.7	Very high	87.4	Confident	10 Å²	10	37.9 Å²	37.9	7%	0.07	20%	0.204	C	C	.	.			trans	-73.9	163.6	170.1	73.7	0	0	0	0	111.5	L144 M440 D442	L144-S444 WeakPolarHBondContact O-CA 3.24Å; M440-S444 WeakPolarHBondContact CB-O 3.46Å; M440-S444 WeakPolarHBondContact CB-OG 3.31Å; M440-S444 PolarHBondContact N-O 2.95Å; D442-S444 VanDerWaalsContact CG-OG 3.32Å; D442-S444 PolarHBondContact O-N 2.88Å; D442-S444 VanDerWaalsContact OD1-CB 3.32Å; D442-S444 WeakPolarHBondContact OD1-CB 3.5Å; D442-S444 PolarHBondContact OD1-N 3.37Å; D442-S444 PolarHBondContact OD1-OG 3.45Å; D442-S444 PolarHBondContact OD2-OG 2.86Å
445	I	94.3	Very high	87.1	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.3	171.6	-55.4	137.7	0	0	0	107.1	S143 L144 V151 L154 L161 T163 W173 A437 T438 L447	S143-I445 CarbonylContact C-O 3.52Å; S143-I445 VanDerWaalsContact CA-O 3.27Å; S143-I445 WeakPolarHBondContact CA-O 3.29Å; L144-I445 HydrophobicContact CB-CB 4.18Å; L144-I445 HydrophobicContact CB-CD1 4.05Å; L144-I445 HydrophobicContact CD1-CD1 4.4Å; L144-I445 PolarHBondContact N-O 2.77Å; L144-I445 PolarHBondContact O-N 3.29Å; V151-I445 HydrophobicContact CG2-CG1 4.38Å; L154-I445 HydrophobicContact CD2-CG1 4.49Å; L154-I445 HydrophobicContact CD2-CG2 4.28Å; L161-I445 HydrophobicContact CD2-CG2 3.94Å; T163-I445 HydrophobicContact CG2-CD1 3.32Å; T163-I445 HydrophobicContact CG2-CG1 3.99Å; W173-I445 HydrophobicContact CZ2-CD1 4.23Å; A437-I445 HydrophobicContact CB-CG2 4.44Å; T438-I445 CarbonylContact O-C 3.46Å; T438-I445 WeakPolarHBondContact O-CA 3.39Å; I445-L447 HydrophobicContact CG2-CD2 3.83Å
446	H	94.7	Very high	86.8	Confident	24 Å²	24	41.8 Å²	41.8	11%	0.111	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	130.7	175	-178.7	73.9	0	0	0	110	P404 A437 T438 M440	P404-H446 WeakPolarHBondContact CD-NE2 3.27Å; A437-H446 CarbonylContact C-O 3.56Å; A437-H446 VanDerWaalsContact CA-O 3.28Å; A437-H446 WeakPolarHBondContact CA-O 3.49Å; T438-H446 HydrophobicContact CG2-CB 4Å; T438-H446 PolarHBondContact N-O 2.64Å; T438-H446 PolarHBondContact O-N 2.58Å; M440-H446 HydrophobicContact CG-CB 3.63Å; M440-H446 HydrophobicContact SD-CB 3.69Å
447	L	95.1	Very high	86.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	140.4	179.5	-52.4	-179.6	0	0	0	109.8	T141 S142 L144 L161 V175 L434 F436 A437 I445 L449	T141-L447 VanDerWaalsContact CA-O 3.26Å; T141-L447 WeakPolarHBondContact CA-O 3.26Å; S142-L447 PolarHBondContact N-O 2.95Å; S142-L447 PolarHBondContact O-N 3.36Å; S142-L447 WeakPolarHBondContact OG-CB 3.48Å; L144-L447 HydrophobicContact CD1-CD1 3.87Å; L144-L447 HydrophobicContact CD1-CD2 4.46Å; L144-L447 HydrophobicContact CD1-CG 4.48Å; L144-L447 HydrophobicContact CD2-CD1 4.16Å; L144-L447 HydrophobicContact CG-CD1 3.77Å; L144-L447 HydrophobicContact CG-CG 4.35Å; L161-L447 HydrophobicContact CD2-CD2 3.81Å; V175-L447 HydrophobicContact CG1-CD1 4.21Å; L434-L447 HydrophobicContact CD1-CB 3.94Å; L434-L447 HydrophobicContact CD1-CD2 3.84Å; L434-L447 HydrophobicContact CD1-CG 4.34Å; F436-L447 CarbonylContact O-C 3.5Å; F436-L447 WeakPolarHBondContact O-CA 3.17Å; A437-L447 HydrophobicContact CB-CD2 3.58Å; I445-L447 HydrophobicContact CG2-CD2 3.83Å; L447-L449 HydrophobicContact CB-CG 4.47Å
448	V	94.7	Very high	86	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.2	166.8	-176.8	0	0	0	0	106.6	F139 E140 T141 L387 L403 V435 F436	F139-V448 HydrophobicContact CB-CG1 3.71Å; F139-V448 HydrophobicContact CD2-CG1 4.18Å; F139-V448 HydrophobicContact CG-CG1 3.91Å; E140-V448 WeakPolarHBondContact O-CA 3.32Å; T141-V448 HydrophobicContact CG2-CG2 4.36Å; L387-V448 HydrophobicContact CD1-CB 4.37Å; L387-V448 HydrophobicContact CD1-CG1 4.24Å; L387-V448 HydrophobicContact CD1-CG2 4.07Å; L403-V448 HydrophobicContact CD2-CG2 4.14Å; V435-V448 WeakPolarHBondContact CA-O 3.42Å; V435-V448 HydrophobicContact CB-CG1 4.39Å; V435-V448 WeakPolarHBondContact CB-O 3.47Å; V435-V448 PolarHBondContact N-O 3.05Å; F436-V448 HydrophobicContact CB-CB 4.08Å; F436-V448 HydrophobicContact CB-CG2 4.23Å; F436-V448 HydrophobicContact CD1-CG2 4.02Å; F436-V448 PolarHBondContact N-O 3.39Å; F436-V448 PolarHBondContact O-N 3.3Å
449	L	93.5	Very high	85.6	Confident	20 Å²	20	49.7 Å²	49.7	11%	0.105	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	152.3	-174.9	-58.5	170.2	0	0	0	109.9	F139 E140 S142 V175 G433 L434 L447	F139-L449 CarbonylContact C-O 3.33Å; F139-L449 WeakPolarHBondContact CA-O 3.29Å; F139-L449 WeakPolarHBondContact CB-O 3.26Å; E140-L449 HydrophobicContact CG-CB 3.94Å; E140-L449 PolarHBondContact N-O 3.25Å; E140-L449 PolarHBondContact O-N 2.55Å; S142-L449 WeakPolarHBondContact OG-CD1 3.21Å; V175-L449 HydrophobicContact CG1-CD2 3.48Å; V175-L449 VanDerWaalsContact CG1-CD2 3.48Å; G433-L449 WeakPolarHBondContact O-CA 3.29Å; L434-L449 HydrophobicContact CB-CD2 4.28Å; L434-L449 HydrophobicContact CD1-CD2 3.78Å; L447-L449 HydrophobicContact CB-CG 4.47Å
450	W	91.4	Very high	85.1	Confident	3 Å²	3	52.5 Å²	52.5	1%	0.011	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	138.6	164.7	-80.2	107.4	0	0	0	110.9	L133 A138 F139 W422 L426 D431 G433 V435 E452	L133-W450 HydrophobicContact CD1-CH2 4.35Å; L133-W450 HydrophobicContact CD2-CH2 3.79Å; L133-W450 HydrophobicContact CD2-CZ3 3.99Å; L133-W450 HydrophobicContact CG-CH2 4.41Å; A138-W450 HydrophobicContact CB-CE3 4.43Å; A138-W450 HydrophobicContact CB-CZ3 3.94Å; F139-W450 HydrophobicContact CD1-CD2 4.15Å; F139-W450 HydrophobicContact CD1-CE3 4Å; F139-W450 HydrophobicContact CD1-CZ3 4.38Å; F139-W450 AromaticContact CE1-CD2 3.71Å; F139-W450 HydrophobicContact CE1-CD2 3.71Å; F139-W450 AromaticContact CE1-CE2 3.81Å; F139-W450 AromaticContact CE1-CE3 3.63Å; F139-W450 HydrophobicContact CE1-CE3 3.63Å; F139-W450 HydrophobicContact CE1-CG 4.45Å; F139-W450 AromaticContact CE1-CH2 3.82Å; F139-W450 HydrophobicContact CE1-CH2 3.82Å; F139-W450 AromaticContact CE1-CZ2 3.88Å; F139-W450 HydrophobicContact CE1-CZ2 3.88Å; F139-W450 AromaticContact CE1-CZ3 3.69Å; F139-W450 HydrophobicContact CE1-CZ3 3.69Å; F139-W450 HydrophobicContact CZ-CH2 4.27Å; F139-W450 HydrophobicContact CZ-CZ2 4.41Å; F139-W450 HydrophobicContact CZ-CZ3 4.43Å; W422-W450 AromaticContact CD1-NE1 3.79Å; W422-W450 AromaticContact CD2-CZ2 3.73Å; W422-W450 HydrophobicContact CD2-CZ2 3.73Å; W422-W450 AromaticContact CE2-CZ2 3.95Å; W422-W450 AromaticContact CE3-CZ2 3.86Å; W422-W450 HydrophobicContact CE3-CZ2 3.86Å; W422-W450 HydrophobicContact CG-CZ2 4.15Å; W422-W450 HydrophobicContact CH2-CZ2 4.38Å; W422-W450 HydrophobicContact CZ2-CZ2 4.28Å; W422-W450 HydrophobicContact CZ3-CZ2 4.18Å; W422-W450 AromaticContact NE1-NE1 3.78Å; L426-W450 HydrophobicContact CD2-CH2 4.42Å; L426-W450 HydrophobicContact CD2-CZ2 4.49Å; D431-W450 VanDerWaalsContact C-CG 3.41Å; D431-W450 HydrophobicContact CB-CD2 4.2Å; D431-W450 HydrophobicContact CB-CE3 4.29Å; D431-W450 HydrophobicContact CB-CH2 4.43Å; D431-W450 HydrophobicContact CB-CZ2 4.35Å; D431-W450 HydrophobicContact CB-CZ3 4.41Å; D431-W450 VanDerWaalsContact O-CB 3.22Å; D431-W450 WeakPolarHBondContact O-CB 3.49Å; D431-W450 VanDerWaalsContact O-CG 3.22Å; G433-W450 PolarHBondContact O-N 3.46Å; V435-W450 HydrophobicContact CG2-CD2 4.27Å; V435-W450 HydrophobicContact CG2-CG 3.9Å; W450-E452 PolarHBondContact O-N 2.79Å
451	K	88.8	Confident	84.6	Confident	90 Å²	90	54.4 Å²	54.4	39%	0.391	29%	0.292	S	S	.	.			trans	-79.3	117.6	174.2	-167.9	176.7	-179.2	-179.7	0	110.4	A138 H453	A138-K451 WeakPolarHBondContact O-CB 3.34Å; A138-K451 PolarHBondContact O-N 3.1Å; K451-H453 PolarHBondContact O-N 2.98Å
452	E	69.4	Low	84.4	Confident	127 Å²	127	51.9 Å²	51.9	59%	0.593	27%	0.272	S	S	*	.	S	Bend	trans	-62.6	-25.2	-172.4	-58.7	-159.7	141.1	0	0	114.6	M432 W450	M432-E452 HydrophobicContact CE-CB 3.76Å; M432-E452 HydrophobicContact CE-CG 3.5Å; M432-E452 VanDerWaalsContact CE-CG 3.5Å; W450-E452 PolarHBondContact O-N 2.79Å
453	H	59.4	Low	84	Confident	165 Å²	165	47.2 Å²	47.2	76%	0.764	25%	0.246	S	C	*	.			trans	-124.5	83.4	-179.3	-62.4	-26.7	0	0	0	110	K451	K451-H453 PolarHBondContact O-N 2.98Å
454	G	43.4	Very low	83.4	Confident	56 Å²	56	45.1 Å²	45.1	58%	0.577	24%	0.239	S	C	*	.			trans	-108.4	0	170.9	0	0	0	0	0	111.8	L128 Q132	L128-G454 VanDerWaalsContact CD2-OXT 3.26Å; L128-G454 WeakPolarHBondContact CD2-OXT 3.4Å; Q132-G454 PolarHBondContact NE2-OXT 3.41Å

Retrieved 454 of 454 residues in 902.3 ms (Link to these results)

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