A0A093I2U5_STRCA Loading...

Neutrophil cytosol factor 4

Subunit of the phagocyte NADPH oxidase complex that mediates the transfer of electrons from cytosolic NADPH to O2 to produce the superoxide anion (O2(-)). In the activated complex, electrons are first transferred from NADPH to flavin adenine dinucleotide (FAD) and subsequently transferred via two heme molecules to molecular oxygen, producing superoxide through an outer-sphere reaction. Activation of the NADPH oxidase complex is initiated by the assembly of cytosolic subunits of the NADPH oxidase complex with the core NADPH oxidase complex to form a complex at the plasma membrane or phagosomal membrane. This activation process is initiated by phosphorylation dependent binding of the cytosolic NCF1/p47-phox subunit to the C-terminus of CYBA/p22-phox.

AlphaFold DB , UniProt , Accession A0A093I2U5, Species STRCA (Struthio camelus australis), Gene n/a, Length 350 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	55.8	Low	71.9	Confident	146 Å²	146	115.5 Å²	115.5	72%	0.719	56%	0.564	S	S	*	*				0	132.2	0	-69.7	-76.4	-99.2	0	0	107.7	Q6 E9	M1-Q6 HydrophobicContact CB-CG 4.04Å; M1-E9 WeakPolarHBondContact CE-OE1 3.38Å; M1-E9 WeakPolarHBondContact CE-OE2 3.17Å
2	S	76.8	Confident	72.5	Confident	64 Å²	64	111 Å²	111	45%	0.448	54%	0.544	S	S	.	.			trans	-76.7	148.9	177.6	56.5	0	0	0	0	110.9	P4 R5 Q6	S2-P4 VanDerWaalsContact C-CD 3.4Å; S2-P4 VanDerWaalsContact C-N 3.31Å; S2-R5 WeakPolarHBondContact O-CB 3.13Å; S2-R5 PolarHBondContact O-N 2.71Å; S2-Q6 PolarHBondContact O-N 3.43Å
3	L	70.1	Confident	72.9	Confident	125 Å²	125	109 Å²	109	65%	0.654	53%	0.531	S	S	*	.	H	α-helix	trans	-50.6	-41.2	-179.2	-164.2	86.7	0	0	0	113.6	R5 Q6 L7	L3-R5 VanDerWaalsContact C-N 3.34Å; L3-R5 PolarHBondContact O-N 3.22Å; L3-Q6 PolarHBondContact O-N 3.44Å; L3-L7 WeakPolarHBondContact O-CG 3.4Å; L3-L7 PolarHBondContact O-N 3.38Å; L3-L7 VanDerWaalsContact O-N 3.15Å
4	P	72.4	Confident	73.5	Confident	93 Å²	93	108.1 Å²	108.1	60%	0.604	53%	0.53	S	S	*	.	H	α-helix	trans	-66.7	-31.8	177.7	-22.2	35.6	0	0	0	113.8	S2 R8	S2-P4 VanDerWaalsContact C-CD 3.4Å; S2-P4 VanDerWaalsContact C-N 3.31Å; P4-R8 PolarHBondContact O-N 2.91Å
5	R	71.1	Confident	74.1	Confident	162 Å²	162	110.7 Å²	110.7	61%	0.611	54%	0.541	S	S	*	.	H	α-helix	trans	-69.2	-41.9	175.8	-77.5	-175.1	169.2	-174.6	-2.3	111.2	S2 L3 L7 R8 E9	S2-R5 WeakPolarHBondContact O-CB 3.13Å; S2-R5 PolarHBondContact O-N 2.71Å; L3-R5 VanDerWaalsContact C-N 3.34Å; L3-R5 PolarHBondContact O-N 3.22Å; R5-L7 VanDerWaalsContact C-N 3.35Å; R5-L7 PolarHBondContact O-N 3.22Å; R5-R8 PolarHBondContact O-N 2.92Å; R5-E9 WeakPolarHBondContact O-CB 3.44Å; R5-E9 WeakPolarHBondContact O-CG 3.28Å; R5-E9 PolarHBondContact O-N 3.01Å
6	Q	71.3	Confident	74.7	Confident	100 Å²	100	104.6 Å²	104.6	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-40.8	177.5	-69	177.4	-32.1	0	0	112.4	M1 S2 L3 K10	M1-Q6 HydrophobicContact CB-CG 4.04Å; S2-Q6 PolarHBondContact O-N 3.43Å; L3-Q6 PolarHBondContact O-N 3.44Å; Q6-K10 VanDerWaalsContact O-CB 3.28Å; Q6-K10 WeakPolarHBondContact O-CB 3.49Å; Q6-K10 PolarHBondContact O-N 2.83Å
7	L	70.5	Confident	75.4	Confident	112 Å²	112	101.3 Å²	101.3	59%	0.586	50%	0.499	S	S	*	.	H	α-helix	trans	-66.6	-39	177.4	-69.4	171.7	0	0	0	112.1	L3 R5 S11	L3-L7 WeakPolarHBondContact O-CG 3.4Å; L3-L7 PolarHBondContact O-N 3.38Å; L3-L7 VanDerWaalsContact O-N 3.15Å; R5-L7 VanDerWaalsContact C-N 3.35Å; R5-L7 PolarHBondContact O-N 3.22Å; L7-S11 WeakPolarHBondContact O-CB 3.32Å; L7-S11 PolarHBondContact O-N 2.81Å
8	R	74.9	Confident	75.8	Confident	180 Å²	180	101.6 Å²	101.6	68%	0.679	50%	0.503	S	S	*	.	H	α-helix	trans	-67	-48	176.6	-171.9	174	-178.1	173	1.3	111.7	P4 R5 K10 S11 D12	P4-R8 PolarHBondContact O-N 2.91Å; R5-R8 PolarHBondContact O-N 2.92Å; R8-K10 VanDerWaalsContact C-N 3.26Å; R8-K10 PolarHBondContact O-N 2.95Å; R8-S11 WeakPolarHBondContact O-CB 3.29Å; R8-S11 PolarHBondContact O-N 3Å; R8-S11 VanDerWaalsContact O-N 3.16Å; R8-D12 WeakPolarHBondContact O-CB 3.41Å; R8-D12 PolarHBondContact O-N 3.33Å
9	E	74.7	Confident	76.1	Confident	99 Å²	99	100 Å²	100	46%	0.463	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-37.3	176.8	-74.4	168.5	-170.1	0	0	112.2	M1 R5 F13	M1-E9 WeakPolarHBondContact CE-OE1 3.38Å; M1-E9 WeakPolarHBondContact CE-OE2 3.17Å; R5-E9 WeakPolarHBondContact O-CB 3.44Å; R5-E9 WeakPolarHBondContact O-CG 3.28Å; R5-E9 PolarHBondContact O-N 3.01Å; E9-F13 VanDerWaalsContact O-CB 3.28Å; E9-F13 WeakPolarHBondContact O-CB 3.04Å; E9-F13 PolarHBondContact O-N 3.04Å
10	K	74.4	Confident	76.7	Confident	135 Å²	135	95.2 Å²	95.2	59%	0.587	47%	0.473	S	S	*	.	H	α-helix	trans	-64.9	-46.6	174.4	-172.1	175.6	-179.6	-179.8	0	111.8	Q6 R8 D12 F13 D14	Q6-K10 VanDerWaalsContact O-CB 3.28Å; Q6-K10 WeakPolarHBondContact O-CB 3.49Å; Q6-K10 PolarHBondContact O-N 2.83Å; R8-K10 VanDerWaalsContact C-N 3.26Å; R8-K10 PolarHBondContact O-N 2.95Å; K10-D12 PolarHBondContact O-N 2.89Å; K10-F13 PolarHBondContact O-N 2.76Å; K10-D14 WeakPolarHBondContact O-CB 3.44Å; K10-D14 PolarHBondContact O-N 2.95Å
11	S	78.4	Confident	77.3	Confident	55 Å²	55	91 Å²	91	39%	0.385	45%	0.453	S	S	.	.	H	α-helix	trans	-60.6	-44.2	175.6	178.5	0	0	0	0	112.1	L7 R8 F13 D14 Q15	L7-S11 WeakPolarHBondContact O-CB 3.32Å; L7-S11 PolarHBondContact O-N 2.81Å; R8-S11 WeakPolarHBondContact O-CB 3.29Å; R8-S11 PolarHBondContact O-N 3Å; R8-S11 VanDerWaalsContact O-N 3.16Å; S11-F13 VanDerWaalsContact C-N 3.34Å; S11-D14 PolarHBondContact O-N 2.96Å; S11-Q15 WeakPolarHBondContact O-CG 3.37Å; S11-Q15 PolarHBondContact O-N 2.94Å
12	D	79.1	Confident	79	Confident	61 Å²	61	87.1 Å²	87.1	33%	0.326	44%	0.437	S	S	.	.	H	α-helix	trans	-66	-38.9	-179.9	-66.1	-14.2	0	0	0	110.8	R8 K10 I121	R8-D12 WeakPolarHBondContact O-CB 3.41Å; R8-D12 PolarHBondContact O-N 3.33Å; K10-D12 PolarHBondContact O-N 2.89Å; D12-I121 HydrophobicContact CB-CD1 3.62Å
13	F	78.4	Confident	79.8	Confident	85 Å²	85	85.7 Å²	85.7	37%	0.373	43%	0.427	S	S	.	.	H	α-helix	trans	-66.3	-41.4	173.9	-176.9	-95	0	0	0	112.4	E9 K10 S11 Q15 L16 V22 K48	E9-F13 VanDerWaalsContact O-CB 3.28Å; E9-F13 WeakPolarHBondContact O-CB 3.04Å; E9-F13 PolarHBondContact O-N 3.04Å; K10-F13 PolarHBondContact O-N 2.76Å; S11-F13 VanDerWaalsContact C-N 3.34Å; F13-Q15 PolarHBondContact O-N 2.86Å; F13-L16 HydrophobicContact CD2-CD1 3.89Å; F13-L16 HydrophobicContact CE2-CD1 4.34Å; F13-L16 WeakPolarHBondContact O-CB 3.27Å; F13-L16 WeakPolarHBondContact O-CG 3.33Å; F13-L16 PolarHBondContact O-N 3.37Å; F13-L16 VanDerWaalsContact O-N 3.09Å; F13-V22 HydrophobicContact CE2-CG1 3.83Å; F13-V22 HydrophobicContact CZ-CG1 3.83Å; F13-K48 HydrophobicContact CE1-CD 3.97Å; F13-K48 HydrophobicContact CE1-CG 4.03Å; F13-K48 HydrophobicContact CZ-CD 4.01Å; F13-K48 HydrophobicContact CZ-CG 3.9Å; F13-K48 PolarHBondContact O-NZ 3.07Å
14	D	80.8	Confident	81	Confident	96 Å²	96	79.9 Å²	79.9	51%	0.513	40%	0.397	S	S	.	.	H	α-helix	trans	-63.1	-29	-179.5	-73.8	-20.4	0	0	0	112.2	K10 S11 L16 K48	K10-D14 WeakPolarHBondContact O-CB 3.44Å; K10-D14 PolarHBondContact O-N 2.95Å; S11-D14 PolarHBondContact O-N 2.96Å; D14-L16 VanDerWaalsContact C-N 3.3Å; D14-L16 PolarHBondContact O-N 3.36Å; D14-K48 VanDerWaalsContact C-NZ 3.26Å; D14-K48 PolarHBondContact O-NZ 2.81Å
15	Q	83.1	Confident	82.1	Confident	148 Å²	148	78.9 Å²	78.9	69%	0.692	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.2	176.1	-68.7	175.6	18.2	0	0	114.5	S11 F13	S11-Q15 WeakPolarHBondContact O-CG 3.37Å; S11-Q15 PolarHBondContact O-N 2.94Å; F13-Q15 PolarHBondContact O-N 2.86Å
16	L	84.1	Confident	83.1	Confident	12 Å²	12	72.1 Å²	72.1	6%	0.063	36%	0.362	C	S	.	.	S	Bend	trans	-68.4	144.1	177.8	-64.2	175.2	0	0	0	111.8	F13 D14 V20 K48 I121 M125	F13-L16 HydrophobicContact CD2-CD1 3.89Å; F13-L16 HydrophobicContact CE2-CD1 4.34Å; F13-L16 WeakPolarHBondContact O-CB 3.27Å; F13-L16 WeakPolarHBondContact O-CG 3.33Å; F13-L16 PolarHBondContact O-N 3.37Å; F13-L16 VanDerWaalsContact O-N 3.09Å; D14-L16 VanDerWaalsContact C-N 3.3Å; D14-L16 PolarHBondContact O-N 3.36Å; L16-V20 HydrophobicContact CB-CG2 4.22Å; L16-V20 HydrophobicContact CD1-CG1 4.4Å; L16-K48 HydrophobicContact CB-CD 4.17Å; L16-K48 PolarHBondContact O-NZ 3.32Å; L16-I121 HydrophobicContact CD1-CD1 4.48Å; L16-I121 HydrophobicContact CD1-CG1 4.31Å; L16-I121 HydrophobicContact CD2-CB 4.45Å; L16-I121 HydrophobicContact CD2-CD1 4.37Å; L16-I121 HydrophobicContact CD2-CG1 4.2Å; L16-I121 HydrophobicContact CD2-CG2 3.53Å; L16-M125 HydrophobicContact CD2-CE 3.9Å; L16-M125 HydrophobicContact CD2-CG 4.48Å; L16-M125 HydrophobicContact CD2-SD 4.47Å
17	P	85.1	Confident	83.9	Confident	49 Å²	49	70.4 Å²	70.4	32%	0.318	37%	0.365	S	S	.	.			trans	-57.9	153.3	169.8	-25.9	36.3	0	0	0	113.1	D19 V20 M125	P17-D19 VanDerWaalsContact C-N 3.25Å; P17-D19 WeakPolarHBondContact CB-OD1 3.36Å; P17-D19 PolarHBondContact O-N 3.37Å; P17-V20 HydrophobicContact CB-CG2 4.18Å; P17-V20 HydrophobicContact CG-CG2 4.38Å; P17-V20 WeakPolarHBondContact O-CB 3.24Å; P17-V20 WeakPolarHBondContact O-CG2 3.23Å; P17-V20 PolarHBondContact O-N 3.1Å; P17-M125 HydrophobicContact CG-CE 3.84Å
18	D	83.8	Confident	84.8	Confident	106 Å²	106	66 Å²	66	57%	0.567	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-20.6	-178.1	-72.8	-28.2	0	0	0	113.8	V20 I47 K48 G49	D18-V20 VanDerWaalsContact C-N 3.26Å; D18-V20 PolarHBondContact O-N 3.25Å; D18-I47 WeakPolarHBondContact O-CB 3.23Å; D18-K48 PolarHBondContact O-N 2.76Å; D18-G49 PolarHBondContact O-N 2.95Å
19	D	81.8	Confident	85.5	Confident	72 Å²	72	58.7 Å²	58.7	39%	0.385	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.6	177.8	71.5	-41.8	0	0	0	113.4	P17 I47 R130	P17-D19 VanDerWaalsContact C-N 3.25Å; P17-D19 WeakPolarHBondContact CB-OD1 3.36Å; P17-D19 PolarHBondContact O-N 3.37Å; D19-I47 WeakPolarHBondContact O-CG2 3.09Å; D19-R130 IonicContact OD1-NH2 2.74Å; D19-R130 PolarHBondContact OD1-NH2 2.81Å; D19-R130 IonicContact OD2-CZ 2.67Å; D19-R130 IonicContact OD2-NH2 3.62Å; D19-R130 PolarHBondContact OD2-NH2 3.09Å
20	V	87.1	Confident	86.2	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.018	30%	0.295	C	S	.	.	S	Bend	trans	-65.9	128.4	179.1	173.7	0	0	0	0	110.7	L16 P17 D18 V22 I47 K48 L124 M125	L16-V20 HydrophobicContact CB-CG2 4.22Å; L16-V20 HydrophobicContact CD1-CG1 4.4Å; P17-V20 HydrophobicContact CB-CG2 4.18Å; P17-V20 HydrophobicContact CG-CG2 4.38Å; P17-V20 WeakPolarHBondContact O-CB 3.24Å; P17-V20 WeakPolarHBondContact O-CG2 3.23Å; P17-V20 PolarHBondContact O-N 3.1Å; D18-V20 VanDerWaalsContact C-N 3.26Å; D18-V20 PolarHBondContact O-N 3.25Å; V20-V22 PolarHBondContact O-N 3.21Å; V20-I47 CarbonylContact O-C 3.58Å; V20-I47 VanDerWaalsContact O-CA 3.28Å; V20-I47 WeakPolarHBondContact O-CA 3.45Å; V20-K48 PolarHBondContact O-N 3.35Å; V20-L124 HydrophobicContact CG1-CD2 3.44Å; V20-L124 VanDerWaalsContact CG1-CD2 3.44Å; V20-L124 HydrophobicContact CG1-CG 3.92Å; V20-M125 HydrophobicContact CG2-SD 4.23Å
21	P	89.3	Confident	86.8	Confident	9 Å²	9	52.1 Å²	52.1	6%	0.058	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	127.3	176.8	28.8	-35.1	0	0	0	111	V45 L117 L124 F133	P21-V45 HydrophobicContact CB-CG1 3.74Å; P21-L117 HydrophobicContact CB-CD2 4.03Å; P21-L117 HydrophobicContact CG-CD2 3.78Å; P21-L124 HydrophobicContact CG-CD1 4.4Å; P21-F133 HydrophobicContact CB-CB 4.11Å; P21-F133 HydrophobicContact CB-CG 4.26Å; P21-F133 HydrophobicContact CG-CB 3.83Å; P21-F133 HydrophobicContact CG-CD2 4.08Å; P21-F133 HydrophobicContact CG-CG 4.03Å
22	V	91.6	Very high	87.2	Confident	63 Å²	63	50.3 Å²	50.3	38%	0.382	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-25.9	176.8	-91.4	0	0	0	0	112.7	F13 V20 K46 K48	F13-V22 HydrophobicContact CE2-CG1 3.83Å; F13-V22 HydrophobicContact CZ-CG1 3.83Å; V20-V22 PolarHBondContact O-N 3.21Å; V22-K46 HydrophobicContact CG2-CB 4.46Å; V22-K46 WeakPolarHBondContact CG2-O 3.22Å; V22-K46 PolarHBondContact N-O 2.86Å; V22-K48 HydrophobicContact CG1-CB 4.45Å
23	S	94.1	Very high	87.4	Confident	35 Å²	35	54 Å²	54	25%	0.245	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	145.8	173.5	73.6	0	0	0	0	110.8	V45 K46	S23-V45 WeakPolarHBondContact O-CA 3.19Å; S23-K46 PolarHBondContact N-O 2.84Å; S23-K46 PolarHBondContact O-N 2.68Å; S23-K46 WeakPolarHBondContact OG-CB 3.18Å
24	A	95.2	Very high	87.8	Confident	2 Å²	2	50 Å²	50	2%	0.017	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	128.5	173.5	0	0	0	0	0	109.6	I43 E44 V45 M113 L117 F133	A24-I43 HydrophobicContact CB-CG2 3.91Å; A24-E44 WeakPolarHBondContact CA-O 3.46Å; A24-V45 HydrophobicContact CB-CG2 4.24Å; A24-M113 HydrophobicContact CB-CB 4.22Å; A24-M113 HydrophobicContact CB-CE 4.4Å; A24-M113 HydrophobicContact CB-SD 3.83Å; A24-L117 HydrophobicContact CB-CD1 3.99Å; A24-F133 HydrophobicContact CB-CD1 4.1Å; A24-F133 HydrophobicContact CB-CE1 3.56Å; A24-F133 HydrophobicContact CB-CZ 4.48Å
25	N	94.5	Very high	88.1	Confident	72 Å²	72	45.6 Å²	45.6	39%	0.385	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.7	178.8	-63.9	-74.3	0	0	0	110.6	A27 I43 E44 N110	N25-A27 PolarHBondContact O-N 2.85Å; N25-I43 CarbonylContact O-C 3.57Å; N25-I43 WeakPolarHBondContact O-CA 3.33Å; N25-E44 PolarHBondContact N-O 2.97Å; N25-E44 PolarHBondContact O-N 3.5Å; N25-N110 WeakPolarHBondContact CA-OD1 3.28Å
26	I	93.2	Very high	88.2	Confident	20 Å²	20	39.4 Å²	39.4	10%	0.103	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	119.5	173.9	-62.7	165.7	0	0	0	108.7	D28 I29 F41 V42 I43 I106 L109 N110 M113	I26-D28 WeakPolarHBondContact CG2-O 3.45Å; I26-I29 HydrophobicContact CG2-CG2 4.47Å; I26-F41 HydrophobicContact CD1-CB 4.37Å; I26-F41 HydrophobicContact CD1-CD1 3.73Å; I26-F41 HydrophobicContact CD1-CE1 4.38Å; I26-F41 HydrophobicContact CD1-CG 4.23Å; I26-F41 HydrophobicContact CG1-CB 4.29Å; I26-F41 HydrophobicContact CG1-CD1 4.4Å; I26-F41 HydrophobicContact CG2-CB 4.5Å; I26-F41 HydrophobicContact CG2-CD1 4.23Å; I26-V42 CarbonylContact C-O 3.51Å; I26-V42 WeakPolarHBondContact CA-O 3.47Å; I26-I43 HydrophobicContact CG1-CG1 4.05Å; I26-I106 HydrophobicContact CB-CG2 4.21Å; I26-I106 HydrophobicContact CD1-CB 4.48Å; I26-I106 HydrophobicContact CD1-CG2 4.27Å; I26-I106 HydrophobicContact CG2-CG1 4.44Å; I26-I106 HydrophobicContact CG2-CG2 4.23Å; I26-L109 HydrophobicContact CD1-CB 3.64Å; I26-L109 HydrophobicContact CD1-CD1 4.13Å; I26-N110 WeakPolarHBondContact CG1-OD1 3.31Å; I26-N110 PolarHBondContact N-OD1 3.3Å; I26-M113 HydrophobicContact CD1-CE 4.38Å; I26-M113 HydrophobicContact CG1-CE 3.89Å
27	A	88.9	Confident	88.2	Confident	64 Å²	64	41.1 Å²	41.1	53%	0.529	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-32.9	176.7	0	0	0	0	0	112.3	N25 V42	N25-A27 PolarHBondContact O-N 2.85Å; A27-V42 PolarHBondContact N-O 3.03Å
28	D	88.4	Confident	88.3	Confident	20 Å²	20	39.6 Å²	39.6	11%	0.107	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	171.4	-179.2	-159.2	8.2	0	0	0	111.9	I26 V42 R146	I26-D28 WeakPolarHBondContact CG2-O 3.45Å; D28-V42 HydrophobicContact CB-CB 4.02Å; D28-V42 HydrophobicContact CB-CG2 4.11Å; D28-V42 PolarHBondContact N-O 3.27Å; D28-V42 PolarHBondContact O-N 2.96Å; D28-R146 IonicContact OD1-CZ 3.74Å; D28-R146 IonicContact OD1-NE 3.6Å; D28-R146 PolarHBondContact OD1-NE 2.97Å; D28-R146 IonicContact OD1-NH2 3.05Å; D28-R146 PolarHBondContact OD1-NH2 2.96Å; D28-R146 WeakPolarHBondContact OD2-CD 3.25Å; D28-R146 WeakPolarHBondContact OD2-CG 3.28Å; D28-R146 IonicContact OD2-CZ 2.85Å; D28-R146 IonicContact OD2-NE 3.33Å; D28-R146 PolarHBondContact OD2-NE 2.86Å
29	I	90.3	Very high	88.7	Confident	26 Å²	26	35.8 Å²	35.8	13%	0.133	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.3	168	58.9	170.3	0	0	0	110.4	I26 F39 M40 F41 A102 E103 I106	I26-I29 HydrophobicContact CG2-CG2 4.47Å; I29-F39 HydrophobicContact CD1-CD1 4.29Å; I29-M40 CarbonylContact C-O 3.51Å; I29-M40 WeakPolarHBondContact CA-O 3.39Å; I29-F41 HydrophobicContact CG2-CD1 3.56Å; I29-F41 HydrophobicContact CG2-CE1 3.84Å; I29-A102 HydrophobicContact CD1-CB 4.43Å; I29-E103 HydrophobicContact CD1-CG 3.45Å; I29-E103 VanDerWaalsContact CD1-CG 3.45Å; I29-I106 HydrophobicContact CG2-CD1 3.94Å; I29-I106 HydrophobicContact CG2-CG1 4.17Å
30	E	87.9	Confident	89.1	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.019	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.6	178.7	-69.2	-174.2	-169.3	0	0	110.6	K32 F39 M40 V42 P144 Q145	E30-K32 IonicContact OE2-NZ 3.65Å; E30-K32 PolarHBondContact OE2-NZ 2.85Å; E30-F39 CarbonylContact O-C 3.57Å; E30-F39 WeakPolarHBondContact O-CA 3.42Å; E30-M40 PolarHBondContact N-O 2.83Å; E30-M40 PolarHBondContact O-N 2.87Å; E30-V42 HydrophobicContact CG-CG2 3.87Å; E30-P144 WeakPolarHBondContact OE1-CA 3.42Å; E30-Q145 HydrophobicContact CG-CB 4.18Å; E30-Q145 PolarHBondContact OE1-N 3.17Å
31	E	88.2	Confident	89.4	Confident	92 Å²	92	32.5 Å²	32.5	43%	0.43	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	126.3	165.6	-171.5	178.2	-177.1	0	0	108.9	N37 F39	E31-N37 PolarHBondContact OE1-ND2 3.42Å; E31-F39 HydrophobicContact CB-CD1 4.28Å; E31-F39 HydrophobicContact CB-CE1 3.78Å; E31-F39 HydrophobicContact CB-CZ 3.95Å; E31-F39 HydrophobicContact CG-CE1 4.37Å; E31-F39 HydrophobicContact CG-CE2 4.37Å; E31-F39 HydrophobicContact CG-CZ 4.05Å
32	K	86.1	Confident	89.6	Confident	18 Å²	18	32.1 Å²	32.1	8%	0.078	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137.2	172.7	-62.8	-59	-165.7	-171.3	0	110.1	E30 G34 N37 Y38 M40 E258	E30-K32 IonicContact OE2-NZ 3.65Å; E30-K32 PolarHBondContact OE2-NZ 2.85Å; K32-G34 VanDerWaalsContact C-N 3.35Å; K32-G34 PolarHBondContact O-N 2.93Å; K32-N37 WeakPolarHBondContact O-CA 3.22Å; K32-Y38 HydrophobicContact CB-CD1 4.4Å; K32-Y38 HydrophobicContact CB-CD2 4.27Å; K32-Y38 HydrophobicContact CB-CE1 3.86Å; K32-Y38 HydrophobicContact CB-CE2 3.75Å; K32-Y38 VanDerWaalsContact CB-CZ 3.49Å; K32-Y38 HydrophobicContact CG-CE2 3.96Å; K32-Y38 PolarHBondContact N-O 2.87Å; K32-Y38 PolarHBondContact O-N 2.79Å; K32-Y38 VanDerWaalsContact O-N 3.14Å; K32-M40 HydrophobicContact CG-CB 4.29Å; K32-M40 HydrophobicContact CG-CG 3.57Å; K32-E258 VanDerWaalsContact CA-OE2 3.24Å; K32-E258 WeakPolarHBondContact CA-OE2 3.47Å; K32-E258 HydrophobicContact CB-CB 4.4Å
33	K	84.6	Confident	89.6	Confident	137 Å²	137	29.1 Å²	29.1	60%	0.596	16%	0.155	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	70.2	175.3	-65.6	-174.2	179.2	-174.9	0	110.2	E258	K33-E258 PolarHBondContact N-OE2 2.75Å; K33-E258 PolarHBondContact O-N 3.34Å
34	G	85.5	Confident	89.5	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.01	15%	0.154	C	C	.	.	S	Bend	trans	-80.3	-156.4	171.7	0	0	0	0	0	113.1	K32 T36	K32-G34 VanDerWaalsContact C-N 3.35Å; K32-G34 PolarHBondContact O-N 2.93Å; G34-T36 CarbonylContact C-O 3.54Å; G34-T36 PolarHBondContact O-N 2.8Å
35	F	86.4	Confident	89.2	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.022	15%	0.153	C	C	.	.	S	Bend	trans	-55.8	-44.1	172.4	-56.7	-71.3	0	0	0	111.1	V240 V257 E259 P265 D269 L270 L273 F320 W322	F35-V240 HydrophobicContact CE1-CG2 3.79Å; F35-V257 HydrophobicContact CD1-CG1 4Å; F35-V257 HydrophobicContact CD1-CG2 4.47Å; F35-V257 HydrophobicContact CD2-CG1 4.37Å; F35-V257 HydrophobicContact CE1-CG1 3.94Å; F35-V257 HydrophobicContact CE1-CG2 4.45Å; F35-V257 HydrophobicContact CE2-CG1 4.33Å; F35-V257 HydrophobicContact CG-CG1 4.23Å; F35-V257 HydrophobicContact CZ-CG1 4.12Å; F35-E259 HydrophobicContact CD2-CB 4.31Å; F35-E259 HydrophobicContact CD2-CG 3.74Å; F35-E259 HydrophobicContact CE2-CB 3.85Å; F35-E259 HydrophobicContact CE2-CG 3.8Å; F35-E259 HydrophobicContact CZ-CB 4.48Å; F35-P265 HydrophobicContact CB-CB 4.4Å; F35-P265 HydrophobicContact CD1-CB 4.04Å; F35-P265 HydrophobicContact CD1-CG 4.47Å; F35-P265 HydrophobicContact CD2-CB 3.59Å; F35-P265 HydrophobicContact CD2-CG 4.45Å; F35-P265 HydrophobicContact CE1-CB 4.18Å; F35-P265 HydrophobicContact CE1-CG 4.18Å; F35-P265 HydrophobicContact CE2-CB 3.73Å; F35-P265 HydrophobicContact CE2-CG 4.14Å; F35-P265 HydrophobicContact CG-CB 3.74Å; F35-P265 HydrophobicContact CZ-CB 4.03Å; F35-P265 HydrophobicContact CZ-CG 4.01Å; F35-D269 HydrophobicContact CB-CB 3.98Å; F35-L270 HydrophobicContact CD1-CD2 3.63Å; F35-L270 HydrophobicContact CE1-CD2 3.92Å; F35-L270 HydrophobicContact CG-CD2 4.45Å; F35-L273 HydrophobicContact CD1-CD2 4Å; F35-F320 HydrophobicContact CE1-CZ 4.49Å; F35-F320 HydrophobicContact CE2-CZ 4.44Å; F35-F320 AromaticContact CZ-CE1 3.98Å; F35-F320 HydrophobicContact CZ-CE1 3.98Å; F35-F320 HydrophobicContact CZ-CE2 4.21Å; F35-F320 AromaticContact CZ-CZ 3.71Å; F35-F320 HydrophobicContact CZ-CZ 3.71Å; F35-W322 AromaticContact CE1-CH2 3.72Å; F35-W322 HydrophobicContact CE1-CH2 3.72Å; F35-W322 AromaticContact CE1-CZ2 3.99Å; F35-W322 HydrophobicContact CE1-CZ2 3.99Å; F35-W322 HydrophobicContact CZ-CH2 4.12Å; F35-W322 AromaticContact CZ-CZ2 3.89Å; F35-W322 HydrophobicContact CZ-CZ2 3.89Å
36	T	85.3	Confident	89	Confident	17 Å²	17	30.7 Å²	30.7	10%	0.104	15%	0.154	C	C	.	.	S	Bend	trans	-115.2	153	159.7	51.9	0	0	0	0	109.3	G34 Y38 D269	G34-T36 CarbonylContact C-O 3.54Å; G34-T36 PolarHBondContact O-N 2.8Å; T36-Y38 VanDerWaalsContact O-CD1 3.27Å; T36-Y38 WeakPolarHBondContact O-CD1 3.45Å; T36-Y38 PolarHBondContact O-N 2.9Å; T36-D269 HydrophobicContact CG2-CB 3.81Å; T36-D269 WeakPolarHBondContact CG2-OD1 3.43Å
37	N	85.6	Confident	88.8	Confident	48 Å²	48	31.3 Å²	31.3	26%	0.257	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	131.5	170.7	-64.7	15.6	0	0	0	108.8	E31 K32 K98	E31-N37 PolarHBondContact OE1-ND2 3.42Å; K32-N37 WeakPolarHBondContact O-CA 3.22Å; N37-K98 VanDerWaalsContact O-CD 3.27Å; N37-K98 WeakPolarHBondContact O-CD 3.03Å; N37-K98 PolarHBondContact O-NZ 3.22Å
38	Y	87.5	Confident	88.6	Confident	17 Å²	17	30.5 Å²	30.5	7%	0.067	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	163.8	177	65.9	-89.7	0	0	0	110.7	K32 T36 M40 R58 E258 E259	K32-Y38 HydrophobicContact CB-CD1 4.4Å; K32-Y38 HydrophobicContact CB-CD2 4.27Å; K32-Y38 HydrophobicContact CB-CE1 3.86Å; K32-Y38 HydrophobicContact CB-CE2 3.75Å; K32-Y38 VanDerWaalsContact CB-CZ 3.49Å; K32-Y38 HydrophobicContact CG-CE2 3.96Å; K32-Y38 PolarHBondContact N-O 2.87Å; K32-Y38 PolarHBondContact O-N 2.79Å; K32-Y38 VanDerWaalsContact O-N 3.14Å; T36-Y38 VanDerWaalsContact O-CD1 3.27Å; T36-Y38 WeakPolarHBondContact O-CD1 3.45Å; T36-Y38 PolarHBondContact O-N 2.9Å; Y38-M40 HydrophobicContact CD2-CG 4.04Å; Y38-M40 HydrophobicContact CD2-SD 4.12Å; Y38-M40 HydrophobicContact CE2-CG 3.49Å; Y38-M40 VanDerWaalsContact CE2-CG 3.49Å; Y38-M40 HydrophobicContact CE2-SD 3.54Å; Y38-M40 VanDerWaalsContact CE2-SD 3.54Å; Y38-R58 HydrophobicContact CD2-CB 4.21Å; Y38-R58 HydrophobicContact CE2-CB 4.5Å; Y38-E258 PolarHBondContact OH-O 3.35Å; Y38-E259 VanDerWaalsContact CE1-CD 3.45Å; Y38-E259 HydrophobicContact CE1-CG 4.11Å; Y38-E259 WeakPolarHBondContact CE1-OE1 3.39Å; Y38-E259 PolarHBondContact OH-OE2 2.96Å
39	F	90.4	Very high	88.2	Confident	26 Å²	26	32 Å²	32	11%	0.114	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.5	176.5	-74.5	-94.9	0	0	0	110.5	I29 E30 E31 K98 K99 A102	I29-F39 HydrophobicContact CD1-CD1 4.29Å; E30-F39 CarbonylContact O-C 3.57Å; E30-F39 WeakPolarHBondContact O-CA 3.42Å; E31-F39 HydrophobicContact CB-CD1 4.28Å; E31-F39 HydrophobicContact CB-CE1 3.78Å; E31-F39 HydrophobicContact CB-CZ 3.95Å; E31-F39 HydrophobicContact CG-CE1 4.37Å; E31-F39 HydrophobicContact CG-CE2 4.37Å; E31-F39 HydrophobicContact CG-CZ 4.05Å; F39-K98 HydrophobicContact CD2-CB 4.11Å; F39-K98 HydrophobicContact CE2-CB 3.86Å; F39-K99 HydrophobicContact CE1-CB 4.16Å; F39-K99 HydrophobicContact CE1-CG 3.98Å; F39-K99 VanDerWaalsContact CE2-CA 3.47Å; F39-K99 HydrophobicContact CE2-CB 3.92Å; F39-K99 VanDerWaalsContact CZ-CA 3.49Å; F39-K99 HydrophobicContact CZ-CB 3.48Å; F39-K99 VanDerWaalsContact CZ-CB 3.48Å; F39-K99 HydrophobicContact CZ-CG 3.79Å; F39-A102 HydrophobicContact CB-CB 3.59Å; F39-A102 HydrophobicContact CD1-CB 4.13Å; F39-A102 HydrophobicContact CD2-CB 4.13Å; F39-A102 HydrophobicContact CG-CB 3.67Å
40	M	91.2	Very high	87.7	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.02	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.8	168.6	-71.3	-65.5	-84.1	0	0	109.3	I29 E30 K32 Y38 F56 R57 R58 F138	I29-M40 CarbonylContact C-O 3.51Å; I29-M40 WeakPolarHBondContact CA-O 3.39Å; E30-M40 PolarHBondContact N-O 2.83Å; E30-M40 PolarHBondContact O-N 2.87Å; K32-M40 HydrophobicContact CG-CB 4.29Å; K32-M40 HydrophobicContact CG-CG 3.57Å; Y38-M40 HydrophobicContact CD2-CG 4.04Å; Y38-M40 HydrophobicContact CD2-SD 4.12Å; Y38-M40 HydrophobicContact CE2-CG 3.49Å; Y38-M40 VanDerWaalsContact CE2-CG 3.49Å; Y38-M40 HydrophobicContact CE2-SD 3.54Å; Y38-M40 VanDerWaalsContact CE2-SD 3.54Å; M40-F56 HydrophobicContact CE-CB 3.6Å; M40-F56 WeakPolarHBondContact CE-O 3.29Å; M40-R57 VanDerWaalsContact SD-C 3.52Å; M40-R58 HydrophobicContact SD-CB 3.52Å; M40-R58 VanDerWaalsContact SD-CB 3.52Å; M40-R58 HydrophobicContact SD-CG 4.22Å; M40-R58 PolarHBondContact SD-N 3.04Å; M40-F138 HydrophobicContact CE-CE1 4.15Å
41	F	93.8	Very high	87.3	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.009	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	123.9	169.8	-59.9	-81.4	0	0	0	108.4	I26 I29 I43 F56 R57 F62 A102 R105 I106 L109	I26-F41 HydrophobicContact CD1-CB 4.37Å; I26-F41 HydrophobicContact CD1-CD1 3.73Å; I26-F41 HydrophobicContact CD1-CE1 4.38Å; I26-F41 HydrophobicContact CD1-CG 4.23Å; I26-F41 HydrophobicContact CG1-CB 4.29Å; I26-F41 HydrophobicContact CG1-CD1 4.4Å; I26-F41 HydrophobicContact CG2-CB 4.5Å; I26-F41 HydrophobicContact CG2-CD1 4.23Å; I29-F41 HydrophobicContact CG2-CD1 3.56Å; I29-F41 HydrophobicContact CG2-CE1 3.84Å; F41-I43 HydrophobicContact CB-CD1 4.35Å; F41-I43 HydrophobicContact CB-CG1 4.13Å; F41-F56 WeakPolarHBondContact O-CA 3.24Å; F41-R57 WeakPolarHBondContact CB-O 3.43Å; F41-R57 WeakPolarHBondContact CD2-O 3.44Å; F41-R57 PolarHBondContact N-O 2.98Å; F41-R57 PolarHBondContact O-N 2.93Å; F41-F62 HydrophobicContact CD2-CE2 4.28Å; F41-A102 HydrophobicContact CE1-CB 4.5Å; F41-A102 WeakPolarHBondContact CE1-O 3.33Å; F41-A102 HydrophobicContact CZ-CB 4.28Å; F41-R105 HydrophobicContact CZ-CB 4.13Å; F41-I106 HydrophobicContact CE1-CG1 4.19Å; F41-L109 HydrophobicContact CD1-CD1 4.08Å; F41-L109 HydrophobicContact CD2-CD1 3.85Å; F41-L109 HydrophobicContact CE1-CD1 3.77Å; F41-L109 HydrophobicContact CE2-CD1 3.53Å; F41-L109 HydrophobicContact CG-CD1 4.12Å; F41-L109 HydrophobicContact CZ-CD1 3.49Å; F41-L109 VanDerWaalsContact CZ-CD1 3.49Å
42	V	92.1	Very high	87.2	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	111.4	172	-173.5	0	0	0	0	106.9	I26 A27 D28 E30 L54 F56 P144	I26-V42 CarbonylContact C-O 3.51Å; I26-V42 WeakPolarHBondContact CA-O 3.47Å; A27-V42 PolarHBondContact N-O 3.03Å; D28-V42 HydrophobicContact CB-CB 4.02Å; D28-V42 HydrophobicContact CB-CG2 4.11Å; D28-V42 PolarHBondContact N-O 3.27Å; D28-V42 PolarHBondContact O-N 2.96Å; E30-V42 HydrophobicContact CG-CG2 3.87Å; V42-L54 HydrophobicContact CG1-CB 4.46Å; V42-L54 HydrophobicContact CG1-CD1 4.25Å; V42-L54 HydrophobicContact CG1-CD2 4.31Å; V42-F56 HydrophobicContact CB-CE1 4.42Å; V42-F56 HydrophobicContact CG1-CE1 4.03Å; V42-F56 HydrophobicContact CG1-CZ 4.36Å; V42-F56 HydrophobicContact CG2-CD1 3.89Å; V42-F56 HydrophobicContact CG2-CE1 3.74Å; V42-P144 HydrophobicContact CG1-CG 4.39Å
43	I	92.6	Very high	87.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.4	-170.6	-56.7	160.1	0	0	0	108.7	A24 N25 I26 F41 V45 L54 I55 R57 F62 M113	A24-I43 HydrophobicContact CB-CG2 3.91Å; N25-I43 CarbonylContact O-C 3.57Å; N25-I43 WeakPolarHBondContact O-CA 3.33Å; I26-I43 HydrophobicContact CG1-CG1 4.05Å; F41-I43 HydrophobicContact CB-CD1 4.35Å; F41-I43 HydrophobicContact CB-CG1 4.13Å; I43-V45 HydrophobicContact CG2-CG2 4.15Å; I43-L54 CarbonylContact O-C 3.45Å; I43-L54 VanDerWaalsContact O-CA 3.31Å; I43-L54 WeakPolarHBondContact O-CA 3.26Å; I43-I55 HydrophobicContact CB-CD1 4.41Å; I43-I55 HydrophobicContact CB-CG1 3.75Å; I43-I55 HydrophobicContact CD1-CD1 4.4Å; I43-I55 HydrophobicContact CD1-CG1 4.25Å; I43-I55 HydrophobicContact CG2-CD1 4.49Å; I43-I55 HydrophobicContact CG2-CG1 4.26Å; I43-I55 PolarHBondContact N-O 2.84Å; I43-I55 PolarHBondContact O-N 2.78Å; I43-R57 HydrophobicContact CD1-CB 3.95Å; I43-R57 HydrophobicContact CD1-CG 3.99Å; I43-F62 HydrophobicContact CD1-CE2 4.18Å; I43-F62 HydrophobicContact CD1-CZ 3.68Å; I43-M113 HydrophobicContact CD1-SD 4.05Å; I43-M113 HydrophobicContact CG1-SD 4.44Å; I43-M113 HydrophobicContact CG2-CE 4.06Å; I43-M113 HydrophobicContact CG2-SD 3.86Å
44	E	90.8	Very high	87.2	Confident	49 Å²	49	37.1 Å²	37.1	23%	0.229	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.1	168.4	-172.7	-173.1	-141.6	0	0	109.2	A24 N25 R52 L54	A24-E44 WeakPolarHBondContact CA-O 3.46Å; N25-E44 PolarHBondContact N-O 2.97Å; N25-E44 PolarHBondContact O-N 3.5Å; E44-R52 WeakPolarHBondContact OE1-CD 3.45Å; E44-R52 IonicContact OE1-NH1 3.92Å; E44-R52 PolarHBondContact OE1-NH1 2.99Å; E44-L54 HydrophobicContact CB-CD2 3.89Å; E44-L54 HydrophobicContact CG-CD2 4.3Å
45	V	89.8	Confident	87.3	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134	175.1	-176.5	0	0	0	0	108.7	P21 S23 A24 I43 R52 Y53 I55 F133	P21-V45 HydrophobicContact CB-CG1 3.74Å; S23-V45 WeakPolarHBondContact O-CA 3.19Å; A24-V45 HydrophobicContact CB-CG2 4.24Å; I43-V45 HydrophobicContact CG2-CG2 4.15Å; V45-R52 WeakPolarHBondContact O-CA 3.27Å; V45-Y53 HydrophobicContact CB-CD2 4.15Å; V45-Y53 HydrophobicContact CB-CE1 4.45Å; V45-Y53 HydrophobicContact CB-CE2 3.67Å; V45-Y53 HydrophobicContact CG1-CE1 4.34Å; V45-Y53 HydrophobicContact CG1-CE2 4.05Å; V45-Y53 HydrophobicContact CG2-CE2 4Å; V45-Y53 PolarHBondContact N-O 3.36Å; V45-Y53 PolarHBondContact O-N 3.29Å; V45-I55 HydrophobicContact CG2-CD1 3.7Å; V45-I55 HydrophobicContact CG2-CG1 3.93Å; V45-F133 HydrophobicContact CG2-CD1 4.19Å
46	K	89.8	Confident	87.5	Confident	93 Å²	93	36.9 Å²	36.9	40%	0.404	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.2	170.4	-56.8	-179.2	-178.6	173.6	0	108.7	V22 S23 G51 R52	V22-K46 HydrophobicContact CG2-CB 4.46Å; V22-K46 WeakPolarHBondContact CG2-O 3.22Å; V22-K46 PolarHBondContact N-O 2.86Å; S23-K46 PolarHBondContact N-O 2.84Å; S23-K46 PolarHBondContact O-N 2.68Å; S23-K46 WeakPolarHBondContact OG-CB 3.18Å; K46-G51 WeakPolarHBondContact CA-O 3.08Å; K46-R52 HydrophobicContact CG-CB 4.35Å
47	I	88.8	Confident	87.8	Confident	33 Å²	33	36.8 Å²	36.8	17%	0.169	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	160.1	-179.5	58.9	169.9	0	0	0	111.6	D18 D19 V20 G49 G50 G51 Y53	D18-I47 WeakPolarHBondContact O-CB 3.23Å; D19-I47 WeakPolarHBondContact O-CG2 3.09Å; V20-I47 CarbonylContact O-C 3.58Å; V20-I47 VanDerWaalsContact O-CA 3.28Å; V20-I47 WeakPolarHBondContact O-CA 3.45Å; I47-G49 PolarHBondContact O-N 3.44Å; I47-G50 PolarHBondContact O-N 2.93Å; I47-G51 WeakPolarHBondContact CG1-O 3.26Å; I47-G51 PolarHBondContact N-O 2.84Å; I47-Y53 HydrophobicContact CG2-CE1 3.57Å
48	K	85.4	Confident	88.1	Confident	47 Å²	47	36.3 Å²	36.3	20%	0.204	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-40.8	-178.4	177.3	-178.1	166	-169.9	0	112.3	F13 D14 L16 D18 V20 V22 G50	F13-K48 HydrophobicContact CE1-CD 3.97Å; F13-K48 HydrophobicContact CE1-CG 4.03Å; F13-K48 HydrophobicContact CZ-CD 4.01Å; F13-K48 HydrophobicContact CZ-CG 3.9Å; F13-K48 PolarHBondContact O-NZ 3.07Å; D14-K48 VanDerWaalsContact C-NZ 3.26Å; D14-K48 PolarHBondContact O-NZ 2.81Å; L16-K48 HydrophobicContact CB-CD 4.17Å; L16-K48 PolarHBondContact O-NZ 3.32Å; D18-K48 PolarHBondContact O-N 2.76Å; V20-K48 PolarHBondContact O-N 3.35Å; V22-K48 HydrophobicContact CG1-CB 4.45Å; K48-G50 PolarHBondContact O-N 2.81Å
49	G	80.1	Confident	88.3	Confident	50 Å²	50	36.7 Å²	36.7	52%	0.515	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	5.6	177.7	0	0	0	0	0	115.5	D18 I47 G51	D18-G49 PolarHBondContact O-N 2.95Å; I47-G49 PolarHBondContact O-N 3.44Å; G49-G51 VanDerWaalsContact C-N 3.32Å; G49-G51 PolarHBondContact O-N 2.93Å
50	G	79.5	Confident	88.2	Confident	71 Å²	71	42 Å²	42	73%	0.732	22%	0.218	S	C	*	.	S	Bend	trans	85.2	-0.8	177.5	0	0	0	0	0	114.8	I47 K48	I47-G50 PolarHBondContact O-N 2.93Å; K48-G50 PolarHBondContact O-N 2.81Å
51	G	79.9	Confident	88.3	Confident	30 Å²	30	45.4 Å²	45.4	31%	0.309	23%	0.234	S	C	.	.			trans	-72.3	159.6	173.9	0	0	0	0	0	113.2	K46 I47 G49	K46-G51 WeakPolarHBondContact CA-O 3.08Å; I47-G51 WeakPolarHBondContact CG1-O 3.26Å; I47-G51 PolarHBondContact N-O 2.84Å; G49-G51 VanDerWaalsContact C-N 3.32Å; G49-G51 PolarHBondContact O-N 2.93Å
52	R	85.8	Confident	88.3	Confident	184 Å²	184	45.3 Å²	45.3	69%	0.694	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	147.2	170	62.9	175.5	175.9	175.8	-4.4	111.2	E44 V45 K46	E44-R52 WeakPolarHBondContact OE1-CD 3.45Å; E44-R52 IonicContact OE1-NH1 3.92Å; E44-R52 PolarHBondContact OE1-NH1 2.99Å; V45-R52 WeakPolarHBondContact O-CA 3.27Å; K46-R52 HydrophobicContact CG-CB 4.35Å
53	Y	83.6	Confident	88.3	Confident	49 Å²	49	49.6 Å²	49.6	19%	0.192	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	169.5	175.5	54.3	-95	0	0	0	110.3	V45 I47 I55 F133 H135	V45-Y53 HydrophobicContact CB-CD2 4.15Å; V45-Y53 HydrophobicContact CB-CE1 4.45Å; V45-Y53 HydrophobicContact CB-CE2 3.67Å; V45-Y53 HydrophobicContact CG1-CE1 4.34Å; V45-Y53 HydrophobicContact CG1-CE2 4.05Å; V45-Y53 HydrophobicContact CG2-CE2 4Å; V45-Y53 PolarHBondContact N-O 3.36Å; V45-Y53 PolarHBondContact O-N 3.29Å; I47-Y53 HydrophobicContact CG2-CE1 3.57Å; Y53-I55 HydrophobicContact CD2-CG2 3.67Å; Y53-I55 HydrophobicContact CE2-CG2 3.53Å; Y53-F133 VanDerWaalsContact CE2-O 3.25Å; Y53-F133 WeakPolarHBondContact CE2-O 3.06Å; Y53-F133 PolarHBondContact OH-O 2.93Å; Y53-H135 HydrophobicContact CD2-CB 3.8Å; Y53-H135 HydrophobicContact CE2-CB 3.95Å; Y53-H135 HydrophobicContact CG-CB 4.21Å
54	L	86.2	Confident	88.3	Confident	51 Å²	51	51.9 Å²	51.9	27%	0.267	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137	176.7	-62.1	177.5	0	0	0	109.3	V42 I43 E44 H135 P144	V42-L54 HydrophobicContact CG1-CB 4.46Å; V42-L54 HydrophobicContact CG1-CD1 4.25Å; V42-L54 HydrophobicContact CG1-CD2 4.31Å; I43-L54 CarbonylContact O-C 3.45Å; I43-L54 VanDerWaalsContact O-CA 3.31Å; I43-L54 WeakPolarHBondContact O-CA 3.26Å; E44-L54 HydrophobicContact CB-CD2 3.89Å; E44-L54 HydrophobicContact CG-CD2 4.3Å; L54-H135 PolarHBondContact O-CD2 3.04Å; L54-H135 VanDerWaalsContact O-CD2 3.3Å; L54-P144 HydrophobicContact CD1-CG 3.36Å
55	I	88	Confident	88.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	153	168.8	64.5	177.4	0	0	0	110	I43 V45 Y53 R57 F133 D139	I43-I55 HydrophobicContact CB-CD1 4.41Å; I43-I55 HydrophobicContact CB-CG1 3.75Å; I43-I55 HydrophobicContact CD1-CD1 4.4Å; I43-I55 HydrophobicContact CD1-CG1 4.25Å; I43-I55 HydrophobicContact CG2-CD1 4.49Å; I43-I55 HydrophobicContact CG2-CG1 4.26Å; I43-I55 PolarHBondContact N-O 2.84Å; I43-I55 PolarHBondContact O-N 2.78Å; V45-I55 HydrophobicContact CG2-CD1 3.7Å; V45-I55 HydrophobicContact CG2-CG1 3.93Å; Y53-I55 HydrophobicContact CD2-CG2 3.67Å; Y53-I55 HydrophobicContact CE2-CG2 3.53Å; I55-R57 HydrophobicContact CD1-CG 4.22Å; I55-R57 HydrophobicContact CG1-CG 4.41Å; I55-F133 HydrophobicContact CD1-CD1 4.18Å; I55-D139 WeakPolarHBondContact CA-OD1 3.27Å
56	F	90.3	Very high	88.6	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.009	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.5	-177.9	-60.7	-97.3	0	0	0	107.9	M40 F41 V42 D139 Q142 P144	M40-F56 HydrophobicContact CE-CB 3.6Å; M40-F56 WeakPolarHBondContact CE-O 3.29Å; F41-F56 WeakPolarHBondContact O-CA 3.24Å; V42-F56 HydrophobicContact CB-CE1 4.42Å; V42-F56 HydrophobicContact CG1-CE1 4.03Å; V42-F56 HydrophobicContact CG1-CZ 4.36Å; V42-F56 HydrophobicContact CG2-CD1 3.89Å; V42-F56 HydrophobicContact CG2-CE1 3.74Å; F56-D139 HydrophobicContact CD2-CB 4.31Å; F56-D139 PolarHBondContact N-OD1 2.74Å; F56-Q142 HydrophobicContact CD1-CB 4.49Å; F56-Q142 HydrophobicContact CD2-CB 3.76Å; F56-Q142 HydrophobicContact CD2-CG 4.44Å; F56-Q142 HydrophobicContact CE1-CB 4.17Å; F56-Q142 HydrophobicContact CE2-CB 3.4Å; F56-Q142 HydrophobicContact CE2-CG 4.49Å; F56-Q142 HydrophobicContact CG-CB 4.31Å; F56-Q142 HydrophobicContact CZ-CB 3.63Å; F56-P144 HydrophobicContact CZ-CG 4.09Å
57	R	92.3	Very high	88.6	Confident	14 Å²	14	48.2 Å²	48.2	5%	0.053	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139.7	179.2	-58.5	-66.8	177.2	-94.4	0.1	111.7	M40 F41 I43 I55 F62 F132 Y134 D139	M40-R57 VanDerWaalsContact SD-C 3.52Å; F41-R57 WeakPolarHBondContact CB-O 3.43Å; F41-R57 WeakPolarHBondContact CD2-O 3.44Å; F41-R57 PolarHBondContact N-O 2.98Å; F41-R57 PolarHBondContact O-N 2.93Å; I43-R57 HydrophobicContact CD1-CB 3.95Å; I43-R57 HydrophobicContact CD1-CG 3.99Å; I55-R57 HydrophobicContact CD1-CG 4.22Å; I55-R57 HydrophobicContact CG1-CG 4.41Å; R57-F62 HydrophobicContact CB-CE2 3.89Å; R57-F132 HydrophobicContact CB-CZ 4.31Å; R57-F132 HydrophobicContact CG-CE2 4.21Å; R57-F132 HydrophobicContact CG-CZ 4.01Å; R57-F132 VanDerWaalsContact CZ-O 3.31Å; R57-F132 PolarHBondContact NE-O 2.93Å; R57-F132 PolarHBondContact NH2-O 3.09Å; R57-Y134 PolarHBondContact NH2-O 3.31Å; R57-D139 IonicContact CZ-OD2 3.69Å; R57-D139 VanDerWaalsContact NH1-CG 3.32Å; R57-D139 IonicContact NH1-OD1 2.78Å; R57-D139 PolarHBondContact NH1-OD1 2.72Å; R57-D139 IonicContact NH1-OD2 3.91Å; R57-D139 PolarHBondContact NH1-OD2 3.02Å; R57-D139 IonicContact NH2-OD2 2.84Å; R57-D139 PolarHBondContact NH2-OD2 3.11Å
58	R	91.6	Very high	88.8	Confident	39 Å²	39	50.6 Å²	50.6	15%	0.147	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	156.8	168.9	58.5	-168.4	-67.7	175.5	0.5	110.4	Y38 M40 R60 Q61 E259	Y38-R58 HydrophobicContact CD2-CB 4.21Å; Y38-R58 HydrophobicContact CE2-CB 4.5Å; M40-R58 HydrophobicContact SD-CB 3.52Å; M40-R58 VanDerWaalsContact SD-CB 3.52Å; M40-R58 HydrophobicContact SD-CG 4.22Å; M40-R58 PolarHBondContact SD-N 3.04Å; R58-R60 HydrophobicContact CG-CB 4.33Å; R58-R60 PolarHBondContact O-N 2.77Å; R58-R60 VanDerWaalsContact O-N 3.09Å; R58-Q61 HydrophobicContact CG-CG 3.98Å; R58-Q61 WeakPolarHBondContact O-CB 3.46Å; R58-Q61 PolarHBondContact O-N 3.09Å; R58-E259 IonicContact NH1-OE1 2.76Å; R58-E259 PolarHBondContact NH1-OE1 3.32Å; R58-E259 IonicContact NH1-OE2 3.95Å
59	Y	92.3	Very high	89	Confident	24 Å²	24	48.4 Å²	48.4	9%	0.094	26%	0.26	C	S	.	.	H	α-helix	trans	-51	-38.7	178.6	-174.6	-100.8	0	0	0	114.5	Q61 F62 Y63 P90 G91 R105 L109	Y59-Q61 PolarHBondContact O-N 2.76Å; Y59-F62 WeakPolarHBondContact O-CB 3.36Å; Y59-F62 PolarHBondContact O-N 2.77Å; Y59-F62 VanDerWaalsContact O-N 3.1Å; Y59-Y63 PolarHBondContact O-N 2.73Å; Y59-Y63 VanDerWaalsContact O-N 3.09Å; Y59-P90 HydrophobicContact CE2-CG 4.13Å; Y59-P90 WeakPolarHBondContact OH-CG 3.48Å; Y59-P90 PolarHBondContact OH-O 2.83Å; Y59-G91 PolarHBondContact OH-O 2.87Å; Y59-G91 VanDerWaalsContact OH-O 3.09Å; Y59-R105 VanDerWaalsContact CE1-NH2 3.25Å; Y59-R105 HydrophobicContact CE2-CG 4.41Å; Y59-R105 VanDerWaalsContact CE2-NE 3.33Å; Y59-R105 VanDerWaalsContact CZ-CZ 3.45Å; Y59-L109 HydrophobicContact CD2-CD1 4.43Å; Y59-L109 HydrophobicContact CD2-CD2 4.28Å; Y59-L109 HydrophobicContact CE2-CD2 4.22Å
60	R	89.1	Confident	89.5	Confident	137 Å²	137	50.8 Å²	50.8	52%	0.517	26%	0.258	S	S	.	.	H	α-helix	trans	-57.6	-33.6	178.4	-171.6	178.2	74.5	154.4	-0.8	112.4	R58 Y63 A64	R58-R60 HydrophobicContact CG-CB 4.33Å; R58-R60 PolarHBondContact O-N 2.77Å; R58-R60 VanDerWaalsContact O-N 3.09Å; R60-Y63 PolarHBondContact O-N 2.69Å; R60-A64 WeakPolarHBondContact O-CB 3.09Å; R60-A64 PolarHBondContact O-N 3.12Å
61	Q	91.8	Very high	89.9	Confident	76 Å²	76	54.6 Å²	54.6	36%	0.355	26%	0.257	S	S	.	.	H	α-helix	trans	-70.2	-37.8	178	-67.6	169.1	-57.3	0	0	111.9	R58 Y59 Y63 A64 L65 F132	R58-Q61 HydrophobicContact CG-CG 3.98Å; R58-Q61 WeakPolarHBondContact O-CB 3.46Å; R58-Q61 PolarHBondContact O-N 3.09Å; Y59-Q61 PolarHBondContact O-N 2.76Å; Q61-Y63 VanDerWaalsContact C-N 3.34Å; Q61-A64 PolarHBondContact O-N 3.23Å; Q61-L65 WeakPolarHBondContact O-CB 3.18Å; Q61-L65 PolarHBondContact O-N 2.98Å; Q61-F132 HydrophobicContact CB-CE2 4.11Å
62	F	94.8	Very high	90.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-45.5	171.8	-73.5	-94.6	0	0	0	111.3	F41 I43 R57 Y59 L65 H66 L89 L109 Y112 M113 F132	F41-F62 HydrophobicContact CD2-CE2 4.28Å; I43-F62 HydrophobicContact CD1-CE2 4.18Å; I43-F62 HydrophobicContact CD1-CZ 3.68Å; R57-F62 HydrophobicContact CB-CE2 3.89Å; Y59-F62 WeakPolarHBondContact O-CB 3.36Å; Y59-F62 PolarHBondContact O-N 2.77Å; Y59-F62 VanDerWaalsContact O-N 3.1Å; F62-L65 PolarHBondContact O-N 3.26Å; F62-H66 WeakPolarHBondContact O-CB 3.31Å; F62-H66 PolarHBondContact O-N 2.96Å; F62-L89 HydrophobicContact CB-CD1 4.2Å; F62-L89 HydrophobicContact CB-CD2 4.28Å; F62-L109 HydrophobicContact CB-CD2 4.43Å; F62-L109 HydrophobicContact CD1-CD2 3.88Å; F62-L109 HydrophobicContact CD2-CD2 4.36Å; F62-L109 HydrophobicContact CE1-CD2 4.13Å; F62-L109 HydrophobicContact CE2-CD1 4.29Å; F62-L109 HydrophobicContact CG-CD2 3.99Å; F62-L109 HydrophobicContact CZ-CD1 4.43Å; F62-L109 HydrophobicContact CZ-CD2 4.47Å; F62-Y112 AromaticContact CD1-CD1 3.97Å; F62-Y112 HydrophobicContact CD1-CD1 3.97Å; F62-Y112 HydrophobicContact CD1-CE1 4.01Å; F62-Y112 HydrophobicContact CE1-CD1 4.36Å; F62-M113 HydrophobicContact CE1-CG 3.79Å; F62-M113 HydrophobicContact CE1-SD 3.88Å; F62-M113 HydrophobicContact CZ-SD 4.02Å; F62-F132 HydrophobicContact CD1-CE1 4.32Å; F62-F132 HydrophobicContact CD1-CE2 4.44Å; F62-F132 AromaticContact CD1-CZ 3.64Å; F62-F132 HydrophobicContact CD1-CZ 3.64Å; F62-F132 HydrophobicContact CD2-CE2 4.43Å; F62-F132 AromaticContact CD2-CZ 3.98Å; F62-F132 HydrophobicContact CD2-CZ 3.98Å; F62-F132 AromaticContact CE1-CE1 3.99Å; F62-F132 HydrophobicContact CE1-CE1 3.99Å; F62-F132 AromaticContact CE1-CZ 3.57Å; F62-F132 HydrophobicContact CE1-CZ 3.57Å; F62-F132 AromaticContact CE2-CZ 3.91Å; F62-F132 HydrophobicContact CE2-CZ 3.91Å; F62-F132 HydrophobicContact CG-CE2 4.32Å; F62-F132 AromaticContact CG-CZ 3.86Å; F62-F132 HydrophobicContact CG-CZ 3.86Å; F62-F132 HydrophobicContact CZ-CE1 4.28Å; F62-F132 AromaticContact CZ-CZ 3.72Å; F62-F132 HydrophobicContact CZ-CZ 3.72Å
63	Y	92	Very high	90.3	Very high	93 Å²	93	50.2 Å²	50.2	37%	0.365	23%	0.231	S	C	.	.	H	α-helix	trans	-63.7	-41.8	178.7	-168.3	-85.4	0	0	0	112.1	Y59 R60 Q61 H66 A67 L89 K92	Y59-Y63 PolarHBondContact O-N 2.73Å; Y59-Y63 VanDerWaalsContact O-N 3.09Å; R60-Y63 PolarHBondContact O-N 2.69Å; Q61-Y63 VanDerWaalsContact C-N 3.34Å; Y63-H66 PolarHBondContact O-N 3.44Å; Y63-A67 WeakPolarHBondContact O-CB 3.49Å; Y63-A67 PolarHBondContact O-N 2.94Å; Y63-L89 HydrophobicContact CD2-CD2 4.22Å; Y63-K92 HydrophobicContact CD2-CG 4.49Å; Y63-K92 HydrophobicContact CE2-CG 4.21Å
64	A	91.4	Very high	90.3	Very high	48 Å²	48	48.5 Å²	48.5	40%	0.397	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-43.6	177	0	0	0	0	0	112.1	R60 Q61 K68	R60-A64 WeakPolarHBondContact O-CB 3.09Å; R60-A64 PolarHBondContact O-N 3.12Å; Q61-A64 PolarHBondContact O-N 3.23Å; A64-K68 WeakPolarHBondContact O-CG 3.3Å; A64-K68 PolarHBondContact O-N 2.92Å
65	L	93.9	Very high	89.6	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-49.6	173.5	175	66	0	0	0	110.6	Q61 F62 A67 K68 L69 L116 E128 V129 F132	Q61-L65 WeakPolarHBondContact O-CB 3.18Å; Q61-L65 PolarHBondContact O-N 2.98Å; F62-L65 PolarHBondContact O-N 3.26Å; L65-A67 PolarHBondContact O-N 3.4Å; L65-K68 PolarHBondContact O-N 2.72Å; L65-L69 HydrophobicContact CD1-CD1 4.16Å; L65-L69 HydrophobicContact CD1-CG 4.17Å; L65-L69 HydrophobicContact CG-CD1 4Å; L65-L69 HydrophobicContact CG-CG 4.36Å; L65-L69 WeakPolarHBondContact O-CG 3.45Å; L65-L69 PolarHBondContact O-N 3.35Å; L65-L116 HydrophobicContact CD2-CD2 3.96Å; L65-E128 HydrophobicContact CD1-CB 3.76Å; L65-V129 HydrophobicContact CD1-CG2 4.38Å; L65-F132 HydrophobicContact CB-CD2 4.23Å; L65-F132 HydrophobicContact CD1-CB 4.46Å; L65-F132 HydrophobicContact CD2-CB 3.9Å; L65-F132 HydrophobicContact CD2-CD1 3.96Å; L65-F132 HydrophobicContact CD2-CD2 3.83Å; L65-F132 HydrophobicContact CD2-CE1 4.47Å; L65-F132 HydrophobicContact CD2-CE2 4.35Å; L65-F132 HydrophobicContact CD2-CG 3.62Å
66	H	93.6	Very high	88.7	Confident	16 Å²	16	58.8 Å²	58.8	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-43.8	-177.2	-169.4	57.7	0	0	0	112.4	F62 Y63 K68 L69 E70 P87 L89 Y112	F62-H66 WeakPolarHBondContact O-CB 3.31Å; F62-H66 PolarHBondContact O-N 2.96Å; Y63-H66 PolarHBondContact O-N 3.44Å; H66-K68 VanDerWaalsContact C-N 3.33Å; H66-K68 PolarHBondContact O-N 2.79Å; H66-L69 PolarHBondContact O-N 3.37Å; H66-L69 VanDerWaalsContact O-N 3.13Å; H66-E70 IonicContact CD2-OE1 3.06Å; H66-E70 IonicContact CD2-OE2 3.65Å; H66-E70 IonicContact NE2-OE1 2.94Å; H66-E70 PolarHBondContact NE2-OE1 2.84Å; H66-E70 WeakPolarHBondContact O-CG 3.5Å; H66-E70 PolarHBondContact O-N 3.17Å; H66-P87 PolarHBondContact CE1-O 2.83Å; H66-L89 HydrophobicContact CB-CD2 3.83Å; H66-Y112 AromaticContact ND1-CE2 3.77Å
67	A	91	Very high	87.8	Confident	42 Å²	42	59.8 Å²	59.8	35%	0.347	30%	0.299	S	S	.	.	H	α-helix	trans	-59.2	-42.6	176.5	0	0	0	0	0	112.3	Y63 L65 E70 E71	Y63-A67 WeakPolarHBondContact O-CB 3.49Å; Y63-A67 PolarHBondContact O-N 2.94Å; L65-A67 PolarHBondContact O-N 3.4Å; A67-E70 PolarHBondContact O-N 3.49Å; A67-E71 PolarHBondContact O-N 3.22Å
68	K	91.4	Very high	86.3	Confident	82 Å²	82	68.6 Å²	68.6	36%	0.357	34%	0.338	S	S	.	.	H	α-helix	trans	-64.6	-38.6	175.2	-69.3	-177.3	179.9	-171.9	0	112.4	A64 L65 H66 R72 E128	A64-K68 WeakPolarHBondContact O-CG 3.3Å; A64-K68 PolarHBondContact O-N 2.92Å; L65-K68 PolarHBondContact O-N 2.72Å; H66-K68 VanDerWaalsContact C-N 3.33Å; H66-K68 PolarHBondContact O-N 2.79Å; K68-R72 WeakPolarHBondContact O-CG 3.16Å; K68-R72 PolarHBondContact O-N 3.44Å; K68-E128 HydrophobicContact CD-CG 3.86Å; K68-E128 WeakPolarHBondContact CD-OE2 3.35Å; K68-E128 IonicContact NZ-OE1 3.87Å; K68-E128 PolarHBondContact NZ-OE1 2.75Å; K68-E128 IonicContact NZ-OE2 3.38Å; K68-E128 PolarHBondContact NZ-OE2 3.31Å
69	L	90.9	Very high	84.8	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-69.2	-39.9	177	-67.7	178.8	0	0	0	111.9	L65 H66 E71 R72 Y73 L86 L116 V129	L65-L69 HydrophobicContact CD1-CD1 4.16Å; L65-L69 HydrophobicContact CD1-CG 4.17Å; L65-L69 HydrophobicContact CG-CD1 4Å; L65-L69 HydrophobicContact CG-CG 4.36Å; L65-L69 WeakPolarHBondContact O-CG 3.45Å; L65-L69 PolarHBondContact O-N 3.35Å; H66-L69 PolarHBondContact O-N 3.37Å; H66-L69 VanDerWaalsContact O-N 3.13Å; L69-E71 VanDerWaalsContact C-N 3.35Å; L69-R72 PolarHBondContact O-N 3.41Å; L69-Y73 HydrophobicContact CB-CD2 4.44Å; L69-Y73 HydrophobicContact CD2-CD2 3.85Å; L69-Y73 HydrophobicContact CD2-CE2 3.71Å; L69-Y73 WeakPolarHBondContact O-CB 3.23Å; L69-Y73 PolarHBondContact O-N 2.85Å; L69-L86 HydrophobicContact CB-CD1 3.97Å; L69-L86 HydrophobicContact CB-CD2 4.19Å; L69-L116 HydrophobicContact CD1-CD1 3.66Å; L69-V129 HydrophobicContact CD1-CG2 4.15Å; L69-V129 HydrophobicContact CD2-CG2 3.82Å
70	E	89.8	Confident	83.2	Confident	100 Å²	100	74.7 Å²	74.7	47%	0.467	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-42.4	175.1	-75.7	-177.5	139.1	0	0	111.5	H66 A67 R72 G74 L86	H66-E70 IonicContact CD2-OE1 3.06Å; H66-E70 IonicContact CD2-OE2 3.65Å; H66-E70 IonicContact NE2-OE1 2.94Å; H66-E70 PolarHBondContact NE2-OE1 2.84Å; H66-E70 WeakPolarHBondContact O-CG 3.5Å; H66-E70 PolarHBondContact O-N 3.17Å; A67-E70 PolarHBondContact O-N 3.49Å; E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 2.76Å; E70-G74 VanDerWaalsContact O-CA 3.26Å; E70-G74 WeakPolarHBondContact O-CA 3.25Å; E70-G74 PolarHBondContact O-N 3.05Å; E70-L86 HydrophobicContact CB-CD1 4.28Å; E70-L86 HydrophobicContact CG-CD1 3.75Å
71	E	88.5	Confident	82.2	Confident	152 Å²	152	73.8 Å²	73.8	71%	0.71	39%	0.389	S	S	*	.	H	α-helix	trans	-60	-40.4	175	-174	-178.7	-177	0	0	112.1	A67 L69 S77	A67-E71 PolarHBondContact O-N 3.22Å; L69-E71 VanDerWaalsContact C-N 3.35Å; E71-S77 PolarHBondContact O-OG 2.87Å
72	R	87.1	Confident	81.3	Confident	95 Å²	95	75.8 Å²	75.8	36%	0.358	40%	0.397	S	S	.	.	H	α-helix	trans	-82.2	-42.6	-176.9	-70.8	-178.3	-176.3	-168.1	1.8	113.7	K68 L69 E70 S77 S80 D126	K68-R72 WeakPolarHBondContact O-CG 3.16Å; K68-R72 PolarHBondContact O-N 3.44Å; L69-R72 PolarHBondContact O-N 3.41Å; E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 2.76Å; R72-S77 PolarHBondContact O-OG 3.34Å; R72-S77 VanDerWaalsContact O-OG 3.13Å; R72-S80 PolarHBondContact O-OG 2.86Å; R72-D126 IonicContact CZ-OD2 3.87Å; R72-D126 IonicContact NH1-OD1 3.94Å; R72-D126 IonicContact NH1-OD2 2.75Å; R72-D126 PolarHBondContact NH1-OD2 3.37Å
73	Y	87.7	Confident	80.6	Confident	26 Å²	26	79.8 Å²	79.8	10%	0.102	42%	0.421	C	S	.	.	H	α-helix	trans	-125.1	-1.5	-164.3	-52.5	-61.3	0	0	0	114.5	L69 F82 C84 W122 V123 D126	L69-Y73 HydrophobicContact CB-CD2 4.44Å; L69-Y73 HydrophobicContact CD2-CD2 3.85Å; L69-Y73 HydrophobicContact CD2-CE2 3.71Å; L69-Y73 WeakPolarHBondContact O-CB 3.23Å; L69-Y73 PolarHBondContact O-N 2.85Å; Y73-F82 WeakPolarHBondContact CD1-O 3.39Å; Y73-C84 PolarHBondContact O-N 2.87Å; Y73-C84 VanDerWaalsContact O-N 3.15Å; Y73-W122 HydrophobicContact CD1-CE3 4.41Å; Y73-W122 HydrophobicContact CD1-CH2 4.43Å; Y73-W122 AromaticContact CD1-CZ3 3.57Å; Y73-W122 HydrophobicContact CD1-CZ3 3.57Å; Y73-W122 AromaticContact CE1-CE3 3.98Å; Y73-W122 HydrophobicContact CE1-CE3 3.98Å; Y73-W122 AromaticContact CE1-CZ3 3.59Å; Y73-W122 HydrophobicContact CE1-CZ3 3.59Å; Y73-W122 HydrophobicContact CG-CZ3 4.25Å; Y73-V123 HydrophobicContact CE2-CG1 4.36Å; Y73-D126 HydrophobicContact CE2-CB 4.42Å; Y73-D126 PolarHBondContact OH-OD2 2.8Å
74	G	82.8	Confident	80.2	Confident	14 Å²	14	76.5 Å²	76.5	14%	0.144	41%	0.412	C	S	.	.	S	Bend	trans	-64.4	162.1	178.4	0	0	0	0	0	113	E70 E76 S77	E70-G74 VanDerWaalsContact O-CA 3.26Å; E70-G74 WeakPolarHBondContact O-CA 3.25Å; E70-G74 PolarHBondContact O-N 3.05Å; G74-E76 PolarHBondContact O-N 3.33Å; G74-S77 VanDerWaalsContact O-CB 3.24Å; G74-S77 WeakPolarHBondContact O-CB 3.31Å; G74-S77 PolarHBondContact O-N 2.78Å
75	A	72.3	Confident	79.9	Confident	94 Å²	94	80.6 Å²	80.6	78%	0.777	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.7	-177.5	0	0	0	0	0	113.6
76	E	69.3	Low	79.6	Confident	172 Å²	172	81.5 Å²	81.5	80%	0.804	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	1.1	178.8	-60.8	-61.8	148.3	0	0	113.1	G74 K78	G74-E76 PolarHBondContact O-N 3.33Å; E76-K78 PolarHBondContact O-N 3.07Å; E76-K78 VanDerWaalsContact O-N 3.11Å
77	S	69.8	Low	79.4	Confident	23 Å²	23	81.4 Å²	81.4	16%	0.161	44%	0.437	C	S	.	.			trans	-70.1	109.1	179.2	-177.8	0	0	0	0	110.2	E71 R72 G74 N79	E71-S77 PolarHBondContact O-OG 2.87Å; R72-S77 PolarHBondContact O-OG 3.34Å; R72-S77 VanDerWaalsContact O-OG 3.13Å; G74-S77 VanDerWaalsContact O-CB 3.24Å; G74-S77 WeakPolarHBondContact O-CB 3.31Å; G74-S77 PolarHBondContact O-N 2.78Å; S77-N79 PolarHBondContact O-N 2.78Å
78	K	61.4	Low	79.2	Confident	200 Å²	200	87.2 Å²	87.2	87%	0.87	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-5.8	177	-63.1	-177.8	-178.7	177.6	0	113.4	E76	E76-K78 PolarHBondContact O-N 3.07Å; E76-K78 VanDerWaalsContact O-N 3.11Å
79	N	59.3	Low	79.2	Confident	159 Å²	159	84.2 Å²	84.2	85%	0.85	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-2.3	-163.5	-84.4	-4.4	0	0	0	115.1	S77	S77-N79 PolarHBondContact O-N 2.78Å
80	S	60.5	Low	79	Confident	31 Å²	31	86 Å²	86	22%	0.217	46%	0.458	C	S	.	.			trans	-139.7	135.9	-176.3	59.1	0	0	0	0	112.8	R72 F82	R72-S80 PolarHBondContact O-OG 2.86Å; S80-F82 PolarHBondContact O-N 2.94Å
81	P	67.9	Low	78.8	Confident	119 Å²	119	83.5 Å²	83.5	77%	0.773	46%	0.46	S	S	*	.	S	Bend	trans	-73.6	1.1	171.4	30.3	-33	0	0	0	112.6
82	F	71.8	Confident	78.6	Confident	118 Å²	118	81.5 Å²	81.5	52%	0.518	45%	0.449	S	S	.	.			trans	-115.8	82.9	-174.6	-57.6	-69.7	0	0	0	109.7	Y73 S80 W122	Y73-F82 WeakPolarHBondContact CD1-O 3.39Å; S80-F82 PolarHBondContact O-N 2.94Å; F82-W122 HydrophobicContact CB-CE3 4.15Å; F82-W122 HydrophobicContact CB-CH2 3.87Å; F82-W122 HydrophobicContact CB-CZ2 4.25Å; F82-W122 HydrophobicContact CB-CZ3 3.79Å
83	T	81	Confident	78.3	Confident	84 Å²	84	80.8 Å²	80.8	52%	0.515	46%	0.455	S	S	.	.			trans	-91.3	146.9	171.5	55	0	0	0	0	110.3
84	C	82.8	Confident	77.7	Confident	24 Å²	24	88.7 Å²	88.7	16%	0.162	49%	0.486	C	S	.	.			trans	-144.4	155.6	171.1	71.5	0	0	0	0	111.7	Y73 L86 W122	Y73-C84 PolarHBondContact O-N 2.87Å; Y73-C84 VanDerWaalsContact O-N 3.15Å; C84-L86 PolarHBondContact O-N 2.68Å; C84-W122 HydrophobicContact CB-CH2 3.86Å; C84-W122 HydrophobicContact CB-CZ2 4.39Å
85	T	85.6	Confident	77.3	Confident	134 Å²	134	94.1 Å²	94.1	82%	0.822	52%	0.516	S	S	*	.			trans	-76.4	104.4	172.7	-49.8	0	0	0	0	109
86	L	87.2	Confident	77.8	Confident	26 Å²	26	92.3 Å²	92.3	14%	0.136	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-73.5	146.5	177	-65	172.7	0	0	0	111	L69 E70 C84 L119	L69-L86 HydrophobicContact CB-CD1 3.97Å; L69-L86 HydrophobicContact CB-CD2 4.19Å; E70-L86 HydrophobicContact CB-CD1 4.28Å; E70-L86 HydrophobicContact CG-CD1 3.75Å; C84-L86 PolarHBondContact O-N 2.68Å; L86-L119 HydrophobicContact CD2-CD1 3.97Å
87	P	90.1	Very high	78.6	Confident	13 Å²	13	86.4 Å²	86.4	8%	0.084	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-68.6	145	175.9	27.7	-33.4	0	0	0	111.5	H66 L89 Y112 N115 L116	H66-P87 PolarHBondContact CE1-O 2.83Å; P87-L89 PolarHBondContact O-N 3Å; P87-Y112 HydrophobicContact CB-CD2 4.04Å; P87-Y112 HydrophobicContact CB-CE2 4.41Å; P87-Y112 HydrophobicContact CG-CD2 3.78Å; P87-Y112 HydrophobicContact CG-CE2 3.74Å; P87-N115 HydrophobicContact CB-CB 3.7Å; P87-N115 HydrophobicContact CG-CB 4.26Å; P87-L116 HydrophobicContact CG-CB 4.34Å
88	M	86.5	Confident	79.4	Confident	165 Å²	165	90.1 Å²	90.1	81%	0.813	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-64.6	128.5	177.6	-68.5	-62.8	-54.6	0	0	111.7
89	L	90.9	Very high	80.7	Confident	18 Å²	18	86.2 Å²	86.2	9%	0.094	48%	0.483	C	S	.	.			trans	-107.1	137.5	168	-168	75.7	0	0	0	109.7	F62 Y63 H66 P87 L109 Y112	F62-L89 HydrophobicContact CB-CD1 4.2Å; F62-L89 HydrophobicContact CB-CD2 4.28Å; Y63-L89 HydrophobicContact CD2-CD2 4.22Å; H66-L89 HydrophobicContact CB-CD2 3.83Å; P87-L89 PolarHBondContact O-N 3Å; L89-L109 HydrophobicContact CD1-CD2 3.9Å; L89-Y112 HydrophobicContact CB-CD2 4.13Å; L89-Y112 HydrophobicContact CB-CE2 4.02Å; L89-Y112 HydrophobicContact CD1-CD1 4.11Å; L89-Y112 HydrophobicContact CD1-CD2 3.74Å; L89-Y112 HydrophobicContact CD1-CE1 4.32Å; L89-Y112 HydrophobicContact CD1-CE2 3.94Å; L89-Y112 HydrophobicContact CD1-CG 3.83Å
90	P	86.6	Confident	82.2	Confident	38 Å²	38	84.3 Å²	84.3	25%	0.247	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-60.5	157.3	178.2	17.6	-26	0	0	0	112.3	Y59 V108	Y59-P90 HydrophobicContact CE2-CG 4.13Å; Y59-P90 WeakPolarHBondContact OH-CG 3.48Å; Y59-P90 PolarHBondContact OH-O 2.83Å; P90-V108 HydrophobicContact CG-CB 4.43Å; P90-V108 HydrophobicContact CG-CG1 3.75Å
91	G	85.7	Confident	83.6	Confident	49 Å²	49	84.2 Å²	84.2	51%	0.505	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-71.6	171.7	176.4	0	0	0	0	0	113.5	Y59 R105	Y59-G91 PolarHBondContact OH-O 2.87Å; Y59-G91 VanDerWaalsContact OH-O 3.09Å; G91-R105 PolarHBondContact O-NH2 3.32Å
92	K	83.9	Confident	84.7	Confident	110 Å²	110	78.8 Å²	78.8	48%	0.478	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-67.9	132.3	168.8	-68.1	177	-179.7	175.4	0	109.4	Y63 Y94	Y63-K92 HydrophobicContact CD2-CG 4.49Å; Y63-K92 HydrophobicContact CE2-CG 4.21Å; K92-Y94 HydrophobicContact CB-CE1 4.16Å; K92-Y94 HydrophobicContact CB-CE2 3.82Å; K92-Y94 HydrophobicContact CD-CE1 4.37Å; K92-Y94 VanDerWaalsContact CD-OH 3.29Å; K92-Y94 WeakPolarHBondContact CD-OH 3.24Å
93	V	81.8	Confident	85.6	Confident	79 Å²	79	77.2 Å²	77.2	48%	0.479	43%	0.425	S	S	.	.			trans	-106.8	120.6	173.8	-179.9	0	0	0	0	106.8	V95 I101	V93-V95 VanDerWaalsContact CG1-O 3.3Å; V93-V95 WeakPolarHBondContact CG1-O 3.34Å; V93-I101 HydrophobicContact CB-CD1 4.46Å; V93-I101 HydrophobicContact CB-CG2 4.37Å; V93-I101 HydrophobicContact CG1-CD1 3.78Å; V93-I101 HydrophobicContact CG1-CG1 4.22Å
94	Y	74.3	Confident	86.1	Confident	193 Å²	193	78.9 Å²	78.9	76%	0.757	43%	0.431	S	S	*	.			trans	-100	-13.2	-173.8	-61	-79.7	0	0	0	113.4	K92	K92-Y94 HydrophobicContact CB-CE1 4.16Å; K92-Y94 HydrophobicContact CB-CE2 3.82Å; K92-Y94 HydrophobicContact CD-CE1 4.37Å; K92-Y94 VanDerWaalsContact CD-OH 3.29Å; K92-Y94 WeakPolarHBondContact CD-OH 3.24Å
95	V	74.7	Confident	86.6	Confident	128 Å²	128	79.4 Å²	79.4	78%	0.776	43%	0.429	S	S	*	.	S	Bend	trans	-136.1	136.4	-175	-174.3	0	0	0	0	109.7	V93	V93-V95 VanDerWaalsContact CG1-O 3.3Å; V93-V95 WeakPolarHBondContact CG1-O 3.34Å
96	G	82	Confident	87	Confident	55 Å²	55	75.1 Å²	75.1	57%	0.567	40%	0.401	S	S	*	.	S	Bend	trans	131.4	170.3	175.4	0	0	0	0	0	113.7	K98	G96-K98 PolarHBondContact O-N 2.84Å
97	A	87.1	Confident	87.3	Confident	48 Å²	48	78 Å²	78	40%	0.397	42%	0.421	S	S	.	.			trans	-68.2	120.4	178.4	0	0	0	0	0	110.7	K99 E100 I101	A97-K99 PolarHBondContact O-N 2.8Å; A97-K99 VanDerWaalsContact O-N 3.14Å; A97-E100 HydrophobicContact CB-CB 4.27Å; A97-E100 HydrophobicContact CB-CG 4.06Å; A97-E100 PolarHBondContact O-N 2.83Å; A97-I101 WeakPolarHBondContact O-CG1 3.44Å; A97-I101 PolarHBondContact O-N 2.87Å
98	K	87.3	Confident	87.5	Confident	102 Å²	102	80.4 Å²	80.4	44%	0.443	44%	0.436	S	S	.	.	H	α-helix	trans	-55.2	-36.9	-174.6	-69.3	-177.2	175.4	178.9	0	113.3	N37 F39 G96 A102	N37-K98 VanDerWaalsContact O-CD 3.27Å; N37-K98 WeakPolarHBondContact O-CD 3.03Å; N37-K98 PolarHBondContact O-NZ 3.22Å; F39-K98 HydrophobicContact CD2-CB 4.11Å; F39-K98 HydrophobicContact CE2-CB 3.86Å; G96-K98 PolarHBondContact O-N 2.84Å; K98-A102 WeakPolarHBondContact O-CB 3.38Å; K98-A102 PolarHBondContact O-N 2.85Å
99	K	88.7	Confident	88	Confident	117 Å²	117	72.6 Å²	72.6	51%	0.509	40%	0.397	S	S	.	.	H	α-helix	trans	-65.4	-52.3	178.6	-174.6	179.3	170.7	-171.8	0	111.9	F39 A97 I101 A102 E103	F39-K99 HydrophobicContact CE1-CB 4.16Å; F39-K99 HydrophobicContact CE1-CG 3.98Å; F39-K99 VanDerWaalsContact CE2-CA 3.47Å; F39-K99 HydrophobicContact CE2-CB 3.92Å; F39-K99 VanDerWaalsContact CZ-CA 3.49Å; F39-K99 HydrophobicContact CZ-CB 3.48Å; F39-K99 VanDerWaalsContact CZ-CB 3.48Å; F39-K99 HydrophobicContact CZ-CG 3.79Å; A97-K99 PolarHBondContact O-N 2.8Å; A97-K99 VanDerWaalsContact O-N 3.14Å; K99-I101 VanDerWaalsContact C-N 3.3Å; K99-I101 PolarHBondContact O-N 2.84Å; K99-A102 WeakPolarHBondContact O-CA 3.38Å; K99-A102 WeakPolarHBondContact O-CB 3.27Å; K99-A102 PolarHBondContact O-N 2.87Å; K99-E103 WeakPolarHBondContact CE-OE1 3.3Å; K99-E103 IonicContact NZ-OE1 2.91Å; K99-E103 WeakPolarHBondContact O-CG 3.35Å; K99-E103 PolarHBondContact O-N 2.97Å
100	E	89.3	Confident	88.1	Confident	119 Å²	119	73.4 Å²	73.4	56%	0.556	40%	0.402	S	S	*	.	H	α-helix	trans	-61.8	-40.5	179.3	-64	175.3	-176.9	0	0	111.2	A97 A102 E103 N104	A97-E100 HydrophobicContact CB-CB 4.27Å; A97-E100 HydrophobicContact CB-CG 4.06Å; A97-E100 PolarHBondContact O-N 2.83Å; E100-A102 VanDerWaalsContact C-N 3.28Å; E100-A102 PolarHBondContact O-N 2.98Å; E100-E103 PolarHBondContact O-N 3.48Å; E100-N104 WeakPolarHBondContact O-CB 3.49Å; E100-N104 VanDerWaalsContact O-CG 3.24Å; E100-N104 PolarHBondContact O-N 2.86Å; E100-N104 PolarHBondContact O-ND2 3.49Å
101	I	90.9	Very high	88.6	Confident	30 Å²	30	73.7 Å²	73.7	15%	0.154	41%	0.408	C	S	.	.	H	α-helix	trans	-59.4	-41.4	174	-65.6	166.4	0	0	0	110.8	V93 A97 K99 R105	V93-I101 HydrophobicContact CB-CD1 4.46Å; V93-I101 HydrophobicContact CB-CG2 4.37Å; V93-I101 HydrophobicContact CG1-CD1 3.78Å; V93-I101 HydrophobicContact CG1-CG1 4.22Å; A97-I101 WeakPolarHBondContact O-CG1 3.44Å; A97-I101 PolarHBondContact O-N 2.87Å; K99-I101 VanDerWaalsContact C-N 3.3Å; K99-I101 PolarHBondContact O-N 2.84Å; I101-R105 WeakPolarHBondContact O-CD 3.47Å; I101-R105 VanDerWaalsContact O-CG 3.26Å; I101-R105 WeakPolarHBondContact O-CG 3.33Å; I101-R105 PolarHBondContact O-N 3.18Å
102	A	90.3	Very high	89	Confident	5 Å²	5	71.5 Å²	71.5	4%	0.041	38%	0.384	C	S	.	.	H	α-helix	trans	-67.3	-45.5	178.1	0	0	0	0	0	111.6	I29 F39 F41 K98 K99 E100 R105 I106	I29-A102 HydrophobicContact CD1-CB 4.43Å; F39-A102 HydrophobicContact CB-CB 3.59Å; F39-A102 HydrophobicContact CD1-CB 4.13Å; F39-A102 HydrophobicContact CD2-CB 4.13Å; F39-A102 HydrophobicContact CG-CB 3.67Å; F41-A102 HydrophobicContact CE1-CB 4.5Å; F41-A102 WeakPolarHBondContact CE1-O 3.33Å; F41-A102 HydrophobicContact CZ-CB 4.28Å; K98-A102 WeakPolarHBondContact O-CB 3.38Å; K98-A102 PolarHBondContact O-N 2.85Å; K99-A102 WeakPolarHBondContact O-CA 3.38Å; K99-A102 WeakPolarHBondContact O-CB 3.27Å; K99-A102 PolarHBondContact O-N 2.87Å; E100-A102 VanDerWaalsContact C-N 3.28Å; E100-A102 PolarHBondContact O-N 2.98Å; A102-R105 WeakPolarHBondContact O-CB 3.02Å; A102-R105 PolarHBondContact O-N 2.9Å; A102-I106 PolarHBondContact O-N 2.93Å
103	E	91.1	Very high	89.6	Confident	85 Å²	85	66.3 Å²	66.3	40%	0.397	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-45.9	178.1	-71.9	175	171.7	0	0	111.9	I29 K99 E100 R105 I106	I29-E103 HydrophobicContact CD1-CG 3.45Å; I29-E103 VanDerWaalsContact CD1-CG 3.45Å; K99-E103 WeakPolarHBondContact CE-OE1 3.3Å; K99-E103 IonicContact NZ-OE1 2.91Å; K99-E103 WeakPolarHBondContact O-CG 3.35Å; K99-E103 PolarHBondContact O-N 2.97Å; E100-E103 PolarHBondContact O-N 3.48Å; E103-R105 PolarHBondContact O-N 3.12Å; E103-I106 WeakPolarHBondContact O-CB 3.46Å; E103-I106 WeakPolarHBondContact O-CG1 3.21Å; E103-I106 PolarHBondContact O-N 3.45Å; E103-I106 VanDerWaalsContact O-N 3.14Å
104	N	91.8	Very high	90.3	Very high	118 Å²	118	69.1 Å²	69.1	63%	0.631	37%	0.367	S	S	*	.	H	α-helix	trans	-64	-24.4	177.5	-72.3	-27.1	0	0	0	113.2	E100	E100-N104 WeakPolarHBondContact O-CB 3.49Å; E100-N104 VanDerWaalsContact O-CG 3.24Å; E100-N104 PolarHBondContact O-N 2.86Å; E100-N104 PolarHBondContact O-ND2 3.49Å
105	R	93.9	Very high	91.2	Very high	35 Å²	35	63.9 Å²	63.9	13%	0.132	35%	0.352	C	S	.	.	H	α-helix	trans	-78.9	-20.5	177.3	-80.4	171.8	169.1	169.6	-2.4	113.5	F41 Y59 G91 I101 A102 E103 V108 L109	F41-R105 HydrophobicContact CZ-CB 4.13Å; Y59-R105 VanDerWaalsContact CE1-NH2 3.25Å; Y59-R105 HydrophobicContact CE2-CG 4.41Å; Y59-R105 VanDerWaalsContact CE2-NE 3.33Å; Y59-R105 VanDerWaalsContact CZ-CZ 3.45Å; G91-R105 PolarHBondContact O-NH2 3.32Å; I101-R105 WeakPolarHBondContact O-CD 3.47Å; I101-R105 VanDerWaalsContact O-CG 3.26Å; I101-R105 WeakPolarHBondContact O-CG 3.33Å; I101-R105 PolarHBondContact O-N 3.18Å; A102-R105 WeakPolarHBondContact O-CB 3.02Å; A102-R105 PolarHBondContact O-N 2.9Å; E103-R105 PolarHBondContact O-N 3.12Å; R105-V108 PolarHBondContact O-N 3.3Å; R105-L109 HydrophobicContact CB-CD1 4.07Å; R105-L109 HydrophobicContact CB-CG 4.26Å; R105-L109 WeakPolarHBondContact O-CB 3.43Å; R105-L109 VanDerWaalsContact O-CG 3.3Å; R105-L109 WeakPolarHBondContact O-CG 3.38Å; R105-L109 PolarHBondContact O-N 2.9Å
106	I	92.4	Very high	92.1	Very high	45 Å²	45	57.8 Å²	57.8	23%	0.231	32%	0.315	C	S	.	.	H	α-helix	trans	-51.4	-55.8	-177.2	-63.2	172.6	0	0	0	112.8	I26 I29 F41 A102 E103 V108 L109 N110	I26-I106 HydrophobicContact CB-CG2 4.21Å; I26-I106 HydrophobicContact CD1-CB 4.48Å; I26-I106 HydrophobicContact CD1-CG2 4.27Å; I26-I106 HydrophobicContact CG2-CG1 4.44Å; I26-I106 HydrophobicContact CG2-CG2 4.23Å; I29-I106 HydrophobicContact CG2-CD1 3.94Å; I29-I106 HydrophobicContact CG2-CG1 4.17Å; F41-I106 HydrophobicContact CE1-CG1 4.19Å; A102-I106 PolarHBondContact O-N 2.93Å; E103-I106 WeakPolarHBondContact O-CB 3.46Å; E103-I106 WeakPolarHBondContact O-CG1 3.21Å; E103-I106 PolarHBondContact O-N 3.45Å; E103-I106 VanDerWaalsContact O-N 3.14Å; I106-V108 VanDerWaalsContact C-N 3.3Å; I106-V108 PolarHBondContact O-N 2.66Å; I106-L109 PolarHBondContact O-N 3.15Å; I106-N110 WeakPolarHBondContact O-CB 3.35Å; I106-N110 PolarHBondContact O-N 2.97Å; I106-N110 PolarHBondContact O-ND2 3.35Å
107	P	94.9	Very high	92.7	Very high	86 Å²	86	56.1 Å²	56.1	56%	0.558	29%	0.293	S	S	*	.	H	α-helix	trans	-63.2	-37.8	-178.1	23.7	-34.2	0	0	0	112.4	A111	P107-A111 WeakPolarHBondContact O-CB 3.41Å; P107-A111 PolarHBondContact O-N 3.13Å
108	V	94.3	Very high	92.9	Very high	64 Å²	64	58.6 Å²	58.6	39%	0.388	31%	0.306	S	S	.	.	H	α-helix	trans	-69.2	-42.3	-179.2	-171.5	0	0	0	0	111.2	P90 R105 I106 A111 Y112	P90-V108 HydrophobicContact CG-CB 4.43Å; P90-V108 HydrophobicContact CG-CG1 3.75Å; R105-V108 PolarHBondContact O-N 3.3Å; I106-V108 VanDerWaalsContact C-N 3.3Å; I106-V108 PolarHBondContact O-N 2.66Å; V108-A111 PolarHBondContact O-N 3.45Å; V108-Y112 WeakPolarHBondContact O-CB 3.4Å; V108-Y112 PolarHBondContact O-N 3.01Å
109	L	95.6	Very high	93.1	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.1	-37.2	177.7	-69.1	178.9	0	0	0	112.2	I26 F41 Y59 F62 L89 R105 I106 Y112 M113	I26-L109 HydrophobicContact CD1-CB 3.64Å; I26-L109 HydrophobicContact CD1-CD1 4.13Å; F41-L109 HydrophobicContact CD1-CD1 4.08Å; F41-L109 HydrophobicContact CD2-CD1 3.85Å; F41-L109 HydrophobicContact CE1-CD1 3.77Å; F41-L109 HydrophobicContact CE2-CD1 3.53Å; F41-L109 HydrophobicContact CG-CD1 4.12Å; F41-L109 HydrophobicContact CZ-CD1 3.49Å; F41-L109 VanDerWaalsContact CZ-CD1 3.49Å; Y59-L109 HydrophobicContact CD2-CD1 4.43Å; Y59-L109 HydrophobicContact CD2-CD2 4.28Å; Y59-L109 HydrophobicContact CE2-CD2 4.22Å; F62-L109 HydrophobicContact CB-CD2 4.43Å; F62-L109 HydrophobicContact CD1-CD2 3.88Å; F62-L109 HydrophobicContact CD2-CD2 4.36Å; F62-L109 HydrophobicContact CE1-CD2 4.13Å; F62-L109 HydrophobicContact CE2-CD1 4.29Å; F62-L109 HydrophobicContact CG-CD2 3.99Å; F62-L109 HydrophobicContact CZ-CD1 4.43Å; F62-L109 HydrophobicContact CZ-CD2 4.47Å; L89-L109 HydrophobicContact CD1-CD2 3.9Å; R105-L109 HydrophobicContact CB-CD1 4.07Å; R105-L109 HydrophobicContact CB-CG 4.26Å; R105-L109 WeakPolarHBondContact O-CB 3.43Å; R105-L109 VanDerWaalsContact O-CG 3.3Å; R105-L109 WeakPolarHBondContact O-CG 3.38Å; R105-L109 PolarHBondContact O-N 2.9Å; I106-L109 PolarHBondContact O-N 3.15Å; L109-Y112 PolarHBondContact O-N 3.06Å; L109-M113 WeakPolarHBondContact O-CG 3.46Å; L109-M113 PolarHBondContact O-N 3.13Å
110	N	94.9	Very high	93.1	Very high	35 Å²	35	52.1 Å²	52.1	19%	0.187	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-44.5	171.7	-79.4	-24.2	0	0	0	111.5	N25 I26 I106 M113 K114	N25-N110 WeakPolarHBondContact CA-OD1 3.28Å; I26-N110 WeakPolarHBondContact CG1-OD1 3.31Å; I26-N110 PolarHBondContact N-OD1 3.3Å; I106-N110 WeakPolarHBondContact O-CB 3.35Å; I106-N110 PolarHBondContact O-N 2.97Å; I106-N110 PolarHBondContact O-ND2 3.35Å; N110-M113 PolarHBondContact O-N 3.07Å; N110-M113 WeakPolarHBondContact OD1-CE 3.42Å; N110-K114 VanDerWaalsContact O-CB 3.32Å; N110-K114 WeakPolarHBondContact O-CB 3.46Å; N110-K114 PolarHBondContact O-N 3.42Å
111	A	95.3	Very high	93.1	Very high	45 Å²	45	49.6 Å²	49.6	37%	0.372	28%	0.275	S	S	.	.	H	α-helix	trans	-63.2	-42.9	175.4	0	0	0	0	0	111.9	P107 V108 K114 N115	P107-A111 WeakPolarHBondContact O-CB 3.41Å; P107-A111 PolarHBondContact O-N 3.13Å; V108-A111 PolarHBondContact O-N 3.45Å; A111-K114 PolarHBondContact O-N 3.5Å; A111-N115 WeakPolarHBondContact O-CB 3.42Å; A111-N115 PolarHBondContact O-N 3.28Å; A111-N115 PolarHBondContact O-ND2 2.9Å
112	Y	95.8	Very high	92.9	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-52.5	175.8	174.8	-93.8	0	0	0	111.7	F62 H66 P87 L89 V108 L109 K114 N115 L116	F62-Y112 AromaticContact CD1-CD1 3.97Å; F62-Y112 HydrophobicContact CD1-CD1 3.97Å; F62-Y112 HydrophobicContact CD1-CE1 4.01Å; F62-Y112 HydrophobicContact CE1-CD1 4.36Å; H66-Y112 AromaticContact ND1-CE2 3.77Å; P87-Y112 HydrophobicContact CB-CD2 4.04Å; P87-Y112 HydrophobicContact CB-CE2 4.41Å; P87-Y112 HydrophobicContact CG-CD2 3.78Å; P87-Y112 HydrophobicContact CG-CE2 3.74Å; L89-Y112 HydrophobicContact CB-CD2 4.13Å; L89-Y112 HydrophobicContact CB-CE2 4.02Å; L89-Y112 HydrophobicContact CD1-CD1 4.11Å; L89-Y112 HydrophobicContact CD1-CD2 3.74Å; L89-Y112 HydrophobicContact CD1-CE1 4.32Å; L89-Y112 HydrophobicContact CD1-CE2 3.94Å; L89-Y112 HydrophobicContact CD1-CG 3.83Å; V108-Y112 WeakPolarHBondContact O-CB 3.4Å; V108-Y112 PolarHBondContact O-N 3.01Å; L109-Y112 PolarHBondContact O-N 3.06Å; Y112-K114 PolarHBondContact O-N 3.41Å; Y112-N115 PolarHBondContact O-N 3.28Å; Y112-L116 HydrophobicContact CE1-CD2 3.97Å; Y112-L116 VanDerWaalsContact O-CB 3.28Å; Y112-L116 WeakPolarHBondContact O-CB 3.4Å; Y112-L116 PolarHBondContact O-N 3.31Å
113	M	96.1	Very high	92.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-42.5	179.5	-69.4	-175.3	-64.3	0	0	112	A24 I26 I43 F62 L109 N110 N115 L116 L117 F133	A24-M113 HydrophobicContact CB-CB 4.22Å; A24-M113 HydrophobicContact CB-CE 4.4Å; A24-M113 HydrophobicContact CB-SD 3.83Å; I26-M113 HydrophobicContact CD1-CE 4.38Å; I26-M113 HydrophobicContact CG1-CE 3.89Å; I43-M113 HydrophobicContact CD1-SD 4.05Å; I43-M113 HydrophobicContact CG1-SD 4.44Å; I43-M113 HydrophobicContact CG2-CE 4.06Å; I43-M113 HydrophobicContact CG2-SD 3.86Å; F62-M113 HydrophobicContact CE1-CG 3.79Å; F62-M113 HydrophobicContact CE1-SD 3.88Å; F62-M113 HydrophobicContact CZ-SD 4.02Å; L109-M113 WeakPolarHBondContact O-CG 3.46Å; L109-M113 PolarHBondContact O-N 3.13Å; N110-M113 PolarHBondContact O-N 3.07Å; N110-M113 WeakPolarHBondContact OD1-CE 3.42Å; M113-N115 VanDerWaalsContact C-N 3.33Å; M113-N115 PolarHBondContact O-N 2.92Å; M113-L116 PolarHBondContact O-N 3.13Å; M113-L117 WeakPolarHBondContact O-CG 2.99Å; M113-L117 PolarHBondContact O-N 2.94Å; M113-F133 HydrophobicContact CB-CZ 4.45Å; M113-F133 HydrophobicContact CG-CE1 4.29Å; M113-F133 HydrophobicContact CG-CZ 4.24Å; M113-F133 HydrophobicContact SD-CE1 4.11Å
114	K	95.1	Very high	92.7	Very high	139 Å²	139	48.9 Å²	48.9	60%	0.604	27%	0.267	S	S	*	.	H	α-helix	trans	-57.8	-47.6	175.9	-176.8	-176.1	176.4	-177.3	0	111.2	N110 A111 Y112 C118	N110-K114 VanDerWaalsContact O-CB 3.32Å; N110-K114 WeakPolarHBondContact O-CB 3.46Å; N110-K114 PolarHBondContact O-N 3.42Å; A111-K114 PolarHBondContact O-N 3.5Å; Y112-K114 PolarHBondContact O-N 3.41Å; K114-C118 PolarHBondContact O-N 3.27Å; K114-C118 PolarHBondContact O-SG 2.78Å
115	N	94.5	Very high	92.6	Very high	82 Å²	82	46.5 Å²	46.5	44%	0.439	25%	0.252	S	S	.	.	H	α-helix	trans	-70.2	-36	-179.4	-67.1	-18.3	0	0	0	112	P87 A111 Y112 M113 C118 L119	P87-N115 HydrophobicContact CB-CB 3.7Å; P87-N115 HydrophobicContact CG-CB 4.26Å; A111-N115 WeakPolarHBondContact O-CB 3.42Å; A111-N115 PolarHBondContact O-N 3.28Å; A111-N115 PolarHBondContact O-ND2 2.9Å; Y112-N115 PolarHBondContact O-N 3.28Å; M113-N115 VanDerWaalsContact C-N 3.33Å; M113-N115 PolarHBondContact O-N 2.92Å; N115-C118 PolarHBondContact O-N 2.79Å; N115-L119 PolarHBondContact O-N 3.32Å
116	L	94.1	Very high	92.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-43.9	176.5	-175.3	69.4	0	0	0	111.6	L65 L69 P87 Y112 M113 C118 L119 F133	L65-L116 HydrophobicContact CD2-CD2 3.96Å; L69-L116 HydrophobicContact CD1-CD1 3.66Å; P87-L116 HydrophobicContact CG-CB 4.34Å; Y112-L116 HydrophobicContact CE1-CD2 3.97Å; Y112-L116 VanDerWaalsContact O-CB 3.28Å; Y112-L116 WeakPolarHBondContact O-CB 3.4Å; Y112-L116 PolarHBondContact O-N 3.31Å; M113-L116 PolarHBondContact O-N 3.13Å; L116-C118 PolarHBondContact O-N 2.84Å; L116-L119 HydrophobicContact CD1-CD1 3.78Å; L116-L119 VanDerWaalsContact O-CB 3.28Å; L116-L119 WeakPolarHBondContact O-CB 3.33Å; L116-L119 WeakPolarHBondContact O-CG 3.35Å; L116-L119 PolarHBondContact O-N 2.73Å; L116-F133 HydrophobicContact CD2-CE2 3.88Å; L116-F133 HydrophobicContact CD2-CZ 4.15Å
117	L	93.4	Very high	92.3	Very high	20 Å²	20	49.4 Å²	49.4	11%	0.105	27%	0.267	C	S	.	.	H	α-helix	trans	-73.9	-12.6	178	-64.4	177.3	0	0	0	113.5	P21 A24 M113 L124 F133	P21-L117 HydrophobicContact CB-CD2 4.03Å; P21-L117 HydrophobicContact CG-CD2 3.78Å; A24-L117 HydrophobicContact CB-CD1 3.99Å; M113-L117 WeakPolarHBondContact O-CG 2.99Å; M113-L117 PolarHBondContact O-N 2.94Å; L117-L124 HydrophobicContact CD2-CD1 3.61Å; L117-F133 HydrophobicContact CD1-CZ 4.43Å; L117-F133 HydrophobicContact CD2-CD2 4.04Å; L117-F133 HydrophobicContact CD2-CE2 3.66Å; L117-F133 HydrophobicContact CD2-CZ 3.98Å; L117-F133 HydrophobicContact CG-CE2 4.32Å; L117-F133 HydrophobicContact CG-CZ 4.18Å
118	C	92.1	Very high	92.1	Very high	99 Å²	99	47.1 Å²	47.1	67%	0.669	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-0.5	171.5	-70.3	0	0	0	0	113.2	K114 N115 L116	K114-C118 PolarHBondContact O-N 3.27Å; K114-C118 PolarHBondContact O-SG 2.78Å; N115-C118 PolarHBondContact O-N 2.79Å; L116-C118 PolarHBondContact O-N 2.84Å
119	L	90.9	Very high	91.9	Very high	28 Å²	28	44.1 Å²	44.1	15%	0.147	23%	0.231	C	C	.	.	S	Bend	trans	-68.3	163.6	175.1	-69.2	-176.2	0	0	0	111.3	L86 N115 L116 V123	L86-L119 HydrophobicContact CD2-CD1 3.97Å; N115-L119 PolarHBondContact O-N 3.32Å; L116-L119 HydrophobicContact CD1-CD1 3.78Å; L116-L119 VanDerWaalsContact O-CB 3.28Å; L116-L119 WeakPolarHBondContact O-CB 3.33Å; L116-L119 WeakPolarHBondContact O-CG 3.35Å; L116-L119 PolarHBondContact O-N 2.73Å; L119-V123 HydrophobicContact CB-CB 4.08Å; L119-V123 HydrophobicContact CB-CG1 4.26Å; L119-V123 HydrophobicContact CB-CG2 4.35Å; L119-V123 HydrophobicContact CD1-CB 4.42Å; L119-V123 HydrophobicContact CD1-CG1 3.78Å
120	P	89.4	Confident	91.7	Very high	55 Å²	55	48.2 Å²	48.2	36%	0.357	25%	0.246	S	C	.	.			trans	-54.2	150.5	178	-27.7	36.6	0	0	0	113.5	W122 V123 L124	P120-W122 HydrophobicContact CB-CD2 4.18Å; P120-W122 VanDerWaalsContact CB-CE2 3.49Å; P120-W122 HydrophobicContact CB-CG 4.33Å; P120-W122 HydrophobicContact CB-CZ2 3.88Å; P120-W122 HydrophobicContact CG-CZ2 3.87Å; P120-W122 PolarHBondContact O-N 2.79Å; P120-W122 VanDerWaalsContact O-N 3.1Å; P120-V123 WeakPolarHBondContact O-CB 3.27Å; P120-V123 PolarHBondContact O-N 3.28Å; P120-L124 PolarHBondContact O-N 2.85Å; P120-L124 VanDerWaalsContact O-N 3.15Å
121	I	87.8	Confident	91.4	Very high	66 Å²	66	51.2 Å²	51.2	34%	0.338	26%	0.261	S	S	.	.	H	α-helix	trans	-51.8	-39.2	-175.8	-72.2	167.9	0	0	0	113.2	D12 L16 V123 L124 M125	D12-I121 HydrophobicContact CB-CD1 3.62Å; L16-I121 HydrophobicContact CD1-CD1 4.48Å; L16-I121 HydrophobicContact CD1-CG1 4.31Å; L16-I121 HydrophobicContact CD2-CB 4.45Å; L16-I121 HydrophobicContact CD2-CD1 4.37Å; L16-I121 HydrophobicContact CD2-CG1 4.2Å; L16-I121 HydrophobicContact CD2-CG2 3.53Å; I121-V123 VanDerWaalsContact C-N 3.27Å; I121-V123 PolarHBondContact O-N 2.82Å; I121-L124 WeakPolarHBondContact O-CB 3.39Å; I121-L124 PolarHBondContact O-N 3.33Å; I121-L124 VanDerWaalsContact O-N 3.14Å; I121-M125 HydrophobicContact CG2-CG 4.11Å; I121-M125 WeakPolarHBondContact O-CB 3.46Å; I121-M125 VanDerWaalsContact O-CG 3.26Å; I121-M125 WeakPolarHBondContact O-CG 3.39Å; I121-M125 PolarHBondContact O-N 2.98Å
122	W	87.3	Confident	91.2	Very high	92 Å²	92	49.9 Å²	49.9	35%	0.348	25%	0.247	S	C	.	.	H	α-helix	trans	-66.9	-26.1	179.8	51.3	-99	0	0	0	113.3	Y73 F82 C84 P120	Y73-W122 HydrophobicContact CD1-CE3 4.41Å; Y73-W122 HydrophobicContact CD1-CH2 4.43Å; Y73-W122 AromaticContact CD1-CZ3 3.57Å; Y73-W122 HydrophobicContact CD1-CZ3 3.57Å; Y73-W122 AromaticContact CE1-CE3 3.98Å; Y73-W122 HydrophobicContact CE1-CE3 3.98Å; Y73-W122 AromaticContact CE1-CZ3 3.59Å; Y73-W122 HydrophobicContact CE1-CZ3 3.59Å; Y73-W122 HydrophobicContact CG-CZ3 4.25Å; F82-W122 HydrophobicContact CB-CE3 4.15Å; F82-W122 HydrophobicContact CB-CH2 3.87Å; F82-W122 HydrophobicContact CB-CZ2 4.25Å; F82-W122 HydrophobicContact CB-CZ3 3.79Å; C84-W122 HydrophobicContact CB-CH2 3.86Å; C84-W122 HydrophobicContact CB-CZ2 4.39Å; P120-W122 HydrophobicContact CB-CD2 4.18Å; P120-W122 VanDerWaalsContact CB-CE2 3.49Å; P120-W122 HydrophobicContact CB-CG 4.33Å; P120-W122 HydrophobicContact CB-CZ2 3.88Å; P120-W122 HydrophobicContact CG-CZ2 3.87Å; P120-W122 PolarHBondContact O-N 2.79Å; P120-W122 VanDerWaalsContact O-N 3.1Å
123	V	89.2	Confident	91	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-76.4	-42.9	168.9	-175.2	0	0	0	0	110.2	Y73 L119 P120 I121 M125 D126 V129	Y73-V123 HydrophobicContact CE2-CG1 4.36Å; L119-V123 HydrophobicContact CB-CB 4.08Å; L119-V123 HydrophobicContact CB-CG1 4.26Å; L119-V123 HydrophobicContact CB-CG2 4.35Å; L119-V123 HydrophobicContact CD1-CB 4.42Å; L119-V123 HydrophobicContact CD1-CG1 3.78Å; P120-V123 WeakPolarHBondContact O-CB 3.27Å; P120-V123 PolarHBondContact O-N 3.28Å; I121-V123 VanDerWaalsContact C-N 3.27Å; I121-V123 PolarHBondContact O-N 2.82Å; V123-M125 PolarHBondContact O-N 2.85Å; V123-D126 WeakPolarHBondContact O-CB 3.48Å; V123-D126 PolarHBondContact O-N 2.81Å; V123-V129 HydrophobicContact CG1-CG2 4.46Å
124	L	88.4	Confident	90.6	Very high	13 Å²	13	56.6 Å²	56.6	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-30.5	-179.9	-172.3	61.5	0	0	0	112.2	V20 P21 L117 P120 I121 V129	V20-L124 HydrophobicContact CG1-CD2 3.44Å; V20-L124 VanDerWaalsContact CG1-CD2 3.44Å; V20-L124 HydrophobicContact CG1-CG 3.92Å; P21-L124 HydrophobicContact CG-CD1 4.4Å; L117-L124 HydrophobicContact CD2-CD1 3.61Å; P120-L124 PolarHBondContact O-N 2.85Å; P120-L124 VanDerWaalsContact O-N 3.15Å; I121-L124 WeakPolarHBondContact O-CB 3.39Å; I121-L124 PolarHBondContact O-N 3.33Å; I121-L124 VanDerWaalsContact O-N 3.14Å; L124-V129 HydrophobicContact CD1-CG1 4.41Å
125	M	88.8	Confident	90	Very high	67 Å²	67	52.9 Å²	52.9	33%	0.33	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-2	176.5	-67.8	-65.9	-127.9	0	0	113.9	L16 P17 V20 I121 V123	L16-M125 HydrophobicContact CD2-CE 3.9Å; L16-M125 HydrophobicContact CD2-CG 4.48Å; L16-M125 HydrophobicContact CD2-SD 4.47Å; P17-M125 HydrophobicContact CG-CE 3.84Å; V20-M125 HydrophobicContact CG2-SD 4.23Å; I121-M125 HydrophobicContact CG2-CG 4.11Å; I121-M125 WeakPolarHBondContact O-CB 3.46Å; I121-M125 VanDerWaalsContact O-CG 3.26Å; I121-M125 WeakPolarHBondContact O-CG 3.39Å; I121-M125 PolarHBondContact O-N 2.98Å; V123-M125 PolarHBondContact O-N 2.85Å
126	D	89.9	Confident	89.1	Confident	14 Å²	14	50.5 Å²	50.5	8%	0.075	25%	0.248	C	C	.	.	S	Bend	trans	-59.7	138.4	172.4	-178.6	-92	0	0	0	110.3	R72 Y73 V123 E128 V129 R130	R72-D126 IonicContact CZ-OD2 3.87Å; R72-D126 IonicContact NH1-OD1 3.94Å; R72-D126 IonicContact NH1-OD2 2.75Å; R72-D126 PolarHBondContact NH1-OD2 3.37Å; Y73-D126 HydrophobicContact CE2-CB 4.42Å; Y73-D126 PolarHBondContact OH-OD2 2.8Å; V123-D126 WeakPolarHBondContact O-CB 3.48Å; V123-D126 PolarHBondContact O-N 2.81Å; D126-E128 VanDerWaalsContact C-N 3.27Å; D126-E128 PolarHBondContact O-N 3.14Å; D126-E128 VanDerWaalsContact OD1-CB 3.28Å; D126-E128 WeakPolarHBondContact OD1-CB 3.45Å; D126-E128 PolarHBondContact OD1-N 2.9Å; D126-V129 HydrophobicContact CB-CG2 4.17Å; D126-V129 PolarHBondContact O-N 3.24Å; D126-R130 WeakPolarHBondContact O-CG 3.33Å; D126-R130 PolarHBondContact O-N 2.8Å
127	E	90	Very high	88	Confident	127 Å²	127	55.9 Å²	55.9	59%	0.593	28%	0.281	S	S	*	.	H	α-helix	trans	-56.5	-40.9	-175.7	-175	-178.4	-179.7	0	0	112.3	R130 L131	E127-R130 PolarHBondContact O-N 3.01Å; E127-L131 HydrophobicContact CG-CD1 3.85Å; E127-L131 HydrophobicContact CG-CG 4.36Å; E127-L131 WeakPolarHBondContact O-CB 3.49Å; E127-L131 VanDerWaalsContact O-CG 3.26Å; E127-L131 WeakPolarHBondContact O-CG 3.27Å; E127-L131 PolarHBondContact O-N 2.98Å
128	E	91.3	Very high	87	Confident	39 Å²	39	57.7 Å²	57.7	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-70	-38.4	-177.1	-61.6	-72.3	172.3	0	0	111.3	L65 K68 D126 F132	L65-E128 HydrophobicContact CD1-CB 3.76Å; K68-E128 HydrophobicContact CD-CG 3.86Å; K68-E128 WeakPolarHBondContact CD-OE2 3.35Å; K68-E128 IonicContact NZ-OE1 3.87Å; K68-E128 PolarHBondContact NZ-OE1 2.75Å; K68-E128 IonicContact NZ-OE2 3.38Å; K68-E128 PolarHBondContact NZ-OE2 3.31Å; D126-E128 VanDerWaalsContact C-N 3.27Å; D126-E128 PolarHBondContact O-N 3.14Å; D126-E128 VanDerWaalsContact OD1-CB 3.28Å; D126-E128 WeakPolarHBondContact OD1-CB 3.45Å; D126-E128 PolarHBondContact OD1-N 2.9Å; E128-F132 VanDerWaalsContact O-CB 3.28Å; E128-F132 WeakPolarHBondContact O-CB 3.4Å; E128-F132 PolarHBondContact O-N 3.5Å
129	V	91.1	Very high	86.3	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-46.2	175.3	-179.3	0	0	0	0	110.1	L65 L69 V123 L124 D126 F132 F133	L65-V129 HydrophobicContact CD1-CG2 4.38Å; L69-V129 HydrophobicContact CD1-CG2 4.15Å; L69-V129 HydrophobicContact CD2-CG2 3.82Å; V123-V129 HydrophobicContact CG1-CG2 4.46Å; L124-V129 HydrophobicContact CD1-CG1 4.41Å; D126-V129 HydrophobicContact CB-CG2 4.17Å; D126-V129 PolarHBondContact O-N 3.24Å; V129-F132 WeakPolarHBondContact O-CB 3.47Å; V129-F132 PolarHBondContact O-N 3.47Å; V129-F133 HydrophobicContact CG1-CD2 4.05Å; V129-F133 HydrophobicContact CG1-CE2 4.07Å; V129-F133 WeakPolarHBondContact O-CD2 3.5Å; V129-F133 PolarHBondContact O-N 3.44Å
130	R	89.6	Confident	85.4	Confident	86 Å²	86	55.2 Å²	55.2	33%	0.325	27%	0.274	S	S	.	.	H	α-helix	trans	-61.9	-48.5	178.6	-70.9	-169.1	69	159.4	4	111.6	D19 D126 E127 F132 F133 Y134	D19-R130 IonicContact OD1-NH2 2.74Å; D19-R130 PolarHBondContact OD1-NH2 2.81Å; D19-R130 IonicContact OD2-CZ 2.67Å; D19-R130 IonicContact OD2-NH2 3.62Å; D19-R130 PolarHBondContact OD2-NH2 3.09Å; D126-R130 WeakPolarHBondContact O-CG 3.33Å; D126-R130 PolarHBondContact O-N 2.8Å; E127-R130 PolarHBondContact O-N 3.01Å; R130-F132 VanDerWaalsContact C-N 3.26Å; R130-F132 PolarHBondContact O-N 3.3Å; R130-F133 PolarHBondContact O-N 3.24Å; R130-Y134 VanDerWaalsContact O-CB 3.31Å; R130-Y134 WeakPolarHBondContact O-CB 3.32Å; R130-Y134 PolarHBondContact O-N 2.6Å
131	L	88.5	Confident	84.5	Confident	97 Å²	97	59.2 Å²	59.2	51%	0.508	29%	0.288	S	S	.	.	H	α-helix	trans	-61.2	-36.4	177.3	-74.4	172.7	0	0	0	111.9	E127 F133 Y134	E127-L131 HydrophobicContact CG-CD1 3.85Å; E127-L131 HydrophobicContact CG-CG 4.36Å; E127-L131 WeakPolarHBondContact O-CB 3.49Å; E127-L131 VanDerWaalsContact O-CG 3.26Å; E127-L131 WeakPolarHBondContact O-CG 3.27Å; E127-L131 PolarHBondContact O-N 2.98Å; L131-F133 PolarHBondContact O-N 3.18Å; L131-Y134 PolarHBondContact O-N 2.92Å
132	F	92.3	Very high	83.6	Confident	17 Å²	17	57.3 Å²	57.3	8%	0.075	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-44.5	177.8	-176.6	-93.2	0	0	0	112.3	R57 Q61 F62 L65 E128 V129 R130	R57-F132 HydrophobicContact CB-CZ 4.31Å; R57-F132 HydrophobicContact CG-CE2 4.21Å; R57-F132 HydrophobicContact CG-CZ 4.01Å; R57-F132 VanDerWaalsContact CZ-O 3.31Å; R57-F132 PolarHBondContact NE-O 2.93Å; R57-F132 PolarHBondContact NH2-O 3.09Å; Q61-F132 HydrophobicContact CB-CE2 4.11Å; F62-F132 HydrophobicContact CD1-CE1 4.32Å; F62-F132 HydrophobicContact CD1-CE2 4.44Å; F62-F132 AromaticContact CD1-CZ 3.64Å; F62-F132 HydrophobicContact CD1-CZ 3.64Å; F62-F132 HydrophobicContact CD2-CE2 4.43Å; F62-F132 AromaticContact CD2-CZ 3.98Å; F62-F132 HydrophobicContact CD2-CZ 3.98Å; F62-F132 AromaticContact CE1-CE1 3.99Å; F62-F132 HydrophobicContact CE1-CE1 3.99Å; F62-F132 AromaticContact CE1-CZ 3.57Å; F62-F132 HydrophobicContact CE1-CZ 3.57Å; F62-F132 AromaticContact CE2-CZ 3.91Å; F62-F132 HydrophobicContact CE2-CZ 3.91Å; F62-F132 HydrophobicContact CG-CE2 4.32Å; F62-F132 AromaticContact CG-CZ 3.86Å; F62-F132 HydrophobicContact CG-CZ 3.86Å; F62-F132 HydrophobicContact CZ-CE1 4.28Å; F62-F132 AromaticContact CZ-CZ 3.72Å; F62-F132 HydrophobicContact CZ-CZ 3.72Å; L65-F132 HydrophobicContact CB-CD2 4.23Å; L65-F132 HydrophobicContact CD1-CB 4.46Å; L65-F132 HydrophobicContact CD2-CB 3.9Å; L65-F132 HydrophobicContact CD2-CD1 3.96Å; L65-F132 HydrophobicContact CD2-CD2 3.83Å; L65-F132 HydrophobicContact CD2-CE1 4.47Å; L65-F132 HydrophobicContact CD2-CE2 4.35Å; L65-F132 HydrophobicContact CD2-CG 3.62Å; E128-F132 VanDerWaalsContact O-CB 3.28Å; E128-F132 WeakPolarHBondContact O-CB 3.4Å; E128-F132 PolarHBondContact O-N 3.5Å; V129-F132 WeakPolarHBondContact O-CB 3.47Å; V129-F132 PolarHBondContact O-N 3.47Å; R130-F132 VanDerWaalsContact C-N 3.26Å; R130-F132 PolarHBondContact O-N 3.3Å
133	F	90.8	Very high	82.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-89	-7.7	-179.9	-69.3	-71.3	0	0	0	114.5	P21 A24 V45 Y53 I55 M113 L116 L117 V129 R130 L131	P21-F133 HydrophobicContact CB-CB 4.11Å; P21-F133 HydrophobicContact CB-CG 4.26Å; P21-F133 HydrophobicContact CG-CB 3.83Å; P21-F133 HydrophobicContact CG-CD2 4.08Å; P21-F133 HydrophobicContact CG-CG 4.03Å; A24-F133 HydrophobicContact CB-CD1 4.1Å; A24-F133 HydrophobicContact CB-CE1 3.56Å; A24-F133 HydrophobicContact CB-CZ 4.48Å; V45-F133 HydrophobicContact CG2-CD1 4.19Å; Y53-F133 VanDerWaalsContact CE2-O 3.25Å; Y53-F133 WeakPolarHBondContact CE2-O 3.06Å; Y53-F133 PolarHBondContact OH-O 2.93Å; I55-F133 HydrophobicContact CD1-CD1 4.18Å; M113-F133 HydrophobicContact CB-CZ 4.45Å; M113-F133 HydrophobicContact CG-CE1 4.29Å; M113-F133 HydrophobicContact CG-CZ 4.24Å; M113-F133 HydrophobicContact SD-CE1 4.11Å; L116-F133 HydrophobicContact CD2-CE2 3.88Å; L116-F133 HydrophobicContact CD2-CZ 4.15Å; L117-F133 HydrophobicContact CD1-CZ 4.43Å; L117-F133 HydrophobicContact CD2-CD2 4.04Å; L117-F133 HydrophobicContact CD2-CE2 3.66Å; L117-F133 HydrophobicContact CD2-CZ 3.98Å; L117-F133 HydrophobicContact CG-CE2 4.32Å; L117-F133 HydrophobicContact CG-CZ 4.18Å; V129-F133 HydrophobicContact CG1-CD2 4.05Å; V129-F133 HydrophobicContact CG1-CE2 4.07Å; V129-F133 WeakPolarHBondContact O-CD2 3.5Å; V129-F133 PolarHBondContact O-N 3.44Å; R130-F133 PolarHBondContact O-N 3.24Å; L131-F133 PolarHBondContact O-N 3.18Å
134	Y	87.3	Confident	81.6	Confident	142 Å²	142	57 Å²	57	56%	0.557	29%	0.286	S	S	*	.	S	Bend	trans	-65.6	144	178.6	-177	-103.4	0	0	0	112.2	R57 R130 L131 S136	R57-Y134 PolarHBondContact NH2-O 3.31Å; R130-Y134 VanDerWaalsContact O-CB 3.31Å; R130-Y134 WeakPolarHBondContact O-CB 3.32Å; R130-Y134 PolarHBondContact O-N 2.6Å; L131-Y134 PolarHBondContact O-N 2.92Å; Y134-S136 PolarHBondContact O-N 3.18Å
135	H	82.4	Confident	80.4	Confident	62 Å²	62	60 Å²	60	29%	0.287	30%	0.3	S	S	.	.			trans	-79.3	98	174.7	-173.7	-119.4	0	0	0	110	Y53 L54 D139 S140	Y53-H135 HydrophobicContact CD2-CB 3.8Å; Y53-H135 HydrophobicContact CE2-CB 3.95Å; Y53-H135 HydrophobicContact CG-CB 4.21Å; L54-H135 PolarHBondContact O-CD2 3.04Å; L54-H135 VanDerWaalsContact O-CD2 3.3Å; H135-D139 VanDerWaalsContact CD2-CB 3.43Å; H135-D139 WeakPolarHBondContact CD2-CB 3.37Å; H135-S140 PolarHBondContact CE1-OG 3.14Å; H135-S140 PolarHBondContact ND1-OG 3.4Å
136	S	76.2	Confident	78.6	Confident	31 Å²	31	63.8 Å²	63.8	22%	0.217	31%	0.31	C	S	.	.			trans	-74.2	169.1	-176.9	69.1	0	0	0	0	112.6	Y134 F138 D139 S140	Y134-S136 PolarHBondContact O-N 3.18Å; S136-F138 VanDerWaalsContact C-N 3.25Å; S136-F138 PolarHBondContact O-N 2.96Å; S136-F138 PolarHBondContact OG-N 3.12Å; S136-D139 WeakPolarHBondContact CB-OD2 3.49Å; S136-D139 PolarHBondContact N-OD2 3.07Å; S136-D139 PolarHBondContact O-N 3.32Å; S136-D139 PolarHBondContact OG-N 2.89Å; S136-D139 VanDerWaalsContact OG-N 3.13Å; S136-D139 PolarHBondContact OG-OD2 3.32Å; S136-S140 PolarHBondContact O-N 3.44Å; S136-S140 VanDerWaalsContact O-N 3.07Å; S136-S140 PolarHBondContact O-OG 3.02Å
137	T	71.4	Confident	76.8	Confident	114 Å²	114	67.6 Å²	67.6	70%	0.699	33%	0.33	S	S	*	.	H	α-helix	trans	-58.3	-40.9	170.4	50.5	0	0	0	0	111.2	D139 S140 E141	T137-D139 VanDerWaalsContact C-N 3.32Å; T137-D139 PolarHBondContact O-N 3Å; T137-S140 WeakPolarHBondContact O-CB 3.22Å; T137-S140 PolarHBondContact O-N 2.97Å; T137-S140 VanDerWaalsContact O-N 3.13Å; T137-E141 WeakPolarHBondContact O-CG 3.38Å; T137-E141 PolarHBondContact O-N 3.45Å; T137-E141 VanDerWaalsContact O-N 3.13Å
138	F	72.5	Confident	75	Confident	59 Å²	59	67 Å²	67	26%	0.259	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-35.7	174.9	177.8	-109.7	0	0	0	113.2	M40 S136 S140 Q142	M40-F138 HydrophobicContact CE-CE1 4.15Å; S136-F138 VanDerWaalsContact C-N 3.25Å; S136-F138 PolarHBondContact O-N 2.96Å; S136-F138 PolarHBondContact OG-N 3.12Å; F138-S140 VanDerWaalsContact C-N 3.34Å; F138-Q142 WeakPolarHBondContact O-CG 3.42Å; F138-Q142 PolarHBondContact O-N 2.7Å; F138-Q142 PolarHBondContact O-NE2 3.2Å
139	D	77.4	Confident	72.9	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.011	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-36.8	174.7	-62.4	-55.1	0	0	0	111.1	I55 F56 R57 H135 S136 T137 E141 Q142	I55-D139 WeakPolarHBondContact CA-OD1 3.27Å; F56-D139 HydrophobicContact CD2-CB 4.31Å; F56-D139 PolarHBondContact N-OD1 2.74Å; R57-D139 IonicContact CZ-OD2 3.69Å; R57-D139 VanDerWaalsContact NH1-CG 3.32Å; R57-D139 IonicContact NH1-OD1 2.78Å; R57-D139 PolarHBondContact NH1-OD1 2.72Å; R57-D139 IonicContact NH1-OD2 3.91Å; R57-D139 PolarHBondContact NH1-OD2 3.02Å; R57-D139 IonicContact NH2-OD2 2.84Å; R57-D139 PolarHBondContact NH2-OD2 3.11Å; H135-D139 VanDerWaalsContact CD2-CB 3.43Å; H135-D139 WeakPolarHBondContact CD2-CB 3.37Å; S136-D139 WeakPolarHBondContact CB-OD2 3.49Å; S136-D139 PolarHBondContact N-OD2 3.07Å; S136-D139 PolarHBondContact O-N 3.32Å; S136-D139 PolarHBondContact OG-N 2.89Å; S136-D139 VanDerWaalsContact OG-N 3.13Å; S136-D139 PolarHBondContact OG-OD2 3.32Å; T137-D139 VanDerWaalsContact C-N 3.32Å; T137-D139 PolarHBondContact O-N 3Å; D139-E141 VanDerWaalsContact C-N 3.34Å; D139-E141 PolarHBondContact O-N 3.02Å; D139-Q142 PolarHBondContact O-N 2.87Å
140	S	71.1	Confident	70.3	Confident	72 Å²	72	79.9 Å²	79.9	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-66.9	-33.1	179.6	-55	0	0	0	0	113.2	H135 S136 T137 F138 Q142	H135-S140 PolarHBondContact CE1-OG 3.14Å; H135-S140 PolarHBondContact ND1-OG 3.4Å; S136-S140 PolarHBondContact O-N 3.44Å; S136-S140 VanDerWaalsContact O-N 3.07Å; S136-S140 PolarHBondContact O-OG 3.02Å; T137-S140 WeakPolarHBondContact O-CB 3.22Å; T137-S140 PolarHBondContact O-N 2.97Å; T137-S140 VanDerWaalsContact O-N 3.13Å; F138-S140 VanDerWaalsContact C-N 3.34Å; S140-Q142 VanDerWaalsContact C-N 3.32Å
141	E	70.4	Confident	67.9	Low	140 Å²	140	85.5 Å²	85.5	65%	0.654	40%	0.4	S	S	*	.	H	α-helix	trans	-78.1	-18.6	177.6	-69.6	172.9	-167.4	0	0	112.6	T137 D139	T137-E141 WeakPolarHBondContact O-CG 3.38Å; T137-E141 PolarHBondContact O-N 3.45Å; T137-E141 VanDerWaalsContact O-N 3.13Å; D139-E141 VanDerWaalsContact C-N 3.34Å; D139-E141 PolarHBondContact O-N 3.02Å
142	Q	70.2	Confident	65.2	Low	25 Å²	25	84.7 Å²	84.7	12%	0.117	40%	0.401	C	S	.	.			trans	-87.6	139.2	-178.8	-77.4	-174.5	86.6	0	0	112.7	F56 F138 D139 S140	F56-Q142 HydrophobicContact CD1-CB 4.49Å; F56-Q142 HydrophobicContact CD2-CB 3.76Å; F56-Q142 HydrophobicContact CD2-CG 4.44Å; F56-Q142 HydrophobicContact CE1-CB 4.17Å; F56-Q142 HydrophobicContact CE2-CB 3.4Å; F56-Q142 HydrophobicContact CE2-CG 4.49Å; F56-Q142 HydrophobicContact CG-CB 4.31Å; F56-Q142 HydrophobicContact CZ-CB 3.63Å; F138-Q142 WeakPolarHBondContact O-CG 3.42Å; F138-Q142 PolarHBondContact O-N 2.7Å; F138-Q142 PolarHBondContact O-NE2 3.2Å; D139-Q142 PolarHBondContact O-N 2.87Å; S140-Q142 VanDerWaalsContact C-N 3.32Å
143	V	67.5	Low	62.9	Low	72 Å²	72	95.3 Å²	95.3	44%	0.436	44%	0.441	S	S	.	.			trans	-123.5	124.8	173.2	179.1	0	0	0	0	107.4	Q145 L147 R148	V143-Q145 PolarHBondContact O-N 2.95Å; V143-L147 HydrophobicContact CG1-CB 4.48Å; V143-R148 HydrophobicContact CB-CG 4.37Å; V143-R148 HydrophobicContact CG1-CG 4.08Å; V143-R148 PolarHBondContact O-NE 2.9Å
144	P	66.8	Low	60.2	Low	15 Å²	15	100.5 Å²	100.5	10%	0.097	47%	0.473	C	S	.	.			trans	-52.6	134.7	-176.1	-27.9	32.2	0	0	0	113.1	E30 V42 L54 F56 R146 L147 R148	E30-P144 WeakPolarHBondContact OE1-CA 3.42Å; V42-P144 HydrophobicContact CG1-CG 4.39Å; L54-P144 HydrophobicContact CD1-CG 3.36Å; F56-P144 HydrophobicContact CZ-CG 4.09Å; P144-R146 VanDerWaalsContact C-N 3.28Å; P144-R146 PolarHBondContact O-N 2.99Å; P144-L147 HydrophobicContact CB-CB 4.44Å; P144-L147 HydrophobicContact CB-CD1 4.24Å; P144-L147 HydrophobicContact CB-CG 4.21Å; P144-L147 HydrophobicContact CG-CD1 4.02Å; P144-L147 WeakPolarHBondContact O-CA 3.37Å; P144-L147 WeakPolarHBondContact O-CB 3.47Å; P144-L147 PolarHBondContact O-N 3.26Å; P144-R148 PolarHBondContact O-N 2.62Å
145	Q	62.3	Low	57.9	Low	76 Å²	76	104.2 Å²	104.2	36%	0.355	49%	0.486	S	S	.	.	H	α-helix	trans	-61.9	-35.6	-174	-156.3	-171	46.3	0	0	111.5	E30 V143 L147 R148 R149	E30-Q145 HydrophobicContact CG-CB 4.18Å; E30-Q145 PolarHBondContact OE1-N 3.17Å; V143-Q145 PolarHBondContact O-N 2.95Å; Q145-L147 VanDerWaalsContact C-N 3.32Å; Q145-L147 PolarHBondContact O-N 2.91Å; Q145-R148 CarbonylContact O-C 3.54Å; Q145-R148 WeakPolarHBondContact O-CA 3.44Å; Q145-R148 WeakPolarHBondContact O-CB 3.43Å; Q145-R148 PolarHBondContact O-N 2.88Å; Q145-R148 VanDerWaalsContact O-N 3.12Å; Q145-R149 WeakPolarHBondContact O-CB 3.44Å; Q145-R149 VanDerWaalsContact O-CG 3.31Å; Q145-R149 WeakPolarHBondContact O-CG 3.38Å; Q145-R149 PolarHBondContact O-N 2.8Å
146	R	52.7	Low	55.6	Low	147 Å²	147	112.2 Å²	112.2	56%	0.555	51%	0.514	S	S	*	.	H	α-helix	trans	-62.3	-36.5	172.3	-75.8	-174.6	-159.4	-169.7	4.8	112.9	D28 P144 R148 R149 L150	D28-R146 IonicContact OD1-CZ 3.74Å; D28-R146 IonicContact OD1-NE 3.6Å; D28-R146 PolarHBondContact OD1-NE 2.97Å; D28-R146 IonicContact OD1-NH2 3.05Å; D28-R146 PolarHBondContact OD1-NH2 2.96Å; D28-R146 WeakPolarHBondContact OD2-CD 3.25Å; D28-R146 WeakPolarHBondContact OD2-CG 3.28Å; D28-R146 IonicContact OD2-CZ 2.85Å; D28-R146 IonicContact OD2-NE 3.33Å; D28-R146 PolarHBondContact OD2-NE 2.86Å; P144-R146 VanDerWaalsContact C-N 3.28Å; P144-R146 PolarHBondContact O-N 2.99Å; R146-R148 VanDerWaalsContact C-N 3.34Å; R146-R149 PolarHBondContact O-N 2.51Å; R146-L150 VanDerWaalsContact O-CB 3.29Å; R146-L150 WeakPolarHBondContact O-CB 3.32Å; R146-L150 VanDerWaalsContact O-CG 3.24Å; R146-L150 WeakPolarHBondContact O-CG 3.48Å; R146-L150 PolarHBondContact O-N 2.84Å
147	L	51.3	Low	53.5	Low	94 Å²	94	115.3 Å²	115.3	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-70.9	-32.1	173.3	-63.8	179.8	0	0	0	111.6	V143 P144 Q145 R151	V143-L147 HydrophobicContact CG1-CB 4.48Å; P144-L147 HydrophobicContact CB-CB 4.44Å; P144-L147 HydrophobicContact CB-CD1 4.24Å; P144-L147 HydrophobicContact CB-CG 4.21Å; P144-L147 HydrophobicContact CG-CD1 4.02Å; P144-L147 WeakPolarHBondContact O-CA 3.37Å; P144-L147 WeakPolarHBondContact O-CB 3.47Å; P144-L147 PolarHBondContact O-N 3.26Å; Q145-L147 VanDerWaalsContact C-N 3.32Å; Q145-L147 PolarHBondContact O-N 2.91Å; L147-R151 PolarHBondContact O-N 3.15Å; L147-R151 VanDerWaalsContact O-N 3.09Å
148	R	52.3	Low	51.8	Low	113 Å²	113	116.9 Å²	116.9	43%	0.426	53%	0.528	S	S	.	.	H	α-helix	trans	-67.1	-33.6	168.5	-59.3	-180	-175	-174.8	-5.3	112.4	V143 P144 Q145 R146 R151	V143-R148 HydrophobicContact CB-CG 4.37Å; V143-R148 HydrophobicContact CG1-CG 4.08Å; V143-R148 PolarHBondContact O-NE 2.9Å; P144-R148 PolarHBondContact O-N 2.62Å; Q145-R148 CarbonylContact O-C 3.54Å; Q145-R148 WeakPolarHBondContact O-CA 3.44Å; Q145-R148 WeakPolarHBondContact O-CB 3.43Å; Q145-R148 PolarHBondContact O-N 2.88Å; Q145-R148 VanDerWaalsContact O-N 3.12Å; R146-R148 VanDerWaalsContact C-N 3.34Å; R148-R151 CarbonylContact O-C 3.56Å
149	R	47.6	Very low	49.9	Very low	169 Å²	169	119 Å²	119	64%	0.638	55%	0.55	S	S	*	*	H	α-helix	trans	-82.3	-34.5	179.1	-70.5	178.6	-168	-139.5	7.7	113.3	Q145 R146 R151 P152	Q145-R149 WeakPolarHBondContact O-CB 3.44Å; Q145-R149 VanDerWaalsContact O-CG 3.31Å; Q145-R149 WeakPolarHBondContact O-CG 3.38Å; Q145-R149 PolarHBondContact O-N 2.8Å; R146-R149 PolarHBondContact O-N 2.51Å; R149-R151 VanDerWaalsContact C-N 3.26Å; R149-P152 WeakPolarHBondContact O-CD 3.45Å; R149-P152 VanDerWaalsContact O-CG 3.27Å; R149-P152 WeakPolarHBondContact O-CG 3.19Å
150	L	35.5	Very low	48.3	Very low	142 Å²	142	125.7 Å²	125.7	74%	0.743	59%	0.59	S	S	*	*	H	α-helix	trans	-74.5	-19.4	172.6	-72	171.6	0	0	0	112.2	R146 P152	R146-L150 VanDerWaalsContact O-CB 3.29Å; R146-L150 WeakPolarHBondContact O-CB 3.32Å; R146-L150 VanDerWaalsContact O-CG 3.24Å; R146-L150 WeakPolarHBondContact O-CG 3.48Å; R146-L150 PolarHBondContact O-N 2.84Å; L150-P152 VanDerWaalsContact O-CD 3.26Å; L150-P152 WeakPolarHBondContact O-CD 3.48Å
151	R	39.1	Very low	46.5	Very low	204 Å²	204	127.2 Å²	127.2	77%	0.77	60%	0.601	S	S	*	*	S	Bend	trans	-106	69.2	156.5	-65	-177.4	-172	165	3.7	109.8	L147 R148 R149 R153	L147-R151 PolarHBondContact O-N 3.15Å; L147-R151 VanDerWaalsContact O-N 3.09Å; R148-R151 CarbonylContact O-C 3.56Å; R149-R151 VanDerWaalsContact C-N 3.26Å; R151-R153 PolarHBondContact O-N 2.68Å; R151-R153 VanDerWaalsContact O-N 3.09Å
152	P	31.7	Very low	45.3	Very low	80 Å²	80	126 Å²	126	52%	0.519	61%	0.606	S	S	.	*			trans	-51	129.6	160.5	-5.4	19.4	0	0	0	105.5	R149 L150 T154	R149-P152 WeakPolarHBondContact O-CD 3.45Å; R149-P152 VanDerWaalsContact O-CG 3.27Å; R149-P152 WeakPolarHBondContact O-CG 3.19Å; L150-P152 VanDerWaalsContact O-CD 3.26Å; L150-P152 WeakPolarHBondContact O-CD 3.48Å; P152-T154 PolarHBondContact O-N 3.03Å
153	R	44.7	Very low	44.1	Very low	240 Å²	240	134 Å²	134	91%	0.906	64%	0.643	S	S	*	*	S	Bend	trans	-72.5	67.1	171.5	-85.3	-169.5	173.7	177.8	-0.3	108.4	R151	R151-R153 PolarHBondContact O-N 2.68Å; R151-R153 VanDerWaalsContact O-N 3.09Å
154	T	33.6	Very low	42.6	Very low	112 Å²	112	137.4 Å²	137.4	69%	0.687	66%	0.658	S	S	*	*			trans	-141.1	126.1	163	45.1	0	0	0	0	108.4	P152	P152-T154 PolarHBondContact O-N 3.03Å
155	R	38.9	Very low	41.1	Very low	219 Å²	219	142 Å²	142	83%	0.826	69%	0.688	S	S	*	*			trans	70.8	77.9	158.3	-131.1	-176.2	-179.4	177.8	-2.2	116.6	V157	R155-V157 HydrophobicContact CB-CG2 4.47Å; R155-V157 VanDerWaalsContact CD-CG2 3.49Å; R155-V157 HydrophobicContact CG-CG2 3.54Å; R155-V157 VanDerWaalsContact NE-CG2 3.33Å; R155-V157 PolarHBondContact O-N 3.34Å
156	R	34	Very low	40.1	Very low	231 Å²	231	145 Å²	145	87%	0.872	71%	0.705	S	S	*	*			trans	-65.2	90.2	134.7	-83.6	-172.5	174.3	179.8	-2.5	106.9	K158	R156-K158 PolarHBondContact O-N 2.86Å
157	V	33.5	Very low	39.3	Very low	96 Å²	96	147.7 Å²	147.7	58%	0.582	72%	0.721	S	S	*	*			trans	-64.9	95.1	149.7	-178.3	0	0	0	0	104.2	R155 S159	R155-V157 HydrophobicContact CB-CG2 4.47Å; R155-V157 VanDerWaalsContact CD-CG2 3.49Å; R155-V157 HydrophobicContact CG-CG2 3.54Å; R155-V157 VanDerWaalsContact NE-CG2 3.33Å; R155-V157 PolarHBondContact O-N 3.34Å; V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 2.94Å
158	K	33.9	Very low	39	Very low	147 Å²	147	148.9 Å²	148.9	64%	0.639	73%	0.728	S	S	*	*			trans	-64.5	102.7	162.3	-93.2	-176.3	173.1	-179.7	0	105.4	R156 V160	R156-K158 PolarHBondContact O-N 2.86Å; K158-V160 PolarHBondContact O-N 2.79Å
159	S	32.4	Very low	38.7	Very low	103 Å²	103	151.3 Å²	151.3	72%	0.72	74%	0.737	S	S	*	*			trans	-51.5	130	155.5	43.8	0	0	0	0	107.6	V157 S161	V157-S159 VanDerWaalsContact C-N 3.29Å; V157-S159 PolarHBondContact O-N 2.94Å; S159-S161 PolarHBondContact O-N 3.49Å
160	V	43.8	Very low	38.7	Very low	142 Å²	142	149.7 Å²	149.7	86%	0.861	74%	0.74	S	S	*	*			trans	-59.8	127.6	177.3	173.9	0	0	0	0	109.4	K158	K158-V160 PolarHBondContact O-N 2.79Å
161	S	33.6	Very low	39.7	Very low	104 Å²	104	144.9 Å²	144.9	73%	0.727	72%	0.721	S	S	*	*			trans	-166.4	153.9	141.7	8.3	0	0	0	0	110	S159	S159-S161 PolarHBondContact O-N 3.49Å
162	P	45.5	Very low	41.1	Very low	116 Å²	116	136.8 Å²	136.8	75%	0.753	70%	0.698	S	S	*	*			trans	-98	153.1	-137	25.7	-12.7	0	0	0	113.7
163	Q	46.4	Very low	43.6	Very low	193 Å²	193	134.3 Å²	134.3	90%	0.902	68%	0.681	S	S	*	*			trans	69.6	90.4	167.8	-58	-177.5	6.1	0	0	116.2
164	L	35	Very low	45.9	Very low	142 Å²	142	125 Å²	125	74%	0.743	65%	0.647	S	S	*	*			trans	-84.8	137.1	157.8	-80.9	162	0	0	0	109.8
165	P	35.5	Very low	48.7	Very low	111 Å²	111	119.7 Å²	119.7	72%	0.721	61%	0.614	S	S	*	*			trans	-64	149.4	178.5	24.6	-30.5	0	0	0	111.9	F167	P165-F167 PolarHBondContact O-N 3.31Å
166	I	41.1	Very low	51.3	Low	140 Å²	140	113 Å²	113	72%	0.718	59%	0.592	S	S	*	*	S	Bend	trans	-68.6	-5.1	-164.5	-69	162.6	0	0	0	114.2	D168	I166-D168 PolarHBondContact O-N 2.84Å
167	F	36.2	Very low	54.1	Low	204 Å²	204	102.1 Å²	102.1	90%	0.895	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	77.9	-178.4	-80.3	-91.7	0	0	0	112.1	P165	P165-F167 PolarHBondContact O-N 3.31Å
168	D	44.4	Very low	57	Low	118 Å²	118	100.7 Å²	100.7	63%	0.631	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-176.3	32.1	132.6	-151.2	5.2	0	0	0	112.7	I166 L170 A171	I166-D168 PolarHBondContact O-N 2.84Å; D168-L170 PolarHBondContact O-N 2.92Å; D168-A171 WeakPolarHBondContact OD1-CB 3.45Å
169	R	46.1	Very low	59.8	Low	165 Å²	165	99.3 Å²	99.3	62%	0.623	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.9	-179.1	-77.3	-174.9	-179.8	-170.9	2	114.1	R174	R169-R174 PolarHBondContact O-NH1 3.14Å
170	L	47.5	Very low	62.7	Low	134 Å²	134	99.3 Å²	99.3	70%	0.702	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-22.3	180	-69.3	166	0	0	0	112.8	D168	D168-L170 PolarHBondContact O-N 2.92Å
171	A	57.4	Low	65	Low	41 Å²	41	93.8 Å²	93.8	34%	0.339	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-19.9	179.4	0	0	0	0	0	113.9	D168 K228	D168-A171 WeakPolarHBondContact OD1-CB 3.45Å; A171-K228 WeakPolarHBondContact O-CD 3.07Å; A171-K228 VanDerWaalsContact O-CE 3.27Å; A171-K228 WeakPolarHBondContact O-CE 3.15Å; A171-K228 PolarHBondContact O-NZ 3.45Å
172	A	67.9	Low	67.7	Low	35 Å²	35	93.6 Å²	93.6	29%	0.289	49%	0.489	S	S	.	.	S	Bend	trans	-72.6	139.4	-177.5	0	0	0	0	0	112.7	R174 Y198	A172-R174 PolarHBondContact O-N 2.83Å; A172-Y198 HydrophobicContact CB-CD1 4.17Å; A172-Y198 HydrophobicContact CB-CE1 4.49Å
173	P	84.9	Confident	69.5	Low	27 Å²	27	89.1 Å²	89.1	18%	0.175	46%	0.464	C	S	.	.			trans	-50.7	133	168.2	-30.1	38.4	0	0	0	112.1	L199 K228 D229 L230	P173-L199 HydrophobicContact CB-CB 3.89Å; P173-L199 PolarHBondContact O-N 3.21Å; P173-K228 CarbonylContact C-O 3.52Å; P173-K228 VanDerWaalsContact CA-O 3.26Å; P173-K228 WeakPolarHBondContact CA-O 3.49Å; P173-D229 WeakPolarHBondContact CB-O 3.48Å; P173-L230 HydrophobicContact CB-CD2 3.97Å; P173-L230 HydrophobicContact CB-CG 4.38Å; P173-L230 HydrophobicContact CG-CD2 4.26Å
174	R	91.8	Very high	71	Confident	46 Å²	46	85.2 Å²	85.2	17%	0.174	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	153.5	-175.4	68.3	-163.7	176	-175.6	0.9	112.8	R169 A172 L196 I197 Y198 I227 K228	R169-R174 PolarHBondContact O-NH1 3.14Å; A172-R174 PolarHBondContact O-N 2.83Å; R174-L196 HydrophobicContact CG-CD1 4.43Å; R174-I197 CarbonylContact C-O 3.58Å; R174-I197 WeakPolarHBondContact CA-O 3.21Å; R174-I197 WeakPolarHBondContact CB-O 3.11Å; R174-Y198 HydrophobicContact CB-CD1 4.27Å; R174-I227 HydrophobicContact CG-CB 4.05Å; R174-I227 HydrophobicContact CG-CG2 4.3Å; R174-I227 PolarHBondContact O-N 3.39Å; R174-K228 HydrophobicContact CG-CB 4.37Å; R174-K228 PolarHBondContact N-O 3.36Å; R174-K228 PolarHBondContact O-N 2.99Å
175	A	91.9	Very high	73	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.5	175.2	0	0	0	0	0	110.4	I197 L199 V224 K225 I226	A175-I197 PolarHBondContact N-O 2.89Å; A175-I197 PolarHBondContact O-N 3.45Å; A175-L199 HydrophobicContact CB-CD1 4.36Å; A175-L199 HydrophobicContact CB-CD2 3.87Å; A175-L199 HydrophobicContact CB-CG 4.29Å; A175-V224 HydrophobicContact CB-CB 3.9Å; A175-V224 HydrophobicContact CB-CG2 3.83Å; A175-K225 CarbonylContact C-O 3.46Å; A175-K225 VanDerWaalsContact CA-O 3.22Å; A175-K225 WeakPolarHBondContact CA-O 3.3Å; A175-K225 WeakPolarHBondContact CB-O 3.46Å; A175-I226 HydrophobicContact CB-CG1 4.48Å
176	E	94.3	Very high	74.9	Confident	79 Å²	79	88.7 Å²	88.7	37%	0.369	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.4	174.2	-178.3	-176.1	168.2	0	0	109.4	L178 D195 V224 K225 I227	E176-L178 PolarHBondContact O-N 3.18Å; E176-D195 WeakPolarHBondContact CA-O 3.42Å; E176-V224 CarbonylContact O-C 3.59Å; E176-V224 VanDerWaalsContact O-CA 3.23Å; E176-V224 WeakPolarHBondContact O-CA 3.33Å; E176-K225 PolarHBondContact N-O 2.84Å; E176-K225 PolarHBondContact O-N 3.2Å; E176-I227 HydrophobicContact CB-CD1 3.81Å; E176-I227 HydrophobicContact CB-CG1 4.38Å
177	A	94	Very high	76.6	Confident	1 Å²	1	88.3 Å²	88.3	1%	0.008	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	122.7	177	0	0	0	0	0	111.8	F191 K192 G194 D195 I197	A177-F191 HydrophobicContact CB-CD2 3.38Å; A177-F191 HydrophobicContact CB-CE2 3.6Å; A177-F191 HydrophobicContact CB-CG 4.43Å; A177-K192 WeakPolarHBondContact CB-O 3.43Å; A177-G194 PolarHBondContact O-N 3.18Å; A177-D195 HydrophobicContact CB-CB 4.24Å; A177-D195 PolarHBondContact N-O 3.22Å; A177-I197 HydrophobicContact CB-CD1 4.48Å
178	L	93.4	Very high	78.9	Confident	67 Å²	67	80.4 Å²	80.4	35%	0.351	42%	0.421	S	S	.	.	S	Bend	trans	-84.5	-27.9	175.3	-68.1	176.8	0	0	0	112.4	E176 K193 F223 K225	E176-L178 PolarHBondContact O-N 3.18Å; L178-K193 VanDerWaalsContact O-CD 3.28Å; L178-K193 WeakPolarHBondContact O-CD 3.38Å; L178-K193 WeakPolarHBondContact O-CE 3.3Å; L178-K193 VanDerWaalsContact O-CG 3.32Å; L178-K193 WeakPolarHBondContact O-CG 3.37Å; L178-F223 PolarHBondContact N-O 3.16Å; L178-K225 HydrophobicContact CD1-CB 4.09Å; L178-K225 HydrophobicContact CD2-CB 3.9Å; L178-K225 HydrophobicContact CG-CB 3.97Å
179	F	93.2	Very high	80.9	Confident	117 Å²	117	74.9 Å²	74.9	51%	0.513	39%	0.391	S	S	.	.	S	Bend	trans	-138.4	160	-178.3	-52.2	-73.4	0	0	0	110.4	F191 F223	F179-F191 WeakPolarHBondContact O-CE2 3.35Å; F179-F223 HydrophobicContact CB-CD1 3.83Å; F179-F223 HydrophobicContact CB-CE1 4.21Å; F179-F223 HydrophobicContact CD2-CD1 4.47Å; F179-F223 HydrophobicContact CD2-CG 4.5Å
180	D	92.4	Very high	83	Confident	103 Å²	103	70.2 Å²	70.2	55%	0.551	38%	0.384	S	S	*	.			trans	-68.3	138.4	169.6	-64.1	-11.5	0	0	0	109.5	K192 K193	D180-K192 WeakPolarHBondContact OD1-CA 3.44Å; D180-K193 WeakPolarHBondContact OD1-CB 3.24Å; D180-K193 PolarHBondContact OD1-N 2.93Å
181	F	91.7	Very high	85.1	Confident	26 Å²	26	64.3 Å²	64.3	11%	0.114	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-134.5	121.8	175.5	-178.6	-110	0	0	0	109.6	E188 L189 S190 F191 W207 F219 P220 F223	F181-E188 HydrophobicContact CE1-CB 4.3Å; F181-L189 WeakPolarHBondContact CD1-O 3.49Å; F181-L189 VanDerWaalsContact CE1-O 3.27Å; F181-L189 WeakPolarHBondContact CE1-O 3.41Å; F181-S190 CarbonylContact O-C 3.45Å; F181-S190 VanDerWaalsContact O-CA 3.29Å; F181-S190 WeakPolarHBondContact O-CA 3.18Å; F181-F191 HydrophobicContact CB-CD1 4.35Å; F181-F191 HydrophobicContact CB-CD2 4.13Å; F181-F191 HydrophobicContact CB-CE1 3.85Å; F181-F191 HydrophobicContact CB-CE2 3.61Å; F181-F191 HydrophobicContact CB-CG 4.49Å; F181-F191 HydrophobicContact CB-CZ 3.47Å; F181-F191 VanDerWaalsContact CB-CZ 3.47Å; F181-F191 HydrophobicContact CD1-CD1 4.32Å; F181-F191 AromaticContact CD1-CE1 3.69Å; F181-F191 HydrophobicContact CD1-CE1 3.69Å; F181-F191 HydrophobicContact CD1-CZ 4.03Å; F181-F191 HydrophobicContact CG-CE1 4.16Å; F181-F191 HydrophobicContact CG-CZ 4.04Å; F181-F191 PolarHBondContact N-O 3.09Å; F181-F191 PolarHBondContact O-N 2.7Å; F181-F191 VanDerWaalsContact O-O 3.11Å; F181-W207 HydrophobicContact CZ-CH2 4.24Å; F181-W207 HydrophobicContact CZ-CZ3 4.27Å; F181-F219 HydrophobicContact CD1-CB 4.07Å; F181-F219 HydrophobicContact CE1-CB 4.03Å; F181-P220 HydrophobicContact CD2-CG 3.98Å; F181-P220 HydrophobicContact CE2-CG 3.81Å; F181-P220 HydrophobicContact CZ-CG 4.23Å; F181-F223 HydrophobicContact CB-CD1 3.97Å; F181-F223 HydrophobicContact CD2-CD1 4.1Å; F181-F223 HydrophobicContact CD2-CE1 4.14Å; F181-F223 HydrophobicContact CG-CD1 4.4Å
182	S	90.8	Very high	86.8	Confident	100 Å²	100	69.3 Å²	69.3	70%	0.699	37%	0.367	S	S	*	.			trans	-107.2	108.1	176.8	-62.7	0	0	0	0	108.6	T184	S182-T184 PolarHBondContact O-N 3.34Å
183	G	84	Confident	88.1	Confident	22 Å²	22	74.5 Å²	74.5	23%	0.227	38%	0.383	C	S	.	.			trans	-63.4	129.1	178	0	0	0	0	0	110.9	E188 S190	G183-E188 VanDerWaalsContact CA-CB 3.47Å; G183-E188 WeakPolarHBondContact CA-OE2 3.4Å; G183-S190 PolarHBondContact N-OG 2.88Å
184	T	77.5	Confident	88.3	Confident	111 Å²	111	75.3 Å²	75.3	68%	0.681	40%	0.396	S	S	*	.	S	Bend	trans	-79.5	-28.7	-179.6	55.8	0	0	0	0	112.2	S182 E188	S182-T184 PolarHBondContact O-N 3.34Å; T184-E188 PolarHBondContact N-OE2 3.07Å; T184-E188 PolarHBondContact OG1-OE1 3.41Å; T184-E188 PolarHBondContact OG1-OE2 2.81Å
185	N	76.9	Confident	88.3	Confident	104 Å²	104	74.7 Å²	74.7	56%	0.556	40%	0.396	S	S	*	.	S	Bend	trans	-122.6	160.6	-176	-70.7	-28.5	0	0	0	111.9	L187 E188	N185-L187 PolarHBondContact O-N 3.3Å; N185-E188 PolarHBondContact O-N 3.06Å
186	K	76.3	Confident	88.2	Confident	222 Å²	222	77.9 Å²	77.9	97%	0.965	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-10.8	178.4	-65.7	-177.5	179.5	178.2	0	114.9
187	L	76.5	Confident	88	Confident	132 Å²	132	74.1 Å²	74.1	69%	0.691	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-20.9	176.9	-73	159	0	0	0	112.3	N185 G217 I218	N185-L187 PolarHBondContact O-N 3.3Å; L187-G217 CarbonylContact O-C 3.45Å; L187-G217 WeakPolarHBondContact O-CA 3.37Å; L187-I218 PolarHBondContact O-N 3.42Å
188	E	83.9	Confident	87.7	Confident	39 Å²	39	77.1 Å²	77.1	18%	0.182	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-91.2	134.8	-175.1	-69.5	173	-163	0	0	111	F181 G183 T184 N185 W207 I218	F181-E188 HydrophobicContact CE1-CB 4.3Å; G183-E188 VanDerWaalsContact CA-CB 3.47Å; G183-E188 WeakPolarHBondContact CA-OE2 3.4Å; T184-E188 PolarHBondContact N-OE2 3.07Å; T184-E188 PolarHBondContact OG1-OE1 3.41Å; T184-E188 PolarHBondContact OG1-OE2 2.81Å; N185-E188 PolarHBondContact O-N 3.06Å; E188-W207 HydrophobicContact CG-CH2 4.46Å; E188-W207 HydrophobicContact CG-CZ3 4.18Å; E188-I218 CarbonylContact C-O 3.5Å; E188-I218 VanDerWaalsContact CA-O 3.28Å; E188-I218 WeakPolarHBondContact CA-O 3.49Å; E188-I218 HydrophobicContact CG-CG1 4.02Å
189	L	86.2	Confident	87.3	Confident	2 Å²	2	74.4 Å²	74.4	1%	0.01	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-79.4	128.9	177	-176.3	66.6	0	0	0	109.2	F181 F191 I197 A212 A215 I218 F219	F181-L189 WeakPolarHBondContact CD1-O 3.49Å; F181-L189 VanDerWaalsContact CE1-O 3.27Å; F181-L189 WeakPolarHBondContact CE1-O 3.41Å; L189-F191 HydrophobicContact CB-CD1 4.5Å; L189-F191 HydrophobicContact CD2-CD1 4.08Å; L189-F191 HydrophobicContact CG-CD1 4.07Å; L189-I197 HydrophobicContact CD2-CD1 4.48Å; L189-I197 HydrophobicContact CD2-CG2 3.89Å; L189-A212 HydrophobicContact CD2-CB 4.03Å; L189-A215 HydrophobicContact CD1-CB 3.76Å; L189-A215 VanDerWaalsContact CD1-O 3.23Å; L189-A215 WeakPolarHBondContact CD1-O 3.46Å; L189-I218 PolarHBondContact N-O 3.09Å; L189-F219 HydrophobicContact CB-CD1 4.22Å; L189-F219 HydrophobicContact CD2-CD1 3.87Å; L189-F219 HydrophobicContact CD2-CE1 4.15Å
190	S	89.9	Confident	86.4	Confident	67 Å²	67	73.1 Å²	73.1	47%	0.469	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-96.2	134.5	170.2	-58.6	0	0	0	0	110.6	F181 G183	F181-S190 CarbonylContact O-C 3.45Å; F181-S190 VanDerWaalsContact O-CA 3.29Å; F181-S190 WeakPolarHBondContact O-CA 3.18Å; G183-S190 PolarHBondContact N-OG 2.88Å
191	F	92.4	Very high	85.5	Confident	10 Å²	10	70.2 Å²	70.2	4%	0.044	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-152.8	162.6	179.2	55.1	-97.7	0	0	0	111.4	A177 F179 F181 L189 D195 I197 F219 F223 V224	A177-F191 HydrophobicContact CB-CD2 3.38Å; A177-F191 HydrophobicContact CB-CE2 3.6Å; A177-F191 HydrophobicContact CB-CG 4.43Å; F179-F191 WeakPolarHBondContact O-CE2 3.35Å; F181-F191 HydrophobicContact CB-CD1 4.35Å; F181-F191 HydrophobicContact CB-CD2 4.13Å; F181-F191 HydrophobicContact CB-CE1 3.85Å; F181-F191 HydrophobicContact CB-CE2 3.61Å; F181-F191 HydrophobicContact CB-CG 4.49Å; F181-F191 HydrophobicContact CB-CZ 3.47Å; F181-F191 VanDerWaalsContact CB-CZ 3.47Å; F181-F191 HydrophobicContact CD1-CD1 4.32Å; F181-F191 AromaticContact CD1-CE1 3.69Å; F181-F191 HydrophobicContact CD1-CE1 3.69Å; F181-F191 HydrophobicContact CD1-CZ 4.03Å; F181-F191 HydrophobicContact CG-CE1 4.16Å; F181-F191 HydrophobicContact CG-CZ 4.04Å; F181-F191 PolarHBondContact N-O 3.09Å; F181-F191 PolarHBondContact O-N 2.7Å; F181-F191 VanDerWaalsContact O-O 3.11Å; L189-F191 HydrophobicContact CB-CD1 4.5Å; L189-F191 HydrophobicContact CD2-CD1 4.08Å; L189-F191 HydrophobicContact CG-CD1 4.07Å; F191-D195 HydrophobicContact CB-CB 4.16Å; F191-D195 WeakPolarHBondContact CB-OD2 3.49Å; F191-I197 HydrophobicContact CB-CD1 4.35Å; F191-I197 HydrophobicContact CD1-CD1 3.54Å; F191-I197 HydrophobicContact CD2-CD1 3.95Å; F191-I197 HydrophobicContact CE1-CD1 3.65Å; F191-I197 HydrophobicContact CE2-CD1 4.05Å; F191-I197 HydrophobicContact CG-CD1 3.68Å; F191-I197 HydrophobicContact CZ-CD1 3.9Å; F191-F219 HydrophobicContact CE1-CB 3.46Å; F191-F219 VanDerWaalsContact CE1-CB 3.46Å; F191-F219 HydrophobicContact CE1-CD1 4.27Å; F191-F219 HydrophobicContact CE1-CD2 4.03Å; F191-F219 AromaticContact CE1-CG 3.67Å; F191-F219 HydrophobicContact CE1-CG 3.67Å; F191-F219 HydrophobicContact CZ-CB 4.05Å; F191-F219 HydrophobicContact CZ-CD2 4.14Å; F191-F219 HydrophobicContact CZ-CG 4.21Å; F191-F223 HydrophobicContact CE2-CB 4.45Å; F191-F223 HydrophobicContact CZ-CB 4.23Å; F191-V224 HydrophobicContact CE2-CG1 4.27Å; F191-V224 HydrophobicContact CZ-CG1 4.01Å
192	K	93.9	Very high	84.9	Confident	146 Å²	146	73.9 Å²	73.9	64%	0.635	39%	0.391	S	S	*	.			trans	-105.3	156.8	175.7	-66.4	-172	176.4	-174.5	0	111.1	A177 D180 G194 D195	A177-K192 WeakPolarHBondContact CB-O 3.43Å; D180-K192 WeakPolarHBondContact OD1-CA 3.44Å; K192-G194 PolarHBondContact O-N 3.42Å; K192-D195 PolarHBondContact N-OD2 3.26Å; K192-D195 WeakPolarHBondContact O-CB 3.48Å; K192-D195 PolarHBondContact O-N 3.24Å
193	K	93.6	Very high	83.9	Confident	144 Å²	144	72.7 Å²	72.7	63%	0.626	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	132.3	171.7	177.2	176.9	-178.3	-177.2	0	110.2	L178 D180 D195	L178-K193 VanDerWaalsContact O-CD 3.28Å; L178-K193 WeakPolarHBondContact O-CD 3.38Å; L178-K193 WeakPolarHBondContact O-CE 3.3Å; L178-K193 VanDerWaalsContact O-CG 3.32Å; L178-K193 WeakPolarHBondContact O-CG 3.37Å; D180-K193 WeakPolarHBondContact OD1-CB 3.24Å; D180-K193 PolarHBondContact OD1-N 2.93Å; K193-D195 VanDerWaalsContact C-N 3.34Å
194	G	90.8	Very high	83.1	Confident	44 Å²	44	75.2 Å²	75.2	45%	0.454	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	-7.3	-176.1	0	0	0	0	0	114.2	A177 K192	A177-G194 PolarHBondContact O-N 3.18Å; K192-G194 PolarHBondContact O-N 3.42Å
195	D	90.7	Very high	82.8	Confident	32 Å²	32	78.3 Å²	78.3	17%	0.171	39%	0.392	C	S	.	.			trans	-66.5	136.9	176.7	-73.5	-7.7	0	0	0	111.4	E176 A177 F191 K192 K193 H213	E176-D195 WeakPolarHBondContact CA-O 3.42Å; A177-D195 HydrophobicContact CB-CB 4.24Å; A177-D195 PolarHBondContact N-O 3.22Å; F191-D195 HydrophobicContact CB-CB 4.16Å; F191-D195 WeakPolarHBondContact CB-OD2 3.49Å; K192-D195 PolarHBondContact N-OD2 3.26Å; K192-D195 WeakPolarHBondContact O-CB 3.48Å; K192-D195 PolarHBondContact O-N 3.24Å; K193-D195 VanDerWaalsContact C-N 3.34Å; D195-H213 IonicContact OD1-CE1 3.44Å; D195-H213 PolarHBondContact OD1-CE1 2.95Å; D195-H213 IonicContact OD2-CE1 3.22Å; D195-H213 PolarHBondContact OD2-CE1 2.84Å; D195-H213 IonicContact OD2-ND1 3.53Å
196	L	89.6	Confident	83	Confident	67 Å²	67	78.2 Å²	78.2	35%	0.351	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.4	173	-167.3	76.5	0	0	0	109.9	R174 I227	R174-L196 HydrophobicContact CG-CD1 4.43Å; L196-I227 HydrophobicContact CD1-CD1 3.68Å
197	I	90.6	Very high	83.4	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123.6	-177.8	-48.8	180	0	0	0	108.9	R174 A175 A177 L189 F191 A212 F219 V224	R174-I197 CarbonylContact C-O 3.58Å; R174-I197 WeakPolarHBondContact CA-O 3.21Å; R174-I197 WeakPolarHBondContact CB-O 3.11Å; A175-I197 PolarHBondContact N-O 2.89Å; A175-I197 PolarHBondContact O-N 3.45Å; A177-I197 HydrophobicContact CB-CD1 4.48Å; L189-I197 HydrophobicContact CD2-CD1 4.48Å; L189-I197 HydrophobicContact CD2-CG2 3.89Å; F191-I197 HydrophobicContact CB-CD1 4.35Å; F191-I197 HydrophobicContact CD1-CD1 3.54Å; F191-I197 HydrophobicContact CD2-CD1 3.95Å; F191-I197 HydrophobicContact CE1-CD1 3.65Å; F191-I197 HydrophobicContact CE2-CD1 4.05Å; F191-I197 HydrophobicContact CG-CD1 3.68Å; F191-I197 HydrophobicContact CZ-CD1 3.9Å; I197-A212 HydrophobicContact CG1-CB 4.14Å; I197-A212 HydrophobicContact CG2-CB 4.45Å; I197-F219 HydrophobicContact CB-CZ 4.46Å; I197-F219 HydrophobicContact CD1-CE1 4.44Å; I197-F219 HydrophobicContact CD1-CE2 4.35Å; I197-F219 HydrophobicContact CD1-CZ 4.26Å; I197-F219 HydrophobicContact CG2-CD1 4.5Å; I197-F219 HydrophobicContact CG2-CE1 3.59Å; I197-F219 HydrophobicContact CG2-CZ 3.73Å; I197-V224 HydrophobicContact CD1-CG1 3.87Å
198	Y	88.5	Confident	83.7	Confident	64 Å²	64	64.8 Å²	64.8	25%	0.251	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	120.8	172.8	-68.2	-80.5	0	0	0	109.5	A172 R174 G210 T211	A172-Y198 HydrophobicContact CB-CD1 4.17Å; A172-Y198 HydrophobicContact CB-CE1 4.49Å; R174-Y198 HydrophobicContact CB-CD1 4.27Å; Y198-G210 CarbonylContact O-C 3.55Å; Y198-G210 WeakPolarHBondContact O-CA 3.14Å; Y198-T211 PolarHBondContact N-O 3.33Å; Y198-T211 PolarHBondContact O-N 3.38Å
199	L	83.8	Confident	83.6	Confident	10 Å²	10	66.1 Å²	66.1	5%	0.052	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	130.4	-178.3	-55.3	178.7	0	0	0	109.3	P173 A175 L208 F219 I226 L230	P173-L199 HydrophobicContact CB-CB 3.89Å; P173-L199 PolarHBondContact O-N 3.21Å; A175-L199 HydrophobicContact CB-CD1 4.36Å; A175-L199 HydrophobicContact CB-CD2 3.87Å; A175-L199 HydrophobicContact CB-CG 4.29Å; L199-L208 HydrophobicContact CD2-CD1 4.12Å; L199-F219 HydrophobicContact CD2-CZ 3.73Å; L199-I226 HydrophobicContact CD1-CG2 4.32Å; L199-L230 HydrophobicContact CB-CD1 4.43Å; L199-L230 HydrophobicContact CB-CD2 3.77Å; L199-L230 HydrophobicContact CB-CG 3.87Å; L199-L230 HydrophobicContact CD1-CG 4.35Å
200	L	75.1	Confident	83.5	Confident	91 Å²	91	66 Å²	66	48%	0.476	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-47.1	178	-64.9	-177.9	0	0	0	111.9	E209 T211 T216	L200-E209 HydrophobicContact CB-CG 4.48Å; L200-E209 PolarHBondContact N-O 3.27Å; L200-T211 WeakPolarHBondContact CD1-OG1 3.17Å; L200-T216 HydrophobicContact CD1-CG2 3.54Å
201	S	72.5	Confident	83.4	Confident	42 Å²	42	64.4 Å²	64.4	29%	0.294	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	164.1	-177.2	83.6	0	0	0	0	111.7	E209	S201-E209 PolarHBondContact N-O 2.9Å; S201-E209 PolarHBondContact O-N 2.93Å; S201-E209 WeakPolarHBondContact OG-CB 3.47Å; S201-E209 PolarHBondContact OG-OE2 3.48Å
202	R	78.7	Confident	83	Confident	102 Å²	102	64.2 Å²	64.2	39%	0.385	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.7	172.7	-178.1	172.6	-67.4	-91.3	5	108	N204 L208 D229 L230	R202-N204 WeakPolarHBondContact CG-O 3.45Å; R202-L208 HydrophobicContact CB-CD2 3.92Å; R202-L208 HydrophobicContact CG-CD2 3.93Å; R202-D229 IonicContact NH2-OD1 2.68Å; R202-L230 HydrophobicContact CB-CD1 3.97Å
203	V	70.4	Confident	82.5	Confident	75 Å²	75	64.1 Å²	64.1	46%	0.455	32%	0.321	S	S	.	.			trans	-79.7	-46.8	-178.3	-178.9	0	0	0	0	109.9	W207 E209 I218	V203-W207 HydrophobicContact CB-CB 4.04Å; V203-W207 PolarHBondContact N-O 3.12Å; V203-E209 HydrophobicContact CG2-CB 4.27Å; V203-I218 HydrophobicContact CG2-CB 4.45Å; V203-I218 HydrophobicContact CG2-CG2 3.72Å
204	N	67.6	Low	81.7	Confident	76 Å²	76	63.2 Å²	63.2	41%	0.406	33%	0.332	S	S	.	.	S	Bend	trans	-158.9	-163.2	173.6	60.6	30	0	0	0	109.7	R202 D206 W207	R202-N204 WeakPolarHBondContact CG-O 3.45Å; N204-D206 VanDerWaalsContact C-N 3.26Å; N204-D206 PolarHBondContact O-N 2.92Å; N204-D206 PolarHBondContact OD1-N 3.27Å; N204-W207 PolarHBondContact N-O 3.02Å; N204-W207 WeakPolarHBondContact OD1-CB 3.48Å; N204-W207 PolarHBondContact OD1-N 3.17Å
205	K	71.3	Confident	81.1	Confident	176 Å²	176	63.5 Å²	63.5	77%	0.765	33%	0.33	S	S	*	.	S	Bend	trans	-60.3	-36.3	179.4	-170.8	179.2	177	-175.3	0	112.6
206	D	81.8	Confident	80.7	Confident	102 Å²	102	65.6 Å²	65.6	55%	0.545	34%	0.344	S	S	.	.	S	Bend	trans	-104.3	-14.4	-168.6	-54	-46.9	0	0	0	113.5	N204 P220 C221	N204-D206 VanDerWaalsContact C-N 3.26Å; N204-D206 PolarHBondContact O-N 2.92Å; N204-D206 PolarHBondContact OD1-N 3.27Å; D206-P220 CarbonylContact O-C 3.42Å; D206-P220 WeakPolarHBondContact O-CA 3.43Å; D206-C221 PolarHBondContact O-N 3.22Å
207	W	84.1	Confident	80.3	Confident	72 Å²	72	62.6 Å²	62.6	27%	0.273	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	134.8	-175.2	-70.1	79.5	0	0	0	113.1	F181 E188 V203 N204 I218 F219	F181-W207 HydrophobicContact CZ-CH2 4.24Å; F181-W207 HydrophobicContact CZ-CZ3 4.27Å; E188-W207 HydrophobicContact CG-CH2 4.46Å; E188-W207 HydrophobicContact CG-CZ3 4.18Å; V203-W207 HydrophobicContact CB-CB 4.04Å; V203-W207 PolarHBondContact N-O 3.12Å; N204-W207 PolarHBondContact N-O 3.02Å; N204-W207 WeakPolarHBondContact OD1-CB 3.48Å; N204-W207 PolarHBondContact OD1-N 3.17Å; W207-I218 HydrophobicContact CE3-CB 4.04Å; W207-I218 HydrophobicContact CE3-CD1 3.84Å; W207-I218 HydrophobicContact CE3-CG1 3.8Å; W207-I218 HydrophobicContact CZ3-CD1 4.05Å; W207-I218 HydrophobicContact CZ3-CG1 3.89Å; W207-F219 WeakPolarHBondContact CA-O 2.95Å; W207-F219 VanDerWaalsContact CE3-C 3.42Å
208	L	82.3	Confident	80	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	151.8	174.9	-69.8	171.5	0	0	0	110	L199 R202 I218 F219 C221 V224 I226 L230	L199-L208 HydrophobicContact CD2-CD1 4.12Å; R202-L208 HydrophobicContact CB-CD2 3.92Å; R202-L208 HydrophobicContact CG-CD2 3.93Å; L208-I218 CarbonylContact O-C 3.12Å; L208-I218 VanDerWaalsContact O-CA 3.22Å; L208-I218 WeakPolarHBondContact O-CA 3.32Å; L208-F219 HydrophobicContact CB-CD2 4.38Å; L208-F219 HydrophobicContact CB-CE1 4.3Å; L208-F219 HydrophobicContact CB-CE2 3.79Å; L208-F219 HydrophobicContact CB-CZ 3.75Å; L208-F219 HydrophobicContact CD1-CE2 4.16Å; L208-F219 HydrophobicContact CD1-CZ 4.48Å; L208-F219 PolarHBondContact N-O 3.29Å; L208-F219 PolarHBondContact O-N 3.36Å; L208-C221 HydrophobicContact CD1-CB 4.11Å; L208-C221 HydrophobicContact CG-CB 4.23Å; L208-V224 HydrophobicContact CD1-CG2 4.23Å; L208-I226 HydrophobicContact CD1-CD1 4.43Å; L208-L230 HydrophobicContact CD2-CD1 4.2Å
209	E	83	Confident	79.9	Confident	66 Å²	66	61.8 Å²	61.8	31%	0.308	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.3	169.1	-172.5	-171.8	-165.2	0	0	109	L200 S201 V203 I218	L200-E209 HydrophobicContact CB-CG 4.48Å; L200-E209 PolarHBondContact N-O 3.27Å; S201-E209 PolarHBondContact N-O 2.9Å; S201-E209 PolarHBondContact O-N 2.93Å; S201-E209 WeakPolarHBondContact OG-CB 3.47Å; S201-E209 PolarHBondContact OG-OE2 3.48Å; V203-E209 HydrophobicContact CG2-CB 4.27Å; E209-I218 HydrophobicContact CB-CG2 4.28Å; E209-I218 HydrophobicContact CG-CG2 4.38Å
210	G	83.4	Confident	80.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	176.5	178.7	0	0	0	0	0	113.8	Y198 T216 G217	Y198-G210 CarbonylContact O-C 3.55Å; Y198-G210 WeakPolarHBondContact O-CA 3.14Å; G210-T216 WeakPolarHBondContact O-CA 3.47Å; G210-G217 PolarHBondContact N-O 3.28Å; G210-G217 PolarHBondContact O-N 2.9Å; G210-G217 VanDerWaalsContact O-N 3.09Å
211	T	86.6	Confident	80.8	Confident	34 Å²	34	59.2 Å²	59.2	21%	0.209	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.4	179.3	-56.6	0	0	0	0	110.3	Y198 L200 A215 T216	Y198-T211 PolarHBondContact N-O 3.33Å; Y198-T211 PolarHBondContact O-N 3.38Å; L200-T211 WeakPolarHBondContact CD1-OG1 3.17Å; T211-A215 CarbonylContact C-O 3.53Å; T211-A215 VanDerWaalsContact CA-O 3.24Å; T211-A215 WeakPolarHBondContact CA-O 3.48Å; T211-A215 WeakPolarHBondContact CG2-O 3.43Å; T211-T216 PolarHBondContact OG1-OG1 3.43Å
212	A	85.3	Confident	81.8	Confident	5 Å²	5	61 Å²	61	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	141	171.3	0	0	0	0	0	109.1	L189 I197 S214 A215	L189-A212 HydrophobicContact CD2-CB 4.03Å; I197-A212 HydrophobicContact CG1-CB 4.14Å; I197-A212 HydrophobicContact CG2-CB 4.45Å; A212-S214 PolarHBondContact O-N 3.3Å; A212-A215 PolarHBondContact N-O 3.37Å; A212-A215 PolarHBondContact O-N 2.76Å
213	H	82.4	Confident	82.4	Confident	145 Å²	145	59.5 Å²	59.5	67%	0.671	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	34.6	176.8	-57.9	104.7	0	0	0	115.2	D195 A215	D195-H213 IonicContact OD1-CE1 3.44Å; D195-H213 PolarHBondContact OD1-CE1 2.95Å; D195-H213 IonicContact OD2-CE1 3.22Å; D195-H213 PolarHBondContact OD2-CE1 2.84Å; D195-H213 IonicContact OD2-ND1 3.53Å; H213-A215 PolarHBondContact O-N 3.36Å
214	S	76.9	Confident	83.5	Confident	125 Å²	125	56.5 Å²	56.5	87%	0.874	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	6.8	-175.4	-49.1	0	0	0	0	115.6	A212	A212-S214 PolarHBondContact O-N 3.3Å
215	A	78.2	Confident	84.7	Confident	49 Å²	49	58.9 Å²	58.9	41%	0.405	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	142.2	167.7	0	0	0	0	0	109.9	L189 T211 A212 H213	L189-A215 HydrophobicContact CD1-CB 3.76Å; L189-A215 VanDerWaalsContact CD1-O 3.23Å; L189-A215 WeakPolarHBondContact CD1-O 3.46Å; T211-A215 CarbonylContact C-O 3.53Å; T211-A215 VanDerWaalsContact CA-O 3.24Å; T211-A215 WeakPolarHBondContact CA-O 3.48Å; T211-A215 WeakPolarHBondContact CG2-O 3.43Å; A212-A215 PolarHBondContact N-O 3.37Å; A212-A215 PolarHBondContact O-N 2.76Å; H213-A215 PolarHBondContact O-N 3.36Å
216	T	81.9	Confident	85.7	Confident	76 Å²	76	53.1 Å²	53.1	47%	0.466	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.3	177.5	-60.9	0	0	0	0	108.7	L200 G210 T211	L200-T216 HydrophobicContact CD1-CG2 3.54Å; G210-T216 WeakPolarHBondContact O-CA 3.47Å; T211-T216 PolarHBondContact OG1-OG1 3.43Å
217	G	81.9	Confident	86	Confident	5 Å²	5	52.1 Å²	52.1	5%	0.052	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	178.8	178	0	0	0	0	0	112	L187 G210	L187-G217 CarbonylContact O-C 3.45Å; L187-G217 WeakPolarHBondContact O-CA 3.37Å; G210-G217 PolarHBondContact N-O 3.28Å; G210-G217 PolarHBondContact O-N 2.9Å; G210-G217 VanDerWaalsContact O-N 3.09Å
218	I	83.8	Confident	85.9	Confident	46 Å²	46	52.9 Å²	52.9	24%	0.236	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	150.2	176.8	67.9	173.3	0	0	0	111	L187 E188 L189 V203 W207 L208 E209	L187-I218 PolarHBondContact O-N 3.42Å; E188-I218 CarbonylContact C-O 3.5Å; E188-I218 VanDerWaalsContact CA-O 3.28Å; E188-I218 WeakPolarHBondContact CA-O 3.49Å; E188-I218 HydrophobicContact CG-CG1 4.02Å; L189-I218 PolarHBondContact N-O 3.09Å; V203-I218 HydrophobicContact CG2-CB 4.45Å; V203-I218 HydrophobicContact CG2-CG2 3.72Å; W207-I218 HydrophobicContact CE3-CB 4.04Å; W207-I218 HydrophobicContact CE3-CD1 3.84Å; W207-I218 HydrophobicContact CE3-CG1 3.8Å; W207-I218 HydrophobicContact CZ3-CD1 4.05Å; W207-I218 HydrophobicContact CZ3-CG1 3.89Å; L208-I218 CarbonylContact O-C 3.12Å; L208-I218 VanDerWaalsContact O-CA 3.22Å; L208-I218 WeakPolarHBondContact O-CA 3.32Å; E209-I218 HydrophobicContact CB-CG2 4.28Å; E209-I218 HydrophobicContact CG-CG2 4.38Å
219	F	87.9	Confident	85.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	155.7	176.7	59.9	-90.6	0	0	0	111.9	F181 L189 F191 I197 L199 W207 L208 C221 V224	F181-F219 HydrophobicContact CD1-CB 4.07Å; F181-F219 HydrophobicContact CE1-CB 4.03Å; L189-F219 HydrophobicContact CB-CD1 4.22Å; L189-F219 HydrophobicContact CD2-CD1 3.87Å; L189-F219 HydrophobicContact CD2-CE1 4.15Å; F191-F219 HydrophobicContact CE1-CB 3.46Å; F191-F219 VanDerWaalsContact CE1-CB 3.46Å; F191-F219 HydrophobicContact CE1-CD1 4.27Å; F191-F219 HydrophobicContact CE1-CD2 4.03Å; F191-F219 AromaticContact CE1-CG 3.67Å; F191-F219 HydrophobicContact CE1-CG 3.67Å; F191-F219 HydrophobicContact CZ-CB 4.05Å; F191-F219 HydrophobicContact CZ-CD2 4.14Å; F191-F219 HydrophobicContact CZ-CG 4.21Å; I197-F219 HydrophobicContact CB-CZ 4.46Å; I197-F219 HydrophobicContact CD1-CE1 4.44Å; I197-F219 HydrophobicContact CD1-CE2 4.35Å; I197-F219 HydrophobicContact CD1-CZ 4.26Å; I197-F219 HydrophobicContact CG2-CD1 4.5Å; I197-F219 HydrophobicContact CG2-CE1 3.59Å; I197-F219 HydrophobicContact CG2-CZ 3.73Å; L199-F219 HydrophobicContact CD2-CZ 3.73Å; W207-F219 WeakPolarHBondContact CA-O 2.95Å; W207-F219 VanDerWaalsContact CE3-C 3.42Å; L208-F219 HydrophobicContact CB-CD2 4.38Å; L208-F219 HydrophobicContact CB-CE1 4.3Å; L208-F219 HydrophobicContact CB-CE2 3.79Å; L208-F219 HydrophobicContact CB-CZ 3.75Å; L208-F219 HydrophobicContact CD1-CE2 4.16Å; L208-F219 HydrophobicContact CD1-CZ 4.48Å; L208-F219 PolarHBondContact N-O 3.29Å; L208-F219 PolarHBondContact O-N 3.36Å; F219-C221 PolarHBondContact O-N 2.9Å; F219-V224 HydrophobicContact CD2-CG1 3.76Å; F219-V224 HydrophobicContact CD2-CG2 4.44Å; F219-V224 HydrophobicContact CE2-CB 4.27Å; F219-V224 HydrophobicContact CE2-CG1 3.52Å; F219-V224 HydrophobicContact CE2-CG2 3.74Å
220	P	89.3	Confident	85.6	Confident	17 Å²	17	54.1 Å²	54.1	11%	0.11	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	132.7	-178.9	24.9	-32.7	0	0	0	112	F181 D206 A222 F223	F181-P220 HydrophobicContact CD2-CG 3.98Å; F181-P220 HydrophobicContact CE2-CG 3.81Å; F181-P220 HydrophobicContact CZ-CG 4.23Å; D206-P220 CarbonylContact O-C 3.42Å; D206-P220 WeakPolarHBondContact O-CA 3.43Å; P220-A222 PolarHBondContact O-N 3.48Å; P220-F223 HydrophobicContact CB-CD2 3.95Å; P220-F223 HydrophobicContact CG-CB 4.08Å; P220-F223 HydrophobicContact CG-CD2 3.46Å; P220-F223 VanDerWaalsContact CG-CD2 3.46Å; P220-F223 HydrophobicContact CG-CE2 4.02Å; P220-F223 HydrophobicContact CG-CG 3.79Å; P220-F223 PolarHBondContact O-N 3.43Å; P220-F223 VanDerWaalsContact O-N 3.1Å
221	C	88.3	Confident	84.8	Confident	30 Å²	30	59.2 Å²	59.2	20%	0.203	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-59.2	-31.3	178.2	-172.3	0	0	0	0	112.1	D206 L208 F219 F223 V224	D206-C221 PolarHBondContact O-N 3.22Å; L208-C221 HydrophobicContact CD1-CB 4.11Å; L208-C221 HydrophobicContact CG-CB 4.23Å; F219-C221 PolarHBondContact O-N 2.9Å; C221-F223 PolarHBondContact O-N 3.42Å; C221-V224 WeakPolarHBondContact O-CG2 3.49Å; C221-V224 PolarHBondContact O-N 3.21Å
222	A	91.9	Very high	83.2	Confident	79 Å²	79	65.5 Å²	65.5	65%	0.653	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-65.8	-19.4	179.5	0	0	0	0	0	113.8	P220 V224	P220-A222 PolarHBondContact O-N 3.48Å; A222-V224 VanDerWaalsContact C-N 3.32Å
223	F	92.2	Very high	81.4	Confident	72 Å²	72	72.9 Å²	72.9	32%	0.316	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-89.5	-0.6	-176.7	-80.2	-121.6	0	0	0	113	L178 F179 F181 F191 P220 C221	L178-F223 PolarHBondContact N-O 3.16Å; F179-F223 HydrophobicContact CB-CD1 3.83Å; F179-F223 HydrophobicContact CB-CE1 4.21Å; F179-F223 HydrophobicContact CD2-CD1 4.47Å; F179-F223 HydrophobicContact CD2-CG 4.5Å; F181-F223 HydrophobicContact CB-CD1 3.97Å; F181-F223 HydrophobicContact CD2-CD1 4.1Å; F181-F223 HydrophobicContact CD2-CE1 4.14Å; F181-F223 HydrophobicContact CG-CD1 4.4Å; F191-F223 HydrophobicContact CE2-CB 4.45Å; F191-F223 HydrophobicContact CZ-CB 4.23Å; P220-F223 HydrophobicContact CB-CD2 3.95Å; P220-F223 HydrophobicContact CG-CB 4.08Å; P220-F223 HydrophobicContact CG-CD2 3.46Å; P220-F223 VanDerWaalsContact CG-CD2 3.46Å; P220-F223 HydrophobicContact CG-CE2 4.02Å; P220-F223 HydrophobicContact CG-CG 3.79Å; P220-F223 PolarHBondContact O-N 3.43Å; P220-F223 VanDerWaalsContact O-N 3.1Å; C221-F223 PolarHBondContact O-N 3.42Å
224	V	92.8	Very high	79.7	Confident	11 Å²	11	72.8 Å²	72.8	7%	0.067	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.4	-175.5	-54.7	0	0	0	0	111.8	A175 E176 F191 I197 L208 F219 C221 A222	A175-V224 HydrophobicContact CB-CB 3.9Å; A175-V224 HydrophobicContact CB-CG2 3.83Å; E176-V224 CarbonylContact O-C 3.59Å; E176-V224 VanDerWaalsContact O-CA 3.23Å; E176-V224 WeakPolarHBondContact O-CA 3.33Å; F191-V224 HydrophobicContact CE2-CG1 4.27Å; F191-V224 HydrophobicContact CZ-CG1 4.01Å; I197-V224 HydrophobicContact CD1-CG1 3.87Å; L208-V224 HydrophobicContact CD1-CG2 4.23Å; F219-V224 HydrophobicContact CD2-CG1 3.76Å; F219-V224 HydrophobicContact CD2-CG2 4.44Å; F219-V224 HydrophobicContact CE2-CB 4.27Å; F219-V224 HydrophobicContact CE2-CG1 3.52Å; F219-V224 HydrophobicContact CE2-CG2 3.74Å; C221-V224 WeakPolarHBondContact O-CG2 3.49Å; C221-V224 PolarHBondContact O-N 3.21Å; A222-V224 VanDerWaalsContact C-N 3.32Å
225	K	94.3	Very high	78.5	Confident	126 Å²	126	70.6 Å²	70.6	55%	0.548	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.1	167.4	-177.7	-179.4	179.1	-175.2	0	108.7	A175 E176 L178 I227	A175-K225 CarbonylContact C-O 3.46Å; A175-K225 VanDerWaalsContact CA-O 3.22Å; A175-K225 WeakPolarHBondContact CA-O 3.3Å; A175-K225 WeakPolarHBondContact CB-O 3.46Å; E176-K225 PolarHBondContact N-O 2.84Å; E176-K225 PolarHBondContact O-N 3.2Å; L178-K225 HydrophobicContact CD1-CB 4.09Å; L178-K225 HydrophobicContact CD2-CB 3.9Å; L178-K225 HydrophobicContact CG-CB 3.97Å; K225-I227 PolarHBondContact O-N 3.4Å
226	I	90.6	Very high	77.7	Confident	55 Å²	55	72.2 Å²	72.2	28%	0.282	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	118	176.7	-60.5	176.5	0	0	0	108.8	A175 L199 L208 D229	A175-I226 HydrophobicContact CB-CG1 4.48Å; L199-I226 HydrophobicContact CD1-CG2 4.32Å; L208-I226 HydrophobicContact CD1-CD1 4.43Å; I226-D229 VanDerWaalsContact CG2-CA 3.41Å; I226-D229 HydrophobicContact CG2-CB 3.73Å
227	I	88.7	Confident	77.4	Confident	81 Å²	81	70.3 Å²	70.3	42%	0.415	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-42.9	174.1	-65.5	165.3	0	0	0	109.5	R174 E176 L196 K225	R174-I227 HydrophobicContact CG-CB 4.05Å; R174-I227 HydrophobicContact CG-CG2 4.3Å; R174-I227 PolarHBondContact O-N 3.39Å; E176-I227 HydrophobicContact CB-CD1 3.81Å; E176-I227 HydrophobicContact CB-CG1 4.38Å; L196-I227 HydrophobicContact CD1-CD1 3.68Å; K225-I227 PolarHBondContact O-N 3.4Å
228	K	82.9	Confident	77.5	Confident	89 Å²	89	71 Å²	71	39%	0.387	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	114.1	174.5	-172.4	172.8	-171.6	177	0	107.9	A171 P173 R174	A171-K228 WeakPolarHBondContact O-CD 3.07Å; A171-K228 VanDerWaalsContact O-CE 3.27Å; A171-K228 WeakPolarHBondContact O-CE 3.15Å; A171-K228 PolarHBondContact O-NZ 3.45Å; P173-K228 CarbonylContact C-O 3.52Å; P173-K228 VanDerWaalsContact CA-O 3.26Å; P173-K228 WeakPolarHBondContact CA-O 3.49Å; R174-K228 HydrophobicContact CG-CB 4.37Å; R174-K228 PolarHBondContact N-O 3.36Å; R174-K228 PolarHBondContact O-N 2.99Å
229	D	82.6	Confident	77.7	Confident	67 Å²	67	72.4 Å²	72.4	36%	0.358	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-67.8	161.3	-176.4	-150.8	-11.9	0	0	0	111.1	P173 R202 I226	P173-D229 WeakPolarHBondContact CB-O 3.48Å; R202-D229 IonicContact NH2-OD1 2.68Å; I226-D229 VanDerWaalsContact CG2-CA 3.41Å; I226-D229 HydrophobicContact CG2-CB 3.73Å
230	L	76.1	Confident	77.7	Confident	24 Å²	24	72.4 Å²	72.4	13%	0.126	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-54.1	143.2	163.9	-69.9	162.7	0	0	0	107.9	P173 L199 R202 L208 Q232	P173-L230 HydrophobicContact CB-CD2 3.97Å; P173-L230 HydrophobicContact CB-CG 4.38Å; P173-L230 HydrophobicContact CG-CD2 4.26Å; L199-L230 HydrophobicContact CB-CD1 4.43Å; L199-L230 HydrophobicContact CB-CD2 3.77Å; L199-L230 HydrophobicContact CB-CG 3.87Å; L199-L230 HydrophobicContact CD1-CG 4.35Å; R202-L230 HydrophobicContact CB-CD1 3.97Å; L208-L230 HydrophobicContact CD2-CD1 4.2Å; L230-Q232 PolarHBondContact O-N 3.35Å
231	P	67.2	Low	77.7	Confident	107 Å²	107	73.4 Å²	73.4	70%	0.695	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-51.5	119.6	170.8	23.1	-31.8	0	0	0	106.5	Q233	P231-Q233 PolarHBondContact O-N 2.89Å
232	Q	52.3	Low	77.8	Confident	166 Å²	166	72 Å²	72	78%	0.776	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-47.9	125.8	174.9	-89	178.1	5.2	0	0	105.5	L230 E234	L230-Q232 PolarHBondContact O-N 3.35Å; Q232-E234 PolarHBondContact O-N 2.89Å
233	Q	47.3	Very low	77.6	Confident	161 Å²	161	70.6 Å²	70.6	75%	0.752	35%	0.346	S	S	*	.			trans	-61.1	94.9	167.9	-171	168.8	-6.3	0	0	103.4	P231 D235	P231-Q233 PolarHBondContact O-N 2.89Å; Q233-D235 VanDerWaalsContact C-N 3.33Å; Q233-D235 PolarHBondContact O-N 2.8Å
234	E	46.5	Very low	77.3	Confident	143 Å²	143	68.2 Å²	68.2	67%	0.668	34%	0.335	S	S	*	.			trans	-56.7	109.6	174.1	-75.9	-175.5	159.8	0	0	104	Q232 T236	Q232-E234 PolarHBondContact O-N 2.89Å; E234-T236 PolarHBondContact O-N 3.42Å
235	D	51.7	Low	77	Confident	79 Å²	79	69.1 Å²	69.1	42%	0.422	34%	0.338	S	S	.	.			trans	-64	89.2	169.7	-79.5	-26.4	0	0	0	105.1	Q233 V237 R239 H318	Q233-D235 VanDerWaalsContact C-N 3.33Å; Q233-D235 PolarHBondContact O-N 2.8Å; D235-V237 PolarHBondContact O-N 3.45Å; D235-R239 IonicContact OD2-CZ 2.83Å; D235-R239 IonicContact OD2-NH2 3.65Å; D235-R239 PolarHBondContact OD2-NH2 2.93Å; D235-H318 PolarHBondContact O-CD2 3.4Å; D235-H318 VanDerWaalsContact O-CG 3.31Å
236	T	61.3	Low	76.1	Confident	83 Å²	83	68.1 Å²	68.1	51%	0.509	34%	0.336	S	S	.	.			trans	-66	0.5	176.9	60.9	0	0	0	0	112	E234	E234-T236 PolarHBondContact O-N 3.42Å
237	V	74.9	Confident	75.2	Confident	36 Å²	36	74.9 Å²	74.9	22%	0.218	37%	0.366	C	S	.	.	S	Bend	trans	-96.1	120	-176.8	-172.9	0	0	0	0	108.4	D235 L256 E258	D235-V237 PolarHBondContact O-N 3.45Å; V237-L256 HydrophobicContact CG1-CB 4.03Å; V237-E258 HydrophobicContact CG1-CG 3.92Å; V237-E258 HydrophobicContact CG2-CG 4.41Å
238	N	85.6	Confident	73.9	Confident	19 Å²	19	77.3 Å²	77.3	10%	0.102	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	158.3	179.5	-63.7	-40.7	0	0	0	110.8	V257 E259 L261 H318 F320	N238-V257 PolarHBondContact N-O 3.09Å; N238-V257 PolarHBondContact O-N 3.09Å; N238-V257 VanDerWaalsContact O-O 3.1Å; N238-E259 PolarHBondContact ND2-O 2.97Å; N238-L261 HydrophobicContact CB-CD2 3.79Å; N238-L261 HydrophobicContact CB-CG 4.4Å; N238-H318 CarbonylContact C-O 3.47Å; N238-H318 VanDerWaalsContact CA-O 3.3Å; N238-H318 WeakPolarHBondContact CA-O 3.38Å; N238-H318 WeakPolarHBondContact OD1-CA 3.28Å; N238-H318 PolarHBondContact OD1-ND1 3.09Å; N238-F320 HydrophobicContact CB-CD2 4.42Å; N238-F320 HydrophobicContact CB-CE2 3.81Å; N238-F320 HydrophobicContact CB-CZ 4.37Å
239	R	87.1	Confident	73.4	Confident	75 Å²	75	76.9 Å²	76.9	28%	0.283	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.6	-173.8	-49	-170.6	-177.1	175.9	-1.4	111.5	D235 D254 I255 L256 H318 I319 F320	D235-R239 IonicContact OD2-CZ 2.83Å; D235-R239 IonicContact OD2-NH2 3.65Å; D235-R239 PolarHBondContact OD2-NH2 2.93Å; R239-D254 HydrophobicContact CB-CB 4.44Å; R239-I255 CarbonylContact C-O 3.56Å; R239-I255 VanDerWaalsContact CA-O 3.23Å; R239-I255 WeakPolarHBondContact CA-O 3.31Å; R239-L256 HydrophobicContact CG-CD2 3.77Å; R239-H318 PolarHBondContact N-O 3.22Å; R239-I319 HydrophobicContact CB-CG1 4.27Å; R239-I319 WeakPolarHBondContact O-CA 3.43Å; R239-F320 WeakPolarHBondContact O-CD2 3.46Å; R239-F320 PolarHBondContact O-N 3.42Å
240	V	88.7	Confident	73.1	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121.2	169.7	179.6	0	0	0	0	107.8	F35 D254 I255 V257 F320 W322 L324	F35-V240 HydrophobicContact CE1-CG2 3.79Å; V240-D254 WeakPolarHBondContact O-CA 3.41Å; V240-I255 PolarHBondContact N-O 3.43Å; V240-I255 PolarHBondContact O-N 3.43Å; V240-V257 HydrophobicContact CB-CG2 4.44Å; V240-V257 HydrophobicContact CG2-CB 4.39Å; V240-V257 HydrophobicContact CG2-CG2 3.66Å; V240-F320 HydrophobicContact CG2-CD2 3.54Å; V240-F320 HydrophobicContact CG2-CE2 3.93Å; V240-F320 HydrophobicContact CG2-CG 4.27Å; V240-W322 HydrophobicContact CG1-CH2 4.01Å; V240-W322 HydrophobicContact CG1-CZ3 3.67Å; V240-W322 HydrophobicContact CG2-CH2 3.91Å; V240-W322 HydrophobicContact CG2-CZ3 4.41Å; V240-L324 HydrophobicContact CG1-CD1 4.06Å; V240-L324 HydrophobicContact CG1-CG 4.47Å
241	R	89.4	Confident	73.4	Confident	38 Å²	38	78.6 Å²	78.6	14%	0.143	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	125.4	175.9	-179.6	162	-68	152.5	4.7	110.3	Y243 I252 D254 E316 K323 L324	R241-Y243 HydrophobicContact CG-CE2 4.06Å; R241-I252 HydrophobicContact CG-CG2 4.06Å; R241-D254 WeakPolarHBondContact CB-OD1 3.42Å; R241-D254 VanDerWaalsContact CG-OD1 3.31Å; R241-D254 WeakPolarHBondContact CG-OD1 3.3Å; R241-D254 IonicContact CZ-OD1 3.49Å; R241-D254 IonicContact CZ-OD2 3.61Å; R241-D254 IonicContact NE-OD1 3.26Å; R241-D254 PolarHBondContact NE-OD1 2.91Å; R241-D254 IonicContact NE-OD2 3Å; R241-D254 IonicContact NH2-OD1 3.7Å; R241-D254 IonicContact NH2-OD2 3.83Å; R241-D254 PolarHBondContact NH2-OD2 2.88Å; R241-E316 IonicContact CZ-OE2 3.87Å; R241-E316 IonicContact NH1-OE1 3.68Å; R241-E316 PolarHBondContact NH1-OE1 2.97Å; R241-E316 IonicContact NH1-OE2 3.32Å; R241-E316 PolarHBondContact NH1-OE2 3.13Å; R241-E316 IonicContact NH2-OE2 3.94Å; R241-K323 HydrophobicContact CB-CD 4.45Å; R241-K323 HydrophobicContact CB-CG 4.23Å; R241-K323 HydrophobicContact CG-CD 4.32Å; R241-K323 WeakPolarHBondContact O-CA 3.47Å; R241-L324 PolarHBondContact O-N 3.27Å
242	C	89.3	Confident	74.2	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.7	-179.2	-68.3	0	0	0	0	110.1	I252 R253 F278 L324 I326	C242-I252 WeakPolarHBondContact O-CA 3.33Å; C242-R253 WeakPolarHBondContact CB-O 3.49Å; C242-R253 PolarHBondContact N-O 3.21Å; C242-R253 PolarHBondContact O-N 3.1Å; C242-F278 HydrophobicContact CB-CE2 4.26Å; C242-F278 HydrophobicContact CB-CZ 4.04Å; C242-L324 CarbonylContact C-O 3.57Å; C242-L324 WeakPolarHBondContact CA-O 3.34Å; C242-I326 HydrophobicContact CB-CD1 3.51Å
243	Y	87.8	Confident	75.6	Confident	50 Å²	50	75.9 Å²	75.9	20%	0.196	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	116.6	168.6	-62.4	-88.2	0	0	0	107.9	R241 T251 I252 K323 L324 H325 I326	R241-Y243 HydrophobicContact CG-CE2 4.06Å; Y243-T251 CarbonylContact C-O 3.51Å; Y243-T251 WeakPolarHBondContact CA-O 3.48Å; Y243-I252 HydrophobicContact CD1-CD1 4.22Å; Y243-I252 HydrophobicContact CD1-CG1 3.72Å; Y243-I252 HydrophobicContact CE1-CD1 3.65Å; Y243-I252 HydrophobicContact CE1-CG1 3.66Å; Y243-I252 HydrophobicContact CE1-CG2 4.37Å; Y243-K323 HydrophobicContact CD2-CB 4.37Å; Y243-K323 HydrophobicContact CE2-CB 3.91Å; Y243-K323 HydrophobicContact CE2-CD 3.69Å; Y243-K323 HydrophobicContact CE2-CG 4.36Å; Y243-L324 PolarHBondContact N-O 3.43Å; Y243-H325 AromaticContact CD2-CE1 3.42Å; Y243-H325 VanDerWaalsContact CD2-CE1 3.42Å; Y243-H325 WeakPolarHBondContact CD2-CE1 3.32Å; Y243-H325 AromaticContact CD2-ND1 3.88Å; Y243-H325 AromaticContact CD2-NE2 3.72Å; Y243-H325 AromaticContact CG-CE1 3.75Å; Y243-H325 AromaticContact CG-ND1 3.94Å; Y243-H325 CarbonylContact O-C 3.53Å; Y243-H325 WeakPolarHBondContact O-CA 3.37Å; Y243-I326 WeakPolarHBondContact O-CD1 3.5Å; Y243-I326 PolarHBondContact O-N 3.09Å
244	Y	87.1	Confident	77.4	Confident	22 Å²	22	70.9 Å²	70.9	9%	0.086	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	118.3	175.5	-176	-102.8	0	0	0	108.7	E246 S250 T251 F278 Q280 I283 I326	Y244-E246 HydrophobicContact CD1-CG 3.67Å; Y244-E246 HydrophobicContact CE1-CG 3.32Å; Y244-E246 VanDerWaalsContact CE1-OE1 3.3Å; Y244-E246 WeakPolarHBondContact CE1-OE1 3.48Å; Y244-S250 CarbonylContact O-C 3.56Å; Y244-S250 VanDerWaalsContact O-CA 3.27Å; Y244-S250 WeakPolarHBondContact O-CA 3.39Å; Y244-T251 PolarHBondContact N-O 3.34Å; Y244-T251 PolarHBondContact O-N 2.99Å; Y244-F278 AromaticContact CD2-CD1 3.88Å; Y244-F278 HydrophobicContact CD2-CD1 3.88Å; Y244-F278 AromaticContact CD2-CE1 3.92Å; Y244-F278 HydrophobicContact CD2-CE1 3.92Å; Y244-F278 HydrophobicContact CE2-CD1 4.37Å; Y244-F278 HydrophobicContact CG-CD1 4.19Å; Y244-F278 AromaticContact CG-CE1 3.92Å; Y244-F278 HydrophobicContact CG-CE1 3.92Å; Y244-Q280 VanDerWaalsContact OH-CD 3.29Å; Y244-Q280 PolarHBondContact OH-NE2 3.41Å; Y244-Q280 VanDerWaalsContact OH-NE2 3.15Å; Y244-Q280 PolarHBondContact OH-OE1 3.4Å; Y244-I283 HydrophobicContact CE2-CG2 4.45Å; Y244-I326 HydrophobicContact CD2-CB 3.83Å; Y244-I326 HydrophobicContact CD2-CG2 3.61Å; Y244-I326 HydrophobicContact CE2-CG2 3.9Å
245	H	85	Confident	79.2	Confident	30 Å²	30	64.2 Å²	64.2	14%	0.139	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	109.8	-177.7	-62.5	-70	0	0	0	109.4	S250 H325 I326 T327	H245-S250 PolarHBondContact CE1-OG 3.05Å; H245-S250 PolarHBondContact ND1-OG 3.35Å; H245-H325 AromaticContact CE1-ND1 3.73Å; H245-H325 AromaticContact NE2-CE1 3.97Å; H245-H325 AromaticContact NE2-CG 3.7Å; H245-H325 AromaticContact NE2-ND1 2.9Å; H245-H325 PolarHBondContact NE2-ND1 3.34Å; H245-I326 PolarHBondContact N-O 2.95Å; H245-T327 HydrophobicContact CB-CG2 4.09Å
246	E	77.1	Confident	80.8	Confident	106 Å²	106	65.5 Å²	65.5	50%	0.495	34%	0.336	S	S	.	.			trans	-95.7	167.9	165.9	-64.6	176.8	-176.3	0	0	109.5	Y244 T248 V249	Y244-E246 HydrophobicContact CD1-CG 3.67Å; Y244-E246 HydrophobicContact CE1-CG 3.32Å; Y244-E246 VanDerWaalsContact CE1-OE1 3.3Å; Y244-E246 WeakPolarHBondContact CE1-OE1 3.48Å; E246-T248 PolarHBondContact O-N 2.94Å; E246-V249 WeakPolarHBondContact CB-O 3.38Å; E246-V249 PolarHBondContact N-O 2.92Å; E246-V249 PolarHBondContact O-N 3.49Å
247	E	69.8	Low	82	Confident	196 Å²	196	61.6 Å²	61.6	92%	0.916	31%	0.312	S	S	*	.	S	Bend	trans	-50.7	-24	-174.6	-63.5	-178.5	172.4	0	0	114.6
248	T	63.1	Low	82.5	Confident	132 Å²	132	63 Å²	63	81%	0.81	32%	0.316	S	S	*	.	S	Bend	trans	-133.7	-17.1	-177.6	57.6	0	0	0	0	115.4	E246	E246-T248 PolarHBondContact O-N 2.94Å
249	V	71.9	Confident	82.4	Confident	80 Å²	80	63 Å²	63	49%	0.485	32%	0.316	S	S	.	.			trans	-139.4	140	-174.2	-177.6	0	0	0	0	110.6	E246 T251	E246-V249 WeakPolarHBondContact CB-O 3.38Å; E246-V249 PolarHBondContact N-O 2.92Å; E246-V249 PolarHBondContact O-N 3.49Å; V249-T251 HydrophobicContact CG1-CG2 4.45Å
250	S	76.6	Confident	82.1	Confident	67 Å²	67	62.4 Å²	62.4	47%	0.469	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.7	170.5	-56.4	0	0	0	0	110	Y244 H245	Y244-S250 CarbonylContact O-C 3.56Å; Y244-S250 VanDerWaalsContact O-CA 3.27Å; Y244-S250 WeakPolarHBondContact O-CA 3.39Å; H245-S250 PolarHBondContact CE1-OG 3.05Å; H245-S250 PolarHBondContact ND1-OG 3.35Å
251	T	82.2	Confident	81.9	Confident	60 Å²	60	64.8 Å²	64.8	37%	0.368	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	145.7	176	63.6	0	0	0	0	110.7	Y243 Y244 V249	Y243-T251 CarbonylContact C-O 3.51Å; Y243-T251 WeakPolarHBondContact CA-O 3.48Å; Y244-T251 PolarHBondContact N-O 3.34Å; Y244-T251 PolarHBondContact O-N 2.99Å; V249-T251 HydrophobicContact CG1-CG2 4.45Å
252	I	83.6	Confident	81.5	Confident	110 Å²	110	66.5 Å²	66.5	56%	0.564	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.5	178.7	-52.4	179.2	0	0	0	108.4	R241 C242 Y243	R241-I252 HydrophobicContact CG-CG2 4.06Å; C242-I252 WeakPolarHBondContact O-CA 3.33Å; Y243-I252 HydrophobicContact CD1-CD1 4.22Å; Y243-I252 HydrophobicContact CD1-CG1 3.72Å; Y243-I252 HydrophobicContact CE1-CD1 3.65Å; Y243-I252 HydrophobicContact CE1-CG1 3.66Å; Y243-I252 HydrophobicContact CE1-CG2 4.37Å
253	R	82.1	Confident	81.2	Confident	107 Å²	107	67.7 Å²	67.7	40%	0.404	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	126	176.2	-168.4	167.1	179.9	-176.2	-10.2	110.4	C242 E277 F278	C242-R253 WeakPolarHBondContact CB-O 3.49Å; C242-R253 PolarHBondContact N-O 3.21Å; C242-R253 PolarHBondContact O-N 3.1Å; R253-E277 PolarHBondContact NH1-O 2.84Å; R253-E277 PolarHBondContact NH2-O 3.44Å; R253-E277 IonicContact NH2-OE2 2.69Å; R253-F278 HydrophobicContact CB-CZ 4.1Å
254	D	84.3	Confident	81.3	Confident	55 Å²	55	68.1 Å²	68.1	29%	0.294	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.7	175.1	-73.1	-7.9	0	0	0	108.9	R239 V240 R241	R239-D254 HydrophobicContact CB-CB 4.44Å; V240-D254 WeakPolarHBondContact O-CA 3.41Å; R241-D254 WeakPolarHBondContact CB-OD1 3.42Å; R241-D254 VanDerWaalsContact CG-OD1 3.31Å; R241-D254 WeakPolarHBondContact CG-OD1 3.3Å; R241-D254 IonicContact CZ-OD1 3.49Å; R241-D254 IonicContact CZ-OD2 3.61Å; R241-D254 IonicContact NE-OD1 3.26Å; R241-D254 PolarHBondContact NE-OD1 2.91Å; R241-D254 IonicContact NE-OD2 3Å; R241-D254 IonicContact NH2-OD1 3.7Å; R241-D254 IonicContact NH2-OD2 3.83Å; R241-D254 PolarHBondContact NH2-OD2 2.88Å
255	I	84.5	Confident	81.5	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.021	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.8	-179.3	-59.2	166.5	0	0	0	109.1	R239 V240 V257 L273 I274 E277 F278	R239-I255 CarbonylContact C-O 3.56Å; R239-I255 VanDerWaalsContact CA-O 3.23Å; R239-I255 WeakPolarHBondContact CA-O 3.31Å; V240-I255 PolarHBondContact N-O 3.43Å; V240-I255 PolarHBondContact O-N 3.43Å; I255-V257 HydrophobicContact CG2-CG2 4.32Å; I255-L273 HydrophobicContact CG2-CD1 4.07Å; I255-L273 HydrophobicContact CG2-CD2 4.29Å; I255-L273 HydrophobicContact CG2-CG 4.38Å; I255-I274 HydrophobicContact CD1-CD1 3.43Å; I255-I274 VanDerWaalsContact CD1-CD1 3.43Å; I255-E277 HydrophobicContact CD1-CB 4.02Å; I255-E277 HydrophobicContact CD1-CG 3.91Å; I255-E277 HydrophobicContact CG1-CB 4.39Å; I255-E277 HydrophobicContact CG1-CG 4.13Å; I255-E277 HydrophobicContact CG2-CG 3.86Å; I255-F278 HydrophobicContact CD1-CE2 4.16Å
256	L	85.5	Confident	81.8	Confident	106 Å²	106	69.5 Å²	69.5	56%	0.555	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	128.9	178.1	-57.5	-179.8	0	0	0	110.9	V237 R239	V237-L256 HydrophobicContact CG1-CB 4.03Å; R239-L256 HydrophobicContact CG-CD2 3.77Å
257	V	86.7	Confident	82.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	119.9	-177.9	-177.7	0	0	0	0	110.3	F35 N238 V240 I255 E259 L273 F320	F35-V257 HydrophobicContact CD1-CG1 4Å; F35-V257 HydrophobicContact CD1-CG2 4.47Å; F35-V257 HydrophobicContact CD2-CG1 4.37Å; F35-V257 HydrophobicContact CE1-CG1 3.94Å; F35-V257 HydrophobicContact CE1-CG2 4.45Å; F35-V257 HydrophobicContact CE2-CG1 4.33Å; F35-V257 HydrophobicContact CG-CG1 4.23Å; F35-V257 HydrophobicContact CZ-CG1 4.12Å; N238-V257 PolarHBondContact N-O 3.09Å; N238-V257 PolarHBondContact O-N 3.09Å; N238-V257 VanDerWaalsContact O-O 3.1Å; V240-V257 HydrophobicContact CB-CG2 4.44Å; V240-V257 HydrophobicContact CG2-CB 4.39Å; V240-V257 HydrophobicContact CG2-CG2 3.66Å; I255-V257 HydrophobicContact CG2-CG2 4.32Å; V257-E259 HydrophobicContact CG1-CB 3.85Å; V257-E259 HydrophobicContact CG1-CG 3.83Å; V257-E259 PolarHBondContact O-N 3.32Å; V257-L273 HydrophobicContact CG2-CD2 4.13Å; V257-F320 HydrophobicContact CB-CE2 4.22Å; V257-F320 HydrophobicContact CG1-CE2 4.38Å
258	E	85.1	Confident	83.7	Confident	67 Å²	67	63.5 Å²	63.5	31%	0.313	34%	0.341	S	S	.	.			trans	-84.1	61	175.2	-62.5	-178.3	159.4	0	0	111.3	K32 K33 Y38 V237	K32-E258 VanDerWaalsContact CA-OE2 3.24Å; K32-E258 WeakPolarHBondContact CA-OE2 3.47Å; K32-E258 HydrophobicContact CB-CB 4.4Å; K33-E258 PolarHBondContact N-OE2 2.75Å; K33-E258 PolarHBondContact O-N 3.34Å; Y38-E258 PolarHBondContact OH-O 3.35Å; V237-E258 HydrophobicContact CG1-CG 3.92Å; V237-E258 HydrophobicContact CG2-CG 4.41Å
259	E	84	Confident	85	Confident	19 Å²	19	58.7 Å²	58.7	9%	0.089	31%	0.31	C	S	.	.	S	Bend	trans	-133.7	155.2	174.6	-70.3	-84.1	-159.4	0	0	109.3	F35 Y38 R58 N238 V257 F320	F35-E259 HydrophobicContact CD2-CB 4.31Å; F35-E259 HydrophobicContact CD2-CG 3.74Å; F35-E259 HydrophobicContact CE2-CB 3.85Å; F35-E259 HydrophobicContact CE2-CG 3.8Å; F35-E259 HydrophobicContact CZ-CB 4.48Å; Y38-E259 VanDerWaalsContact CE1-CD 3.45Å; Y38-E259 HydrophobicContact CE1-CG 4.11Å; Y38-E259 WeakPolarHBondContact CE1-OE1 3.39Å; Y38-E259 PolarHBondContact OH-OE2 2.96Å; R58-E259 IonicContact NH1-OE1 2.76Å; R58-E259 PolarHBondContact NH1-OE1 3.32Å; R58-E259 IonicContact NH1-OE2 3.95Å; N238-E259 PolarHBondContact ND2-O 2.97Å; V257-E259 HydrophobicContact CG1-CB 3.85Å; V257-E259 HydrophobicContact CG1-CG 3.83Å; V257-E259 PolarHBondContact O-N 3.32Å; E259-F320 HydrophobicContact CB-CZ 4.32Å
260	D	80.1	Confident	86	Confident	61 Å²	61	54.9 Å²	54.9	33%	0.326	29%	0.287	S	S	.	.			trans	-67	146.5	177.3	179.6	70.2	0	0	0	111.7	S262 S263 F320	D260-S262 PolarHBondContact O-N 3.41Å; D260-S262 VanDerWaalsContact O-N 3.15Å; D260-S262 WeakPolarHBondContact OD2-CA 3.49Å; D260-S262 WeakPolarHBondContact OD2-CB 3.46Å; D260-S262 PolarHBondContact OD2-N 2.82Å; D260-S262 PolarHBondContact OD2-OG 3.44Å; D260-S263 PolarHBondContact N-OG 2.73Å; D260-S263 WeakPolarHBondContact O-CB 3.26Å; D260-S263 PolarHBondContact O-N 2.76Å; D260-S263 PolarHBondContact O-OG 2.74Å; D260-F320 WeakPolarHBondContact O-CE1 3.34Å
261	L	83.6	Confident	86.8	Confident	51 Å²	51	53 Å²	53	27%	0.267	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.1	-178.1	-71.1	174.8	0	0	0	113.8	N238 F320	N238-L261 HydrophobicContact CB-CD2 3.79Å; N238-L261 HydrophobicContact CB-CG 4.4Å; L261-F320 HydrophobicContact CD2-CD1 4.19Å; L261-F320 HydrophobicContact CD2-CD2 4.2Å; L261-F320 HydrophobicContact CD2-CE1 4.39Å; L261-F320 HydrophobicContact CD2-CE2 4.38Å; L261-F320 HydrophobicContact CD2-CG 4.09Å; L261-F320 HydrophobicContact CD2-CZ 4.47Å
262	S	81.8	Confident	87.1	Confident	73 Å²	73	54.3 Å²	54.3	51%	0.51	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6.8	175.3	76.1	0	0	0	0	113.7	D260	D260-S262 PolarHBondContact O-N 3.41Å; D260-S262 VanDerWaalsContact O-N 3.15Å; D260-S262 WeakPolarHBondContact OD2-CA 3.49Å; D260-S262 WeakPolarHBondContact OD2-CB 3.46Å; D260-S262 PolarHBondContact OD2-N 2.82Å; D260-S262 PolarHBondContact OD2-OG 3.44Å
263	S	84.1	Confident	87.5	Confident	25 Å²	25	49.1 Å²	49.1	18%	0.175	25%	0.247	C	C	.	.			trans	-64.5	137	-177.8	-57.1	0	0	0	0	111.7	D260	D260-S263 PolarHBondContact N-OG 2.73Å; D260-S263 WeakPolarHBondContact O-CB 3.26Å; D260-S263 PolarHBondContact O-N 2.76Å; D260-S263 PolarHBondContact O-OG 2.74Å
264	I	89.1	Confident	87.8	Confident	60 Å²	60	44 Å²	44	31%	0.308	23%	0.227	S	C	.	.			trans	-102.7	112.2	173.6	-55	171.6	0	0	0	107.4	V303 E304 V307	I264-V303 HydrophobicContact CG2-CG1 4.43Å; I264-E304 HydrophobicContact CD1-CG 4.47Å; I264-V307 HydrophobicContact CG1-CB 4.41Å; I264-V307 HydrophobicContact CG1-CG1 4.01Å; I264-V307 HydrophobicContact CG2-CG2 4.37Å
265	P	91.6	Very high	88.1	Confident	7 Å²	7	45.6 Å²	45.6	5%	0.045	23%	0.229	C	C	.	.			trans	-74.8	161.6	175.6	29.7	-32.3	0	0	0	111.7	F35 L270 V303 W322	F35-P265 HydrophobicContact CB-CB 4.4Å; F35-P265 HydrophobicContact CD1-CB 4.04Å; F35-P265 HydrophobicContact CD1-CG 4.47Å; F35-P265 HydrophobicContact CD2-CB 3.59Å; F35-P265 HydrophobicContact CD2-CG 4.45Å; F35-P265 HydrophobicContact CE1-CB 4.18Å; F35-P265 HydrophobicContact CE1-CG 4.18Å; F35-P265 HydrophobicContact CE2-CB 3.73Å; F35-P265 HydrophobicContact CE2-CG 4.14Å; F35-P265 HydrophobicContact CG-CB 3.74Å; F35-P265 HydrophobicContact CZ-CB 4.03Å; F35-P265 HydrophobicContact CZ-CG 4.01Å; P265-L270 HydrophobicContact CB-CD1 4.42Å; P265-L270 HydrophobicContact CB-CD2 3.94Å; P265-L270 HydrophobicContact CB-CG 3.87Å; P265-L270 HydrophobicContact CG-CD1 3.76Å; P265-L270 HydrophobicContact CG-CD2 3.73Å; P265-L270 HydrophobicContact CG-CG 3.71Å; P265-V303 HydrophobicContact CG-CG1 3.95Å; P265-V303 VanDerWaalsContact O-CG1 3.3Å; P265-V303 WeakPolarHBondContact O-CG1 3.49Å; P265-W322 HydrophobicContact CG-CH2 4.16Å; P265-W322 HydrophobicContact CG-CZ2 4.08Å
266	L	91.2	Very high	88.3	Confident	74 Å²	74	51.4 Å²	51.4	39%	0.387	25%	0.251	S	S	.	.			trans	-80.4	150.5	165.9	-60.6	174.2	0	0	0	109.8	K268 D269 L270 D300	L266-K268 VanDerWaalsContact C-N 3.26Å; L266-K268 PolarHBondContact O-N 3.09Å; L266-D269 HydrophobicContact CB-CB 4.27Å; L266-D269 WeakPolarHBondContact O-CB 3.18Å; L266-D269 PolarHBondContact O-N 3.33Å; L266-D269 VanDerWaalsContact O-N 3.07Å; L266-L270 PolarHBondContact O-N 3.28Å; L266-D300 WeakPolarHBondContact CA-OD1 3.4Å
267	F	93.4	Very high	88.4	Confident	42 Å²	42	49 Å²	49	18%	0.184	24%	0.237	C	C	.	.	H	α-helix	trans	-56.1	-44	176.4	171.8	-106.2	0	0	0	111.3	D269 L270 L271 L285 L297 D300 V303	F267-D269 VanDerWaalsContact C-N 3.32Å; F267-D269 PolarHBondContact O-N 2.9Å; F267-L270 PolarHBondContact O-N 2.87Å; F267-L271 HydrophobicContact CE1-CD2 4.32Å; F267-L271 HydrophobicContact CZ-CD2 4.44Å; F267-L271 WeakPolarHBondContact O-CB 3.49Å; F267-L271 PolarHBondContact O-N 3.27Å; F267-L285 HydrophobicContact CE2-CD1 4.38Å; F267-L297 HydrophobicContact CD2-CB 4.01Å; F267-L297 HydrophobicContact CE2-CB 3.86Å; F267-L297 WeakPolarHBondContact CE2-O 3.42Å; F267-D300 WeakPolarHBondContact CB-OD1 3.28Å; F267-D300 PolarHBondContact N-OD1 3.35Å; F267-V303 HydrophobicContact CB-CG2 3.93Å; F267-V303 HydrophobicContact CD2-CG2 4.29Å
268	K	92.4	Very high	88.3	Confident	134 Å²	134	50.5 Å²	50.5	58%	0.583	24%	0.243	S	C	*	.	H	α-helix	trans	-61	-40.3	176.9	-174.5	176.4	173.5	178.7	0	112.4	L266 L271 E272	L266-K268 VanDerWaalsContact C-N 3.26Å; L266-K268 PolarHBondContact O-N 3.09Å; K268-L271 PolarHBondContact O-N 2.96Å; K268-E272 WeakPolarHBondContact CE-OE1 3.43Å; K268-E272 IonicContact NZ-OE1 3.36Å; K268-E272 WeakPolarHBondContact O-CB 3.33Å; K268-E272 WeakPolarHBondContact O-CG 3.34Å; K268-E272 PolarHBondContact O-N 2.67Å
269	D	91.5	Very high	88.3	Confident	30 Å²	30	54.6 Å²	54.6	16%	0.16	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-41.3	179.4	-67.9	-20	0	0	0	111.1	F35 T36 L266 F267 L273	F35-D269 HydrophobicContact CB-CB 3.98Å; T36-D269 HydrophobicContact CG2-CB 3.81Å; T36-D269 WeakPolarHBondContact CG2-OD1 3.43Å; L266-D269 HydrophobicContact CB-CB 4.27Å; L266-D269 WeakPolarHBondContact O-CB 3.18Å; L266-D269 PolarHBondContact O-N 3.33Å; L266-D269 VanDerWaalsContact O-N 3.07Å; F267-D269 VanDerWaalsContact C-N 3.32Å; F267-D269 PolarHBondContact O-N 2.9Å; D269-L273 WeakPolarHBondContact O-CB 3.28Å; D269-L273 PolarHBondContact O-N 2.86Å
270	L	92.8	Very high	88.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-45.7	173.9	-71.3	-178.2	0	0	0	111.5	F35 P265 L266 F267 E272 L273 I274 L285 V303 M306 W322 L324	F35-L270 HydrophobicContact CD1-CD2 3.63Å; F35-L270 HydrophobicContact CE1-CD2 3.92Å; F35-L270 HydrophobicContact CG-CD2 4.45Å; P265-L270 HydrophobicContact CB-CD1 4.42Å; P265-L270 HydrophobicContact CB-CD2 3.94Å; P265-L270 HydrophobicContact CB-CG 3.87Å; P265-L270 HydrophobicContact CG-CD1 3.76Å; P265-L270 HydrophobicContact CG-CD2 3.73Å; P265-L270 HydrophobicContact CG-CG 3.71Å; L266-L270 PolarHBondContact O-N 3.28Å; F267-L270 PolarHBondContact O-N 2.87Å; L270-E272 PolarHBondContact O-N 3.39Å; L270-L273 WeakPolarHBondContact O-CB 3.46Å; L270-L273 PolarHBondContact O-N 3.13Å; L270-I274 WeakPolarHBondContact O-CG1 3.5Å; L270-I274 PolarHBondContact O-N 2.99Å; L270-L285 HydrophobicContact CB-CD1 3.74Å; L270-V303 HydrophobicContact CD1-CG1 4.09Å; L270-V303 HydrophobicContact CD1-CG2 4.2Å; L270-M306 HydrophobicContact CD1-CE 4.38Å; L270-W322 HydrophobicContact CD2-CH2 3.88Å; L270-W322 HydrophobicContact CD2-CZ3 4.27Å; L270-L324 HydrophobicContact CD2-CD1 4.34Å
271	L	92.2	Very high	88.6	Confident	28 Å²	28	59.6 Å²	59.6	15%	0.147	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-45.7	-179.7	-172.5	64.7	0	0	0	111.3	F267 K268 L273 I274 R275 L285	F267-L271 HydrophobicContact CE1-CD2 4.32Å; F267-L271 HydrophobicContact CZ-CD2 4.44Å; F267-L271 WeakPolarHBondContact O-CB 3.49Å; F267-L271 PolarHBondContact O-N 3.27Å; K268-L271 PolarHBondContact O-N 2.96Å; L271-L273 PolarHBondContact O-N 3.16Å; L271-I274 PolarHBondContact O-N 3.36Å; L271-R275 WeakPolarHBondContact O-CB 3.26Å; L271-R275 WeakPolarHBondContact O-CG 3.33Å; L271-R275 PolarHBondContact O-N 3.26Å; L271-L285 HydrophobicContact CB-CD1 4.26Å; L271-L285 HydrophobicContact CD1-CD1 4.34Å; L271-L285 HydrophobicContact CD1-CG 4.18Å
272	E	90.1	Very high	88.8	Confident	87 Å²	87	61.3 Å²	61.3	41%	0.407	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-40.8	175.1	-74.7	-179.8	-170.2	0	0	112.4	K268 L270 R276	K268-E272 WeakPolarHBondContact CE-OE1 3.43Å; K268-E272 IonicContact NZ-OE1 3.36Å; K268-E272 WeakPolarHBondContact O-CB 3.33Å; K268-E272 WeakPolarHBondContact O-CG 3.34Å; K268-E272 PolarHBondContact O-N 2.67Å; L270-E272 PolarHBondContact O-N 3.39Å; E272-R276 WeakPolarHBondContact O-CB 3.48Å; E272-R276 PolarHBondContact O-N 2.96Å; E272-R276 VanDerWaalsContact O-N 3.12Å
273	L	90.9	Very high	89.2	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-58.8	-54.3	175.5	178.1	65.2	0	0	0	111	F35 I255 V257 D269 L270 L271 R276 E277	F35-L273 HydrophobicContact CD1-CD2 4Å; I255-L273 HydrophobicContact CG2-CD1 4.07Å; I255-L273 HydrophobicContact CG2-CD2 4.29Å; I255-L273 HydrophobicContact CG2-CG 4.38Å; V257-L273 HydrophobicContact CG2-CD2 4.13Å; D269-L273 WeakPolarHBondContact O-CB 3.28Å; D269-L273 PolarHBondContact O-N 2.86Å; L270-L273 WeakPolarHBondContact O-CB 3.46Å; L270-L273 PolarHBondContact O-N 3.13Å; L271-L273 PolarHBondContact O-N 3.16Å; L273-R276 PolarHBondContact O-N 3.48Å; L273-E277 HydrophobicContact CD1-CG 4.16Å; L273-E277 WeakPolarHBondContact O-CG 3.28Å; L273-E277 PolarHBondContact O-N 3.21Å
274	I	89.9	Confident	89.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.1	-42.1	-175.2	-58.4	-48.4	0	0	0	110.7	I255 L270 L271 R276 E277 F278 I283 L285 L324 I326	I255-I274 HydrophobicContact CD1-CD1 3.43Å; I255-I274 VanDerWaalsContact CD1-CD1 3.43Å; L270-I274 WeakPolarHBondContact O-CG1 3.5Å; L270-I274 PolarHBondContact O-N 2.99Å; L271-I274 PolarHBondContact O-N 3.36Å; I274-R276 VanDerWaalsContact C-N 3.27Å; I274-R276 PolarHBondContact O-N 3.18Å; I274-E277 PolarHBondContact O-N 3.32Å; I274-F278 HydrophobicContact CB-CD2 4.45Å; I274-F278 HydrophobicContact CD1-CE2 4.44Å; I274-F278 HydrophobicContact CG2-CD2 3.45Å; I274-F278 VanDerWaalsContact CG2-CD2 3.45Å; I274-F278 HydrophobicContact CG2-CE2 3.79Å; I274-F278 HydrophobicContact CG2-CG 4.37Å; I274-F278 WeakPolarHBondContact O-CB 3.33Å; I274-F278 WeakPolarHBondContact O-CD2 3.3Å; I274-F278 PolarHBondContact O-N 3.26Å; I274-I283 HydrophobicContact CB-CD1 3.87Å; I274-I283 HydrophobicContact CG2-CD1 3.32Å; I274-L285 HydrophobicContact CB-CD2 3.94Å; I274-L285 HydrophobicContact CG1-CD2 3.71Å; I274-L285 HydrophobicContact CG2-CD2 3.97Å; I274-L324 HydrophobicContact CD1-CD1 4.02Å; I274-L324 HydrophobicContact CG1-CD1 4.13Å; I274-I326 HydrophobicContact CG2-CG1 3.7Å; I274-I326 HydrophobicContact CG2-CG2 4.34Å
275	R	90.7	Very high	89.9	Confident	89 Å²	89	54.6 Å²	54.6	34%	0.336	26%	0.259	S	S	.	.	H	α-helix	trans	-55.9	-43.5	175.4	-74.4	-178.2	168	162	-4.8	112.1	L271 D279 Q280 D281 I283	L271-R275 WeakPolarHBondContact O-CB 3.26Å; L271-R275 WeakPolarHBondContact O-CG 3.33Å; L271-R275 PolarHBondContact O-N 3.26Å; R275-D279 WeakPolarHBondContact O-CA 3.26Å; R275-D279 PolarHBondContact O-N 2.96Å; R275-Q280 WeakPolarHBondContact CG-O 3.39Å; R275-Q280 PolarHBondContact O-N 3.24Å; R275-D281 WeakPolarHBondContact CD-OD1 3.33Å; R275-D281 PolarHBondContact NE-O 2.94Å; R275-D281 VanDerWaalsContact NE-O 3.11Å; R275-D281 IonicContact NE-OD1 2.9Å; R275-D281 PolarHBondContact NH2-O 2.98Å; R275-I283 HydrophobicContact CG-CD1 3.78Å; R275-I283 HydrophobicContact CG-CG1 3.98Å
276	R	87.6	Confident	90	Very high	125 Å²	125	54.2 Å²	54.2	47%	0.472	26%	0.257	S	S	.	.	H	α-helix	trans	-67	-40.8	177.7	-173.1	-173	70.3	-143.8	1.7	113	E272 L273 I274	E272-R276 WeakPolarHBondContact O-CB 3.48Å; E272-R276 PolarHBondContact O-N 2.96Å; E272-R276 VanDerWaalsContact O-N 3.12Å; L273-R276 PolarHBondContact O-N 3.48Å; I274-R276 VanDerWaalsContact C-N 3.27Å; I274-R276 PolarHBondContact O-N 3.18Å
277	E	87.7	Confident	90.1	Very high	57 Å²	57	51.7 Å²	51.7	27%	0.266	24%	0.242	S	C	.	.	H	α-helix	trans	-76.4	-31.4	-176.7	-65.5	-59.4	139.8	0	0	112.9	R253 I255 L273 I274	R253-E277 PolarHBondContact NH1-O 2.84Å; R253-E277 PolarHBondContact NH2-O 3.44Å; R253-E277 IonicContact NH2-OE2 2.69Å; I255-E277 HydrophobicContact CD1-CB 4.02Å; I255-E277 HydrophobicContact CD1-CG 3.91Å; I255-E277 HydrophobicContact CG1-CB 4.39Å; I255-E277 HydrophobicContact CG1-CG 4.13Å; I255-E277 HydrophobicContact CG2-CG 3.86Å; L273-E277 HydrophobicContact CD1-CG 4.16Å; L273-E277 WeakPolarHBondContact O-CG 3.28Å; L273-E277 PolarHBondContact O-N 3.21Å; I274-E277 PolarHBondContact O-N 3.32Å
278	F	84.2	Confident	89.9	Confident	30 Å²	30	56 Å²	56	13%	0.132	26%	0.258	C	S	.	.	H	α-helix	trans	-99.7	-6.8	-179.1	-71.3	-93.1	0	0	0	114.2	C242 Y244 R253 I255 I274 Q280 I326	C242-F278 HydrophobicContact CB-CE2 4.26Å; C242-F278 HydrophobicContact CB-CZ 4.04Å; Y244-F278 AromaticContact CD2-CD1 3.88Å; Y244-F278 HydrophobicContact CD2-CD1 3.88Å; Y244-F278 AromaticContact CD2-CE1 3.92Å; Y244-F278 HydrophobicContact CD2-CE1 3.92Å; Y244-F278 HydrophobicContact CE2-CD1 4.37Å; Y244-F278 HydrophobicContact CG-CD1 4.19Å; Y244-F278 AromaticContact CG-CE1 3.92Å; Y244-F278 HydrophobicContact CG-CE1 3.92Å; R253-F278 HydrophobicContact CB-CZ 4.1Å; I255-F278 HydrophobicContact CD1-CE2 4.16Å; I274-F278 HydrophobicContact CB-CD2 4.45Å; I274-F278 HydrophobicContact CD1-CE2 4.44Å; I274-F278 HydrophobicContact CG2-CD2 3.45Å; I274-F278 VanDerWaalsContact CG2-CD2 3.45Å; I274-F278 HydrophobicContact CG2-CE2 3.79Å; I274-F278 HydrophobicContact CG2-CG 4.37Å; I274-F278 WeakPolarHBondContact O-CB 3.33Å; I274-F278 WeakPolarHBondContact O-CD2 3.3Å; I274-F278 PolarHBondContact O-N 3.26Å; F278-Q280 PolarHBondContact O-N 2.95Å; F278-I326 HydrophobicContact CE2-CD1 4.49Å; F278-I326 HydrophobicContact CZ-CD1 4.45Å
279	D	84.8	Confident	89.8	Confident	153 Å²	153	51 Å²	51	82%	0.818	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	39.5	-179.3	-157.5	35.8	0	0	0	113.1	R275	R275-D279 WeakPolarHBondContact O-CA 3.26Å; R275-D279 PolarHBondContact O-N 2.96Å
280	Q	85.1	Confident	89.4	Confident	73 Å²	73	56.3 Å²	56.3	34%	0.341	26%	0.255	S	S	.	.			trans	-140	132.9	-179.1	-73.7	-172.6	-12.1	0	0	111	Y244 R275 F278 I283	Y244-Q280 VanDerWaalsContact OH-CD 3.29Å; Y244-Q280 PolarHBondContact OH-NE2 3.41Å; Y244-Q280 VanDerWaalsContact OH-NE2 3.15Å; Y244-Q280 PolarHBondContact OH-OE1 3.4Å; R275-Q280 WeakPolarHBondContact CG-O 3.39Å; R275-Q280 PolarHBondContact O-N 3.24Å; F278-Q280 PolarHBondContact O-N 2.95Å; Q280-I283 HydrophobicContact CB-CG2 3.82Å
281	D	85.4	Confident	89.1	Confident	113 Å²	113	63.1 Å²	63.1	60%	0.604	29%	0.291	S	S	*	.	S	Bend	trans	-91.5	-29.2	179.6	-77.5	-38.6	0	0	0	113.9	R275 I283	R275-D281 WeakPolarHBondContact CD-OD1 3.33Å; R275-D281 PolarHBondContact NE-O 2.94Å; R275-D281 VanDerWaalsContact NE-O 3.11Å; R275-D281 IonicContact NE-OD1 2.9Å; R275-D281 PolarHBondContact NH2-O 2.98Å; D281-I283 PolarHBondContact O-N 3.34Å; D281-I283 VanDerWaalsContact O-N 3.12Å
282	D	88.9	Confident	88.6	Confident	86 Å²	86	63.5 Å²	63.5	46%	0.46	30%	0.302	S	S	.	.	S	Bend	trans	-88.5	45.5	-176.5	-70.8	-43.1	0	0	0	113.3	K329	D282-K329 HydrophobicContact CB-CB 4.39Å; D282-K329 WeakPolarHBondContact O-CB 3.28Å; D282-K329 PolarHBondContact O-N 2.75Å
283	I	90.4	Very high	88.5	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.036	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	152.7	177.6	56.2	165.7	0	0	0	111.9	Y244 I274 R275 Q280 D281 I326	Y244-I283 HydrophobicContact CE2-CG2 4.45Å; I274-I283 HydrophobicContact CB-CD1 3.87Å; I274-I283 HydrophobicContact CG2-CD1 3.32Å; R275-I283 HydrophobicContact CG-CD1 3.78Å; R275-I283 HydrophobicContact CG-CG1 3.98Å; Q280-I283 HydrophobicContact CB-CG2 3.82Å; D281-I283 PolarHBondContact O-N 3.34Å; D281-I283 VanDerWaalsContact O-N 3.12Å; I283-I326 HydrophobicContact CB-CG2 3.86Å; I283-I326 HydrophobicContact CD1-CG2 4.44Å; I283-I326 HydrophobicContact CG2-CG2 3.9Å
284	V	92.1	Very high	88.5	Confident	8 Å²	8	63.7 Å²	63.7	5%	0.048	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.9	174.6	171	0	0	0	0	109.6	R296 I326 T327 K329	V284-R296 HydrophobicContact CG1-CG 3.56Å; V284-R296 VanDerWaalsContact CG1-NE 3.3Å; V284-R296 VanDerWaalsContact CG2-CZ 3.46Å; V284-I326 WeakPolarHBondContact O-CA 2.93Å; V284-T327 PolarHBondContact N-O 3.41Å; V284-T327 PolarHBondContact O-N 3.34Å; V284-K329 HydrophobicContact CG2-CB 3.96Å; V284-K329 HydrophobicContact CG2-CG 4.02Å
285	L	94.3	Very high	88.5	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.6	178.2	-55.8	-173.8	0	0	0	110.2	F267 L270 L271 I274 L297 I326	F267-L285 HydrophobicContact CE2-CD1 4.38Å; L270-L285 HydrophobicContact CB-CD1 3.74Å; L271-L285 HydrophobicContact CB-CD1 4.26Å; L271-L285 HydrophobicContact CD1-CD1 4.34Å; L271-L285 HydrophobicContact CD1-CG 4.18Å; I274-L285 HydrophobicContact CB-CD2 3.94Å; I274-L285 HydrophobicContact CG1-CD2 3.71Å; I274-L285 HydrophobicContact CG2-CD2 3.97Å; L285-L297 HydrophobicContact CB-CB 4.36Å; L285-L297 HydrophobicContact CB-CD1 4.13Å; L285-L297 WeakPolarHBondContact O-CB 3.28Å; L285-L297 PolarHBondContact O-N 3.03Å; L285-I326 HydrophobicContact CD2-CG1 4.19Å
286	N	94.3	Very high	88.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	163.2	176.4	-49.4	-71.9	0	0	0	110.9	L294 I295 R296 H325 T327 Y335	N286-L294 HydrophobicContact CB-CD1 3.63Å; N286-L294 HydrophobicContact CB-CD2 4.15Å; N286-L294 HydrophobicContact CB-CG 3.67Å; N286-I295 CarbonylContact C-O 3.53Å; N286-I295 WeakPolarHBondContact CA-O 3.48Å; N286-I295 WeakPolarHBondContact CB-O 3.32Å; N286-R296 WeakPolarHBondContact OD1-CA 3.42Å; N286-R296 WeakPolarHBondContact OD1-CB 3.42Å; N286-H325 WeakPolarHBondContact CA-O 3.38Å; N286-H325 HydrophobicContact CB-CB 4.05Å; N286-H325 VanDerWaalsContact CB-O 3.24Å; N286-H325 WeakPolarHBondContact CB-O 3.41Å; N286-H325 PolarHBondContact N-O 3.29Å; N286-H325 PolarHBondContact ND2-O 3.18Å; N286-H325 VanDerWaalsContact ND2-O 3.09Å; N286-H325 PolarHBondContact O-N 3.21Å; N286-T327 PolarHBondContact ND2-OG1 3.21Å; N286-T327 VanDerWaalsContact ND2-OG1 3.09Å; N286-Y335 WeakPolarHBondContact OD1-CE1 3.49Å; N286-Y335 PolarHBondContact OD1-OH 3.42Å
287	Y	93.4	Very high	88.9	Confident	21 Å²	21	60.6 Å²	60.6	8%	0.082	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	159.6	166.4	77.3	-77	0	0	0	109.8	D289 I295 L297 M306	Y287-D289 HydrophobicContact CE2-CB 4.19Å; Y287-I295 HydrophobicContact CD1-CB 3.98Å; Y287-I295 HydrophobicContact CD1-CG2 4.36Å; Y287-I295 WeakPolarHBondContact CD1-O 3.48Å; Y287-I295 HydrophobicContact CE1-CB 3.56Å; Y287-I295 HydrophobicContact CE1-CG1 4.42Å; Y287-I295 HydrophobicContact CE1-CG2 3.59Å; Y287-I295 PolarHBondContact N-O 3.22Å; Y287-I295 PolarHBondContact O-N 3.06Å; Y287-L297 HydrophobicContact CD1-CD2 3.5Å; Y287-L297 HydrophobicContact CD1-CG 4.09Å; Y287-L297 HydrophobicContact CE1-CD2 3.82Å; Y287-M306 VanDerWaalsContact CB-SD 3.56Å; Y287-M306 HydrophobicContact CD1-CB 4.09Å; Y287-M306 HydrophobicContact CD1-CG 4.26Å; Y287-M306 HydrophobicContact CD2-CB 3.99Å; Y287-M306 HydrophobicContact CD2-CG 3.78Å; Y287-M306 HydrophobicContact CE1-CB 4.29Å; Y287-M306 HydrophobicContact CE2-CB 4.22Å; Y287-M306 HydrophobicContact CE2-CG 4.47Å; Y287-M306 HydrophobicContact CG-CB 3.92Å; Y287-M306 HydrophobicContact CG-CG 3.66Å; Y287-M306 HydrophobicContact CG-SD 4.08Å
288	R	90	Very high	89.2	Confident	133 Å²	133	63.5 Å²	63.5	50%	0.502	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.4	168.9	-75.2	-174.1	-178.3	-158	-0.9	110.1	D293 L294	R288-D293 WeakPolarHBondContact CA-O 3.29Å; R288-L294 HydrophobicContact CG-CD1 4.06Å
289	D	88.9	Confident	89.7	Confident	28 Å²	28	64.2 Å²	64.2	15%	0.15	32%	0.324	C	S	.	.			trans	-75.2	-157.1	177.2	74.5	1.4	0	0	0	111.9	Y287 D291 G292 D293 I295	Y287-D289 HydrophobicContact CE2-CB 4.19Å; D289-D291 WeakPolarHBondContact OD1-CA 3.49Å; D289-D291 PolarHBondContact OD1-N 2.86Å; D289-G292 PolarHBondContact OD1-N 2.94Å; D289-D293 PolarHBondContact N-O 2.91Å; D289-D293 VanDerWaalsContact N-O 3.09Å; D289-D293 PolarHBondContact OD1-N 3.31Å; D289-I295 HydrophobicContact CB-CG1 4.08Å
290	R	83.8	Confident	90.1	Very high	142 Å²	142	60.9 Å²	60.9	54%	0.536	31%	0.306	S	S	.	.	S	Bend	trans	-81.5	-29.5	179	-65.4	-175.2	-179.5	168.2	6.4	113.2	G292	R290-G292 VanDerWaalsContact C-N 3.27Å
291	D	85.4	Confident	90.5	Very high	142 Å²	142	62.6 Å²	62.6	76%	0.759	31%	0.314	S	S	*	.	S	Bend	trans	-85.3	-11.6	-178.6	-59.1	-42.6	0	0	0	110.8	D289	D289-D291 WeakPolarHBondContact OD1-CA 3.49Å; D289-D291 PolarHBondContact OD1-N 2.86Å
292	G	83.6	Confident	90.9	Very high	37 Å²	37	59.2 Å²	59.2	38%	0.381	30%	0.296	S	S	.	.	S	Bend	trans	97.9	2.9	175.9	0	0	0	0	0	113	D289 R290	D289-G292 PolarHBondContact OD1-N 2.94Å; R290-G292 VanDerWaalsContact C-N 3.27Å
293	D	87.6	Confident	91.2	Very high	65 Å²	65	55.1 Å²	55.1	35%	0.348	27%	0.274	S	S	.	.			trans	-73.6	143.7	179.2	-74	-44.9	0	0	0	110.9	R288 D289 I295 N336	R288-D293 WeakPolarHBondContact CA-O 3.29Å; D289-D293 PolarHBondContact N-O 2.91Å; D289-D293 VanDerWaalsContact N-O 3.09Å; D289-D293 PolarHBondContact OD1-N 3.31Å; D293-I295 HydrophobicContact CB-CD1 4.39Å; D293-N336 PolarHBondContact OD1-ND2 3Å
294	L	89.6	Confident	91.3	Very high	26 Å²	26	59 Å²	59	14%	0.136	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	117.3	178.3	-163.1	66.1	0	0	0	109.3	N286 R288 H325 T327 V334 Y335	N286-L294 HydrophobicContact CB-CD1 3.63Å; N286-L294 HydrophobicContact CB-CD2 4.15Å; N286-L294 HydrophobicContact CB-CG 3.67Å; R288-L294 HydrophobicContact CG-CD1 4.06Å; L294-H325 HydrophobicContact CD1-CB 3.53Å; L294-T327 HydrophobicContact CD2-CG2 4.23Å; L294-V334 HydrophobicContact CD2-CB 3.84Å; L294-V334 HydrophobicContact CD2-CG2 3.92Å; L294-Y335 HydrophobicContact CD2-CE1 4.41Å; L294-Y335 HydrophobicContact CG-CE1 4.44Å; L294-Y335 WeakPolarHBondContact O-CD1 3.16Å
295	I	91.1	Very high	91.3	Very high	64 Å²	64	62.3 Å²	62.3	33%	0.328	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.4	-177.8	-52.8	-61.5	0	0	0	109.7	N286 Y287 D289 D293	N286-I295 CarbonylContact C-O 3.53Å; N286-I295 WeakPolarHBondContact CA-O 3.48Å; N286-I295 WeakPolarHBondContact CB-O 3.32Å; Y287-I295 HydrophobicContact CD1-CB 3.98Å; Y287-I295 HydrophobicContact CD1-CG2 4.36Å; Y287-I295 WeakPolarHBondContact CD1-O 3.48Å; Y287-I295 HydrophobicContact CE1-CB 3.56Å; Y287-I295 HydrophobicContact CE1-CG1 4.42Å; Y287-I295 HydrophobicContact CE1-CG2 3.59Å; Y287-I295 PolarHBondContact N-O 3.22Å; Y287-I295 PolarHBondContact O-N 3.06Å; D289-I295 HydrophobicContact CB-CG1 4.08Å; D293-I295 HydrophobicContact CB-CD1 4.39Å
296	R	93.4	Very high	91.2	Very high	84 Å²	84	62.4 Å²	62.4	32%	0.317	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	131.2	179.1	-173.1	169.8	176.5	155.8	0.1	111.8	V284 N286 L298 Y335	V284-R296 HydrophobicContact CG1-CG 3.56Å; V284-R296 VanDerWaalsContact CG1-NE 3.3Å; V284-R296 VanDerWaalsContact CG2-CZ 3.46Å; N286-R296 WeakPolarHBondContact OD1-CA 3.42Å; N286-R296 WeakPolarHBondContact OD1-CB 3.42Å; R296-L298 HydrophobicContact CG-CD2 3.87Å; R296-L298 HydrophobicContact CG-CG 4.33Å; R296-Y335 HydrophobicContact CB-CE1 3.97Å
297	L	94	Very high	91.1	Very high	2 Å²	2	62.6 Å²	62.6	1%	0.01	31%	0.311	C	S	.	.			trans	-84.6	126.8	173.2	-61.6	173.8	0	0	0	109.3	F267 L285 Y287 D302 V303 M306 L324	F267-L297 HydrophobicContact CD2-CB 4.01Å; F267-L297 HydrophobicContact CE2-CB 3.86Å; F267-L297 WeakPolarHBondContact CE2-O 3.42Å; L285-L297 HydrophobicContact CB-CB 4.36Å; L285-L297 HydrophobicContact CB-CD1 4.13Å; L285-L297 WeakPolarHBondContact O-CB 3.28Å; L285-L297 PolarHBondContact O-N 3.03Å; Y287-L297 HydrophobicContact CD1-CD2 3.5Å; Y287-L297 HydrophobicContact CD1-CG 4.09Å; Y287-L297 HydrophobicContact CE1-CD2 3.82Å; L297-D302 HydrophobicContact CD2-CB 3.68Å; L297-V303 HydrophobicContact CD1-CG2 4.41Å; L297-V303 HydrophobicContact CD2-CG2 4.5Å; L297-M306 HydrophobicContact CD1-CE 4.4Å; L297-M306 HydrophobicContact CD1-SD 4.02Å; L297-M306 HydrophobicContact CD2-CB 4.38Å; L297-L324 HydrophobicContact CD1-CD2 3.86Å
298	L	92.8	Very high	90.9	Very high	117 Å²	117	64.3 Å²	64.3	61%	0.613	33%	0.326	S	S	*	.			trans	-124.6	-21.1	-178.8	-60.8	175.9	0	0	0	112.7	R296 D302	R296-L298 HydrophobicContact CG-CD2 3.87Å; R296-L298 HydrophobicContact CG-CG 4.33Å; L298-D302 WeakPolarHBondContact CA-OD2 3.5Å; L298-D302 PolarHBondContact N-OD2 3.38Å
299	S	94.6	Very high	90.8	Very high	45 Å²	45	60.3 Å²	60.3	32%	0.315	31%	0.313	S	S	.	.	S	Bend	trans	-146.4	167.2	-171.7	70	0	0	0	0	112.8	Q301 D302 V303	S299-Q301 PolarHBondContact O-N 3.21Å; S299-Q301 PolarHBondContact OG-N 3.43Å; S299-D302 PolarHBondContact N-OD2 3.42Å; S299-D302 PolarHBondContact O-N 3.32Å; S299-D302 PolarHBondContact OG-N 3.34Å; S299-D302 PolarHBondContact OG-OD2 3.01Å; S299-V303 PolarHBondContact O-N 2.79Å
300	D	93.1	Very high	90.6	Very high	84 Å²	84	59.2 Å²	59.2	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-30	172.8	-65.9	-30.1	0	0	0	112.1	L266 F267 D302 V303 E304	L266-D300 WeakPolarHBondContact CA-OD1 3.4Å; F267-D300 WeakPolarHBondContact CB-OD1 3.28Å; F267-D300 PolarHBondContact N-OD1 3.35Å; D300-D302 VanDerWaalsContact C-N 3.35Å; D300-V303 PolarHBondContact O-N 2.96Å; D300-E304 PolarHBondContact O-N 3.35Å
301	Q	94.2	Very high	90.4	Very high	109 Å²	109	59.9 Å²	59.9	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-66.7	-37.8	177.2	-167.9	62.3	65.5	0	0	111.6	S299 V303 E304 L305	S299-Q301 PolarHBondContact O-N 3.21Å; S299-Q301 PolarHBondContact OG-N 3.43Å; Q301-V303 VanDerWaalsContact C-N 3.33Å; Q301-E304 PolarHBondContact NE2-OE2 2.8Å; Q301-E304 PolarHBondContact O-N 3.09Å; Q301-L305 WeakPolarHBondContact O-CG 3.48Å; Q301-L305 PolarHBondContact O-N 2.83Å
302	D	94.2	Very high	89.6	Confident	41 Å²	41	62.6 Å²	62.6	22%	0.219	31%	0.309	C	S	.	.	H	α-helix	trans	-67.2	-37.9	177.4	-53.2	-42.6	0	0	0	111.1	L297 L298 S299 D300 L305 M306	L297-D302 HydrophobicContact CD2-CB 3.68Å; L298-D302 WeakPolarHBondContact CA-OD2 3.5Å; L298-D302 PolarHBondContact N-OD2 3.38Å; S299-D302 PolarHBondContact N-OD2 3.42Å; S299-D302 PolarHBondContact O-N 3.32Å; S299-D302 PolarHBondContact OG-N 3.34Å; S299-D302 PolarHBondContact OG-OD2 3.01Å; D300-D302 VanDerWaalsContact C-N 3.35Å; D302-L305 PolarHBondContact O-N 3Å; D302-M306 WeakPolarHBondContact O-CB 3.5Å; D302-M306 PolarHBondContact O-N 3.49Å
303	V	93.7	Very high	88.9	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.5	-44.3	175.2	178.1	0	0	0	0	110.5	I264 P265 F267 L270 L297 S299 D300 Q301 L305 M306 V307	I264-V303 HydrophobicContact CG2-CG1 4.43Å; P265-V303 HydrophobicContact CG-CG1 3.95Å; P265-V303 VanDerWaalsContact O-CG1 3.3Å; P265-V303 WeakPolarHBondContact O-CG1 3.49Å; F267-V303 HydrophobicContact CB-CG2 3.93Å; F267-V303 HydrophobicContact CD2-CG2 4.29Å; L270-V303 HydrophobicContact CD1-CG1 4.09Å; L270-V303 HydrophobicContact CD1-CG2 4.2Å; L297-V303 HydrophobicContact CD1-CG2 4.41Å; L297-V303 HydrophobicContact CD2-CG2 4.5Å; S299-V303 PolarHBondContact O-N 2.79Å; D300-V303 PolarHBondContact O-N 2.96Å; Q301-V303 VanDerWaalsContact C-N 3.33Å; V303-L305 VanDerWaalsContact C-N 3.32Å; V303-L305 PolarHBondContact O-N 2.56Å; V303-M306 HydrophobicContact CG1-CE 4.12Å; V303-M306 PolarHBondContact O-N 2.85Å; V303-V307 HydrophobicContact CG1-CG2 4.42Å; V303-V307 WeakPolarHBondContact O-CG2 3.26Å; V303-V307 PolarHBondContact O-N 3.26Å
304	E	93.1	Very high	88	Confident	89 Å²	89	68.8 Å²	68.8	42%	0.416	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-41.5	175.5	-174.1	173.7	-146.5	0	0	112	I264 D300 Q301 V307 S308	I264-E304 HydrophobicContact CD1-CG 4.47Å; D300-E304 PolarHBondContact O-N 3.35Å; Q301-E304 PolarHBondContact NE2-OE2 2.8Å; Q301-E304 PolarHBondContact O-N 3.09Å; E304-V307 PolarHBondContact O-N 3.16Å; E304-S308 VanDerWaalsContact O-CB 3.3Å; E304-S308 WeakPolarHBondContact O-CB 3.38Å; E304-S308 PolarHBondContact O-N 2.93Å; E304-S308 PolarHBondContact O-OG 3.15Å; E304-S308 VanDerWaalsContact O-OG 3.13Å
305	L	91.9	Very high	86.9	Confident	77 Å²	77	72.2 Å²	72.2	40%	0.403	36%	0.358	S	S	.	.	H	α-helix	trans	-61.7	-48	174.1	-72.3	171.6	0	0	0	111.6	Q301 D302 V303 V307 S308 Q309	Q301-L305 WeakPolarHBondContact O-CG 3.48Å; Q301-L305 PolarHBondContact O-N 2.83Å; D302-L305 PolarHBondContact O-N 3Å; V303-L305 VanDerWaalsContact C-N 3.32Å; V303-L305 PolarHBondContact O-N 2.56Å; L305-V307 PolarHBondContact O-N 3.35Å; L305-S308 PolarHBondContact O-N 3.45Å; L305-S308 PolarHBondContact O-OG 2.99Å; L305-Q309 WeakPolarHBondContact O-CB 3.03Å; L305-Q309 VanDerWaalsContact O-CG 3.26Å; L305-Q309 WeakPolarHBondContact O-CG 3.43Å; L305-Q309 PolarHBondContact O-N 3.36Å
306	M	93.4	Very high	86.3	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.025	36%	0.362	C	S	.	.	H	α-helix	trans	-55.8	-49.8	175.6	174.5	-168.9	66.3	0	0	111.6	L270 Y287 L297 D302 V303 Q309 S310 W322 L324	L270-M306 HydrophobicContact CD1-CE 4.38Å; Y287-M306 VanDerWaalsContact CB-SD 3.56Å; Y287-M306 HydrophobicContact CD1-CB 4.09Å; Y287-M306 HydrophobicContact CD1-CG 4.26Å; Y287-M306 HydrophobicContact CD2-CB 3.99Å; Y287-M306 HydrophobicContact CD2-CG 3.78Å; Y287-M306 HydrophobicContact CE1-CB 4.29Å; Y287-M306 HydrophobicContact CE2-CB 4.22Å; Y287-M306 HydrophobicContact CE2-CG 4.47Å; Y287-M306 HydrophobicContact CG-CB 3.92Å; Y287-M306 HydrophobicContact CG-CG 3.66Å; Y287-M306 HydrophobicContact CG-SD 4.08Å; L297-M306 HydrophobicContact CD1-CE 4.4Å; L297-M306 HydrophobicContact CD1-SD 4.02Å; L297-M306 HydrophobicContact CD2-CB 4.38Å; D302-M306 WeakPolarHBondContact O-CB 3.5Å; D302-M306 PolarHBondContact O-N 3.49Å; V303-M306 HydrophobicContact CG1-CE 4.12Å; V303-M306 PolarHBondContact O-N 2.85Å; M306-Q309 PolarHBondContact O-N 3.14Å; M306-S310 PolarHBondContact O-N 2.99Å; M306-W322 HydrophobicContact CE-CB 4.33Å; M306-W322 HydrophobicContact CE-CD2 3.71Å; M306-W322 HydrophobicContact CE-CE3 3.5Å; M306-W322 VanDerWaalsContact CE-CE3 3.5Å; M306-W322 HydrophobicContact CE-CG 4.08Å; M306-W322 HydrophobicContact CE-CZ3 4.05Å; M306-W322 HydrophobicContact CG-CB 3.92Å; M306-W322 HydrophobicContact SD-CB 4.17Å; M306-W322 HydrophobicContact SD-CD2 4.45Å; M306-W322 HydrophobicContact SD-CE3 4.05Å; M306-L324 HydrophobicContact CE-CD2 4.41Å; M306-L324 HydrophobicContact SD-CD2 4.02Å
307	V	91.9	Very high	85.5	Confident	4 Å²	4	78 Å²	78	2%	0.024	38%	0.384	C	S	.	.	H	α-helix	trans	-64.2	-46.1	-178.8	177.6	0	0	0	0	110.5	I264 V303 E304 L305 Q309 S310 R311 W322	I264-V307 HydrophobicContact CG1-CB 4.41Å; I264-V307 HydrophobicContact CG1-CG1 4.01Å; I264-V307 HydrophobicContact CG2-CG2 4.37Å; V303-V307 HydrophobicContact CG1-CG2 4.42Å; V303-V307 WeakPolarHBondContact O-CG2 3.26Å; V303-V307 PolarHBondContact O-N 3.26Å; E304-V307 PolarHBondContact O-N 3.16Å; L305-V307 PolarHBondContact O-N 3.35Å; V307-Q309 VanDerWaalsContact C-N 3.34Å; V307-Q309 PolarHBondContact O-N 2.88Å; V307-S310 PolarHBondContact O-N 3.24Å; V307-S310 VanDerWaalsContact O-N 3.16Å; V307-S310 PolarHBondContact O-OG 3.15Å; V307-R311 PolarHBondContact O-N 2.91Å; V307-W322 HydrophobicContact CG2-CG 4.3Å
308	S	89.5	Confident	84.9	Confident	57 Å²	57	80.9 Å²	80.9	40%	0.399	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-38.7	-179.3	68.5	0	0	0	0	112.8	E304 L305 S310	E304-S308 VanDerWaalsContact O-CB 3.3Å; E304-S308 WeakPolarHBondContact O-CB 3.38Å; E304-S308 PolarHBondContact O-N 2.93Å; E304-S308 PolarHBondContact O-OG 3.15Å; E304-S308 VanDerWaalsContact O-OG 3.13Å; L305-S308 PolarHBondContact O-N 3.45Å; L305-S308 PolarHBondContact O-OG 2.99Å; S308-S310 VanDerWaalsContact C-N 3.29Å; S308-S310 PolarHBondContact O-N 3.28Å
309	Q	87.9	Confident	84.5	Confident	49 Å²	49	76.1 Å²	76.1	23%	0.229	37%	0.372	C	S	.	.	H	α-helix	trans	-65.5	-33.1	176.1	-72	-179.8	23.2	0	0	112.7	L305 M306 V307	L305-Q309 WeakPolarHBondContact O-CB 3.03Å; L305-Q309 VanDerWaalsContact O-CG 3.26Å; L305-Q309 WeakPolarHBondContact O-CG 3.43Å; L305-Q309 PolarHBondContact O-N 3.36Å; M306-Q309 PolarHBondContact O-N 3.14Å; V307-Q309 VanDerWaalsContact C-N 3.34Å; V307-Q309 PolarHBondContact O-N 2.88Å
310	S	84.2	Confident	84.2	Confident	4 Å²	4	74 Å²	74	3%	0.028	36%	0.358	C	S	.	.	H	α-helix	trans	-74.8	-22.4	-177	75.5	0	0	0	0	114.4	M306 V307 S308 R312 K313 P321	M306-S310 PolarHBondContact O-N 2.99Å; V307-S310 PolarHBondContact O-N 3.24Å; V307-S310 VanDerWaalsContact O-N 3.16Å; V307-S310 PolarHBondContact O-OG 3.15Å; S308-S310 VanDerWaalsContact C-N 3.29Å; S308-S310 PolarHBondContact O-N 3.28Å; S310-R312 PolarHBondContact O-N 3.22Å; S310-K313 WeakPolarHBondContact O-CB 3.15Å; S310-K313 PolarHBondContact O-N 2.89Å; S310-P321 WeakPolarHBondContact OG-CG 3.48Å
311	R	78.2	Confident	84	Confident	157 Å²	157	71.1 Å²	71.1	59%	0.592	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-17.2	-178.2	-69.1	-176.4	-180	-164	-1.2	114.6	V307	V307-R311 PolarHBondContact O-N 2.91Å
312	R	69.3	Low	83.8	Confident	198 Å²	198	66.2 Å²	66.2	75%	0.747	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-9.3	178.4	-60.2	-176.6	-176.8	-174.4	-1.8	113.4	S310	S310-R312 PolarHBondContact O-N 3.22Å
313	K	69.6	Low	83.7	Confident	104 Å²	104	67.2 Å²	67.2	45%	0.452	32%	0.323	S	S	.	.	S	Bend	trans	-87.2	146.9	-179.1	-65.1	-178	178.7	176.8	0	110	S310 T315	S310-K313 WeakPolarHBondContact O-CB 3.15Å; S310-K313 PolarHBondContact O-N 2.89Å; K313-T315 PolarHBondContact O-N 2.74Å
314	P	67.8	Low	83.7	Confident	128 Å²	128	67.2 Å²	67.2	83%	0.831	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-60.2	126.5	174	22.6	-30	0	0	0	110
315	T	67.4	Low	83.6	Confident	98 Å²	98	63.6 Å²	63.6	60%	0.601	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-81.3	121.1	-178.9	47.7	0	0	0	0	110.5	K313 P321	K313-T315 PolarHBondContact O-N 2.74Å; T315-P321 HydrophobicContact CG2-CB 4.18Å
316	E	77.3	Confident	83.7	Confident	89 Å²	89	60 Å²	60	42%	0.416	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-66.2	140	161.3	-68.9	171	-131.9	0	0	108.3	R241 H318 I319 K323	R241-E316 IonicContact CZ-OE2 3.87Å; R241-E316 IonicContact NH1-OE1 3.68Å; R241-E316 PolarHBondContact NH1-OE1 2.97Å; R241-E316 IonicContact NH1-OE2 3.32Å; R241-E316 PolarHBondContact NH1-OE2 3.13Å; R241-E316 IonicContact NH2-OE2 3.94Å; E316-H318 PolarHBondContact O-N 3.21Å; E316-I319 HydrophobicContact CB-CB 3.99Å; E316-I319 HydrophobicContact CB-CD1 3.88Å; E316-I319 HydrophobicContact CB-CG1 4.45Å; E316-I319 PolarHBondContact O-N 3.4Å; E316-I319 VanDerWaalsContact OE2-CD1 3.25Å; E316-I319 WeakPolarHBondContact OE2-CD1 3.44Å; E316-K323 IonicContact OE1-NZ 3.55Å
317	K	77.3	Confident	83.5	Confident	181 Å²	181	59.7 Å²	59.7	79%	0.787	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	134.3	179.3	-74.6	-170.5	176.8	-172.2	0	110.4	I319	K317-I319 PolarHBondContact O-N 3.41Å
318	H	81	Confident	83.4	Confident	62 Å²	62	63 Å²	63	29%	0.287	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	22.1	179.5	-55	-63.8	0	0	0	115.4	D235 N238 R239 E316	D235-H318 PolarHBondContact O-CD2 3.4Å; D235-H318 VanDerWaalsContact O-CG 3.31Å; N238-H318 CarbonylContact C-O 3.47Å; N238-H318 VanDerWaalsContact CA-O 3.3Å; N238-H318 WeakPolarHBondContact CA-O 3.38Å; N238-H318 WeakPolarHBondContact OD1-CA 3.28Å; N238-H318 PolarHBondContact OD1-ND1 3.09Å; R239-H318 PolarHBondContact N-O 3.22Å; E316-H318 PolarHBondContact O-N 3.21Å
319	I	84.1	Confident	83.2	Confident	18 Å²	18	65.1 Å²	65.1	9%	0.092	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-124	132.4	176.4	-67.6	162.7	0	0	0	108.6	R239 E316 K317	R239-I319 HydrophobicContact CB-CG1 4.27Å; R239-I319 WeakPolarHBondContact O-CA 3.43Å; E316-I319 HydrophobicContact CB-CB 3.99Å; E316-I319 HydrophobicContact CB-CD1 3.88Å; E316-I319 HydrophobicContact CB-CG1 4.45Å; E316-I319 PolarHBondContact O-N 3.4Å; E316-I319 VanDerWaalsContact OE2-CD1 3.25Å; E316-I319 WeakPolarHBondContact OE2-CD1 3.44Å; K317-I319 PolarHBondContact O-N 3.41Å
320	F	88.4	Confident	83.1	Confident	1 Å²	1	68.5 Å²	68.5	0%	0.004	32%	0.322	C	S	.	.			trans	-59.7	135.9	175.3	-78.1	-87.2	0	0	0	110.1	F35 N238 R239 V240 V257 E259 D260 L261 W322	F35-F320 HydrophobicContact CE1-CZ 4.49Å; F35-F320 HydrophobicContact CE2-CZ 4.44Å; F35-F320 AromaticContact CZ-CE1 3.98Å; F35-F320 HydrophobicContact CZ-CE1 3.98Å; F35-F320 HydrophobicContact CZ-CE2 4.21Å; F35-F320 AromaticContact CZ-CZ 3.71Å; F35-F320 HydrophobicContact CZ-CZ 3.71Å; N238-F320 HydrophobicContact CB-CD2 4.42Å; N238-F320 HydrophobicContact CB-CE2 3.81Å; N238-F320 HydrophobicContact CB-CZ 4.37Å; R239-F320 WeakPolarHBondContact O-CD2 3.46Å; R239-F320 PolarHBondContact O-N 3.42Å; V240-F320 HydrophobicContact CG2-CD2 3.54Å; V240-F320 HydrophobicContact CG2-CE2 3.93Å; V240-F320 HydrophobicContact CG2-CG 4.27Å; V257-F320 HydrophobicContact CB-CE2 4.22Å; V257-F320 HydrophobicContact CG1-CE2 4.38Å; E259-F320 HydrophobicContact CB-CZ 4.32Å; D260-F320 WeakPolarHBondContact O-CE1 3.34Å; L261-F320 HydrophobicContact CD2-CD1 4.19Å; L261-F320 HydrophobicContact CD2-CD2 4.2Å; L261-F320 HydrophobicContact CD2-CE1 4.39Å; L261-F320 HydrophobicContact CD2-CE2 4.38Å; L261-F320 HydrophobicContact CD2-CG 4.09Å; L261-F320 HydrophobicContact CD2-CZ 4.47Å; F320-W322 HydrophobicContact CB-CD2 4.21Å; F320-W322 HydrophobicContact CB-CZ2 4.14Å; F320-W322 AromaticContact CD1-CE2 3.72Å; F320-W322 AromaticContact CD1-CZ2 3.66Å; F320-W322 HydrophobicContact CD1-CZ2 3.66Å; F320-W322 AromaticContact CD1-NE1 3.52Å; F320-W322 HydrophobicContact CE1-CZ2 4.19Å; F320-W322 AromaticContact CG-CE2 3.98Å; F320-W322 AromaticContact CG-CZ2 3.88Å; F320-W322 HydrophobicContact CG-CZ2 3.88Å; F320-W322 PolarHBondContact O-N 3.38Å
321	P	89	Confident	82.9	Confident	23 Å²	23	70.2 Å²	70.2	15%	0.149	33%	0.331	C	S	.	.	S	Bend	trans	-67	-24.2	-176.1	23.6	-32.1	0	0	0	113.1	S310 T315	S310-P321 WeakPolarHBondContact OG-CG 3.48Å; T315-P321 HydrophobicContact CG2-CB 4.18Å
322	W	91.6	Very high	82.9	Confident	6 Å²	6	67.6 Å²	67.6	2%	0.023	33%	0.328	C	S	.	.	S	Bend	trans	-89.8	146.4	171.8	50	-90	0	0	0	110.2	F35 V240 P265 L270 M306 V307 F320 L324	F35-W322 AromaticContact CE1-CH2 3.72Å; F35-W322 HydrophobicContact CE1-CH2 3.72Å; F35-W322 AromaticContact CE1-CZ2 3.99Å; F35-W322 HydrophobicContact CE1-CZ2 3.99Å; F35-W322 HydrophobicContact CZ-CH2 4.12Å; F35-W322 AromaticContact CZ-CZ2 3.89Å; F35-W322 HydrophobicContact CZ-CZ2 3.89Å; V240-W322 HydrophobicContact CG1-CH2 4.01Å; V240-W322 HydrophobicContact CG1-CZ3 3.67Å; V240-W322 HydrophobicContact CG2-CH2 3.91Å; V240-W322 HydrophobicContact CG2-CZ3 4.41Å; P265-W322 HydrophobicContact CG-CH2 4.16Å; P265-W322 HydrophobicContact CG-CZ2 4.08Å; L270-W322 HydrophobicContact CD2-CH2 3.88Å; L270-W322 HydrophobicContact CD2-CZ3 4.27Å; M306-W322 HydrophobicContact CE-CB 4.33Å; M306-W322 HydrophobicContact CE-CD2 3.71Å; M306-W322 HydrophobicContact CE-CE3 3.5Å; M306-W322 VanDerWaalsContact CE-CE3 3.5Å; M306-W322 HydrophobicContact CE-CG 4.08Å; M306-W322 HydrophobicContact CE-CZ3 4.05Å; M306-W322 HydrophobicContact CG-CB 3.92Å; M306-W322 HydrophobicContact SD-CB 4.17Å; M306-W322 HydrophobicContact SD-CD2 4.45Å; M306-W322 HydrophobicContact SD-CE3 4.05Å; V307-W322 HydrophobicContact CG2-CG 4.3Å; F320-W322 HydrophobicContact CB-CD2 4.21Å; F320-W322 HydrophobicContact CB-CZ2 4.14Å; F320-W322 AromaticContact CD1-CE2 3.72Å; F320-W322 AromaticContact CD1-CZ2 3.66Å; F320-W322 HydrophobicContact CD1-CZ2 3.66Å; F320-W322 AromaticContact CD1-NE1 3.52Å; F320-W322 HydrophobicContact CE1-CZ2 4.19Å; F320-W322 AromaticContact CG-CE2 3.98Å; F320-W322 AromaticContact CG-CZ2 3.88Å; F320-W322 HydrophobicContact CG-CZ2 3.88Å; F320-W322 PolarHBondContact O-N 3.38Å; W322-L324 HydrophobicContact CE3-CD2 4.5Å; W322-L324 HydrophobicContact CE3-CG 4.24Å; W322-L324 HydrophobicContact CZ3-CD1 4.01Å; W322-L324 HydrophobicContact CZ3-CD2 4.34Å; W322-L324 HydrophobicContact CZ3-CG 3.9Å
323	K	91.7	Very high	83	Confident	62 Å²	62	63.1 Å²	63.1	27%	0.27	33%	0.327	S	S	.	.			trans	-126	140.8	-178.3	-54.8	-177.3	-177.9	175.4	0	108.6	R241 Y243 E316	R241-K323 HydrophobicContact CB-CD 4.45Å; R241-K323 HydrophobicContact CB-CG 4.23Å; R241-K323 HydrophobicContact CG-CD 4.32Å; R241-K323 WeakPolarHBondContact O-CA 3.47Å; Y243-K323 HydrophobicContact CD2-CB 4.37Å; Y243-K323 HydrophobicContact CE2-CB 3.91Å; Y243-K323 HydrophobicContact CE2-CD 3.69Å; Y243-K323 HydrophobicContact CE2-CG 4.36Å; E316-K323 IonicContact OE1-NZ 3.55Å
324	L	92.6	Very high	83.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142.2	179	-69.8	173.1	0	0	0	110.5	V240 R241 C242 Y243 L270 I274 L297 M306 W322 I326	V240-L324 HydrophobicContact CG1-CD1 4.06Å; V240-L324 HydrophobicContact CG1-CG 4.47Å; R241-L324 PolarHBondContact O-N 3.27Å; C242-L324 CarbonylContact C-O 3.57Å; C242-L324 WeakPolarHBondContact CA-O 3.34Å; Y243-L324 PolarHBondContact N-O 3.43Å; L270-L324 HydrophobicContact CD2-CD1 4.34Å; I274-L324 HydrophobicContact CD1-CD1 4.02Å; I274-L324 HydrophobicContact CG1-CD1 4.13Å; L297-L324 HydrophobicContact CD1-CD2 3.86Å; M306-L324 HydrophobicContact CE-CD2 4.41Å; M306-L324 HydrophobicContact SD-CD2 4.02Å; W322-L324 HydrophobicContact CE3-CD2 4.5Å; W322-L324 HydrophobicContact CE3-CG 4.24Å; W322-L324 HydrophobicContact CZ3-CD1 4.01Å; W322-L324 HydrophobicContact CZ3-CD2 4.34Å; W322-L324 HydrophobicContact CZ3-CG 3.9Å; L324-I326 HydrophobicContact CB-CD1 4.07Å
325	H	92.4	Very high	83.6	Confident	13 Å²	13	55.8 Å²	55.8	6%	0.06	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.3	173.3	-70.7	-93	0	0	0	108.2	Y243 H245 N286 L294	Y243-H325 AromaticContact CD2-CE1 3.42Å; Y243-H325 VanDerWaalsContact CD2-CE1 3.42Å; Y243-H325 WeakPolarHBondContact CD2-CE1 3.32Å; Y243-H325 AromaticContact CD2-ND1 3.88Å; Y243-H325 AromaticContact CD2-NE2 3.72Å; Y243-H325 AromaticContact CG-CE1 3.75Å; Y243-H325 AromaticContact CG-ND1 3.94Å; Y243-H325 CarbonylContact O-C 3.53Å; Y243-H325 WeakPolarHBondContact O-CA 3.37Å; H245-H325 AromaticContact CE1-ND1 3.73Å; H245-H325 AromaticContact NE2-CE1 3.97Å; H245-H325 AromaticContact NE2-CG 3.7Å; H245-H325 AromaticContact NE2-ND1 2.9Å; H245-H325 PolarHBondContact NE2-ND1 3.34Å; N286-H325 WeakPolarHBondContact CA-O 3.38Å; N286-H325 HydrophobicContact CB-CB 4.05Å; N286-H325 VanDerWaalsContact CB-O 3.24Å; N286-H325 WeakPolarHBondContact CB-O 3.41Å; N286-H325 PolarHBondContact N-O 3.29Å; N286-H325 PolarHBondContact ND2-O 3.18Å; N286-H325 VanDerWaalsContact ND2-O 3.09Å; N286-H325 PolarHBondContact O-N 3.21Å; L294-H325 HydrophobicContact CD1-CB 3.53Å
326	I	92.1	Very high	83.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.3	-174.7	-57.5	81.6	0	0	0	107.7	C242 Y243 Y244 H245 I274 F278 I283 V284 L285 L324	C242-I326 HydrophobicContact CB-CD1 3.51Å; Y243-I326 WeakPolarHBondContact O-CD1 3.5Å; Y243-I326 PolarHBondContact O-N 3.09Å; Y244-I326 HydrophobicContact CD2-CB 3.83Å; Y244-I326 HydrophobicContact CD2-CG2 3.61Å; Y244-I326 HydrophobicContact CE2-CG2 3.9Å; H245-I326 PolarHBondContact N-O 2.95Å; I274-I326 HydrophobicContact CG2-CG1 3.7Å; I274-I326 HydrophobicContact CG2-CG2 4.34Å; F278-I326 HydrophobicContact CE2-CD1 4.49Å; F278-I326 HydrophobicContact CZ-CD1 4.45Å; I283-I326 HydrophobicContact CB-CG2 3.86Å; I283-I326 HydrophobicContact CD1-CG2 4.44Å; I283-I326 HydrophobicContact CG2-CG2 3.9Å; V284-I326 WeakPolarHBondContact O-CA 2.93Å; L285-I326 HydrophobicContact CD2-CG1 4.19Å; L324-I326 HydrophobicContact CB-CD1 4.07Å
327	T	91	Very high	82.5	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	159.8	178.1	61.5	0	0	0	0	108.9	H245 V284 N286 L294 V334	H245-T327 HydrophobicContact CB-CG2 4.09Å; V284-T327 PolarHBondContact N-O 3.41Å; V284-T327 PolarHBondContact O-N 3.34Å; N286-T327 PolarHBondContact ND2-OG1 3.21Å; N286-T327 VanDerWaalsContact ND2-OG1 3.09Å; L294-T327 HydrophobicContact CD2-CG2 4.23Å; T327-V334 HydrophobicContact CG2-CB 4.42Å; T327-V334 HydrophobicContact CG2-CG1 4.17Å; T327-V334 HydrophobicContact CG2-CG2 3.97Å
328	H	88.8	Confident	80.9	Confident	72 Å²	72	57.2 Å²	57.2	33%	0.333	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	148	168.8	-164.8	-98.3	0	0	0	110	D330 D331	H328-D330 IonicContact CE1-OD2 3.79Å; H328-D330 PolarHBondContact CE1-OD2 3Å; H328-D330 PolarHBondContact ND1-N 3.1Å; H328-D330 IonicContact ND1-OD2 3.83Å; H328-D330 PolarHBondContact O-N 2.99Å; H328-D331 HydrophobicContact CB-CB 4.19Å; H328-D331 PolarHBondContact O-N 2.92Å; H328-D331 VanDerWaalsContact O-N 3.17Å
329	K	86.3	Confident	79.1	Confident	102 Å²	102	59.4 Å²	59.4	44%	0.443	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-34	-175.2	-177.2	-176.5	174.2	-168.3	0	114.2	D282 V284	D282-K329 HydrophobicContact CB-CB 4.39Å; D282-K329 WeakPolarHBondContact O-CB 3.28Å; D282-K329 PolarHBondContact O-N 2.75Å; V284-K329 HydrophobicContact CG2-CB 3.96Å; V284-K329 HydrophobicContact CG2-CG 4.02Å
330	D	84.1	Confident	77.1	Confident	121 Å²	121	62.4 Å²	62.4	65%	0.647	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-9.6	-178	-54.9	-39.2	0	0	0	113	H328 L332	H328-D330 IonicContact CE1-OD2 3.79Å; H328-D330 PolarHBondContact CE1-OD2 3Å; H328-D330 PolarHBondContact ND1-N 3.1Å; H328-D330 IonicContact ND1-OD2 3.83Å; H328-D330 PolarHBondContact O-N 2.99Å; D330-L332 PolarHBondContact O-N 3.28Å; D330-L332 VanDerWaalsContact O-N 3.12Å
331	D	80.1	Confident	74.6	Confident	39 Å²	39	69.8 Å²	69.8	21%	0.209	40%	0.397	C	S	.	.			trans	-81	96.8	177.3	-175.6	9.5	0	0	0	110.3	H328 S333 V334	H328-D331 HydrophobicContact CB-CB 4.19Å; H328-D331 PolarHBondContact O-N 2.92Å; H328-D331 VanDerWaalsContact O-N 3.17Å; D331-S333 WeakPolarHBondContact OD1-CB 3.4Å; D331-S333 PolarHBondContact OD1-N 2.8Å; D331-S333 PolarHBondContact OD1-OG 3.18Å; D331-V334 WeakPolarHBondContact O-CG2 3.26Å; D331-V334 WeakPolarHBondContact OD2-CG1 3.46Å
332	L	78.1	Confident	72.1	Confident	103 Å²	103	71.4 Å²	71.4	54%	0.539	42%	0.419	S	S	.	.			trans	-95.1	-5.8	173.4	-62.3	177.3	0	0	0	112.9	D330 V334 Y335	D330-L332 PolarHBondContact O-N 3.28Å; D330-L332 VanDerWaalsContact O-N 3.12Å; L332-V334 PolarHBondContact O-N 3.42Å; L332-Y335 HydrophobicContact CB-CD2 4.42Å; L332-Y335 HydrophobicContact CD2-CD2 4.07Å; L332-Y335 HydrophobicContact CD2-CE2 3.92Å; L332-Y335 WeakPolarHBondContact O-CD2 3.45Å; L332-Y335 PolarHBondContact O-N 3.04Å
333	S	72.6	Confident	69.5	Low	103 Å²	103	75.8 Å²	75.8	72%	0.72	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-23.6	-175.9	72.7	0	0	0	0	113	D331 Y335	D331-S333 WeakPolarHBondContact OD1-CB 3.4Å; D331-S333 PolarHBondContact OD1-N 2.8Å; D331-S333 PolarHBondContact OD1-OG 3.18Å; S333-Y335 VanDerWaalsContact C-N 3.27Å; S333-Y335 PolarHBondContact O-N 2.84Å
334	V	72.9	Confident	66.8	Low	45 Å²	45	79.9 Å²	79.9	27%	0.273	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-16.1	177.1	-67.7	0	0	0	0	114.3	L294 T327 D331 L332	L294-V334 HydrophobicContact CD2-CB 3.84Å; L294-V334 HydrophobicContact CD2-CG2 3.92Å; T327-V334 HydrophobicContact CG2-CB 4.42Å; T327-V334 HydrophobicContact CG2-CG1 4.17Å; T327-V334 HydrophobicContact CG2-CG2 3.97Å; D331-V334 WeakPolarHBondContact O-CG2 3.26Å; D331-V334 WeakPolarHBondContact OD2-CG1 3.46Å; L332-V334 PolarHBondContact O-N 3.42Å
335	Y	77.7	Confident	64	Low	34 Å²	34	88 Å²	88	13%	0.133	52%	0.517	C	S	.	.	S	Bend	trans	-94.7	135.6	175.2	-52.6	-81.1	0	0	0	108.9	N286 L294 R296 L332 S333 T337	N286-Y335 WeakPolarHBondContact OD1-CE1 3.49Å; N286-Y335 PolarHBondContact OD1-OH 3.42Å; L294-Y335 HydrophobicContact CD2-CE1 4.41Å; L294-Y335 HydrophobicContact CG-CE1 4.44Å; L294-Y335 WeakPolarHBondContact O-CD1 3.16Å; R296-Y335 HydrophobicContact CB-CE1 3.97Å; L332-Y335 HydrophobicContact CB-CD2 4.42Å; L332-Y335 HydrophobicContact CD2-CD2 4.07Å; L332-Y335 HydrophobicContact CD2-CE2 3.92Å; L332-Y335 WeakPolarHBondContact O-CD2 3.45Å; L332-Y335 PolarHBondContact O-N 3.04Å; S333-Y335 VanDerWaalsContact C-N 3.27Å; S333-Y335 PolarHBondContact O-N 2.84Å; Y335-T337 PolarHBondContact O-N 3.2Å
336	N	66.1	Low	61.2	Low	140 Å²	140	93.6 Å²	93.6	75%	0.749	55%	0.552	S	S	*	*			trans	-69.5	70	174.1	-75.7	-33.8	0	0	0	110.5	D293 N338	D293-N336 PolarHBondContact OD1-ND2 3Å; N336-N338 VanDerWaalsContact C-N 3.29Å; N336-N338 PolarHBondContact O-N 3.18Å
337	T	54.2	Low	58.5	Low	103 Å²	103	99.1 Å²	99.1	63%	0.632	59%	0.586	S	S	*	*			trans	-93.1	42.4	178.1	61.6	0	0	0	0	111.5	Y335 P339	Y335-T337 PolarHBondContact O-N 3.2Å; T337-P339 WeakPolarHBondContact O-CD 3.24Å
338	N	45	Very low	55.7	Low	155 Å²	155	110.4 Å²	110.4	83%	0.829	63%	0.629	S	S	*	*			trans	-82.7	107.3	168.3	-87.2	-11.9	0	0	0	108.3	N336 G340	N336-N338 VanDerWaalsContact C-N 3.29Å; N336-N338 PolarHBondContact O-N 3.18Å; N338-G340 PolarHBondContact O-N 2.75Å
339	P	43.1	Very low	53.1	Low	108 Å²	108	113.1 Å²	113.1	70%	0.701	65%	0.65	S	S	*	*			trans	-67	126.4	159.8	15.4	-0.7	0	0	0	105.7	T337 I341	T337-P339 WeakPolarHBondContact O-CD 3.24Å; P339-I341 PolarHBondContact O-N 3.15Å
340	G	41.1	Very low	50.6	Low	81 Å²	81	120.9 Å²	120.9	84%	0.835	69%	0.691	S	S	*	*			trans	-47.7	101.8	-177.3	0	0	0	0	0	112.1	N338 G342	N338-G340 PolarHBondContact O-N 2.75Å; G340-G342 PolarHBondContact O-N 3.13Å
341	I	36.6	Very low	48.9	Very low	155 Å²	155	120.9 Å²	120.9	80%	0.795	69%	0.694	S	S	*	*			trans	-70.2	112.9	162	-67	174.6	0	0	0	104.3	P339	P339-I341 PolarHBondContact O-N 3.15Å
342	G	35.2	Very low	47.3	Very low	58 Å²	58	125.2 Å²	125.2	60%	0.598	72%	0.719	S	S	*	*			trans	-46.2	142.1	-175.2	0	0	0	0	0	112.4	G340 I344	G340-G342 PolarHBondContact O-N 3.13Å; G342-I344 PolarHBondContact O-N 3.25Å
343	A	37.2	Very low	45.6	Very low	98 Å²	98	126.4 Å²	126.4	81%	0.81	73%	0.729	S	S	*	*			trans	-40.2	107.1	173.7	0	0	0	0	0	111.6	Q345	A343-Q345 VanDerWaalsContact C-N 3.33Å; A343-Q345 PolarHBondContact O-N 2.92Å
344	I	34.9	Very low	44	Very low	147 Å²	147	127.8 Å²	127.8	75%	0.754	73%	0.73	S	S	*	*			trans	-72.9	98.6	161.2	-63.5	174.8	0	0	0	105.5	G342 T346	G342-I344 PolarHBondContact O-N 3.25Å; I344-T346 PolarHBondContact O-N 3.21Å
345	Q	35.6	Very low	42.2	Very low	172 Å²	172	133 Å²	133	80%	0.804	76%	0.758	S	S	*	*			trans	-54.1	109.9	166.9	-80.6	-179.1	-11.9	0	0	108.5	A343 V347	A343-Q345 VanDerWaalsContact C-N 3.33Å; A343-Q345 PolarHBondContact O-N 2.92Å; Q345-V347 PolarHBondContact O-N 3.01Å
346	T	32.8	Very low	39.8	Very low	129 Å²	129	139.6 Å²	139.6	79%	0.791	80%	0.8	S	S	*	*			trans	-80.3	98.9	164.4	-48.4	0	0	0	0	106.6	I344 R348	I344-T346 PolarHBondContact O-N 3.21Å; T346-R348 PolarHBondContact O-N 3.38Å; T346-R348 VanDerWaalsContact O-N 3.16Å
347	V	35.4	Very low	38	Very low	117 Å²	117	139.6 Å²	139.6	71%	0.709	80%	0.803	S	S	*	*			trans	-59.6	112.8	167.8	176	0	0	0	0	107.5	Q345	Q345-V347 PolarHBondContact O-N 3.01Å
348	R	32.3	Very low	36.7	Very low	237 Å²	237	142.4 Å²	142.4	89%	0.894	82%	0.817	S	S	*	*			trans	-85.1	114.7	163.6	-91.2	-175.9	172.8	176	-1.5	108.1	T346 M350	T346-R348 PolarHBondContact O-N 3.38Å; T346-R348 VanDerWaalsContact O-N 3.16Å; R348-M350 PolarHBondContact O-N 3.11Å
349	T	34.9	Very low	36	Very low	128 Å²	128	141.3 Å²	141.3	79%	0.785	82%	0.816	S	S	*	*			trans	-71.3	112.1	160.8	32.1	0	0	0	0	109.7
350	M	33.1	Very low	35.4	Very low	266 Å²	266	144.4 Å²	144.4	100%	1.31	83%	0.826	S	S	*	*				178.6	0	120.8	-93.9	-166.5	179.9	0	0	109.5	R348	R348-M350 PolarHBondContact O-N 3.11Å

Retrieved 350 of 350 residues in 845.9 ms (Link to these results)

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