A0A087XZZ9_POEFO Loading...

Endoplasmic reticulum lectin

Lectin component of the HRD1 complex, which functions in endoplasmic reticulum (ER) quality control and ER-associated degradation (ERAD). Specifically recognizes and binds improperly folded glycoproteins as well as hyperglycosylated proteins, retain them in the ER, and transfers them to the ubiquitination machinery and promote their degradation. Possible targets include TRPV4 as well as hyperglycosylated HSP90B1. Lectin involved in the quality control of the secretory pathway. As a member of the endoplasmic reticulum-associated degradation lumenal (ERAD-L) surveillance system, targets misfolded endoplasmic reticulum lumenal glycoproteins for degradation.

AlphaFold DB , UniProt , Accession A0A087XZZ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 668 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.7	Low	51.7	Low	222 Å²	222	114.9 Å²	114.9	100%	1.094	65%	0.652	S	S	*	*				0	-2	0	-71.8	173.8	179	0	0	115.3
2	I	53.6	Low	52.4	Low	158 Å²	158	111.8 Å²	111.8	81%	0.81	64%	0.636	S	S	*	*	H	α-helix	trans	-87.8	-29.6	-172.3	-61	173.2	0	0	0	114.1	G4	I2-G4 VanDerWaalsContact C-N 3.32Å; I2-G4 PolarHBondContact O-N 3.46Å
3	R	46.8	Very low	52.9	Low	237 Å²	237	117.7 Å²	117.7	89%	0.894	64%	0.642	S	S	*	*	H	α-helix	trans	-73.4	-15.5	178.5	-75.8	-175.8	173.1	176.2	-2.8	115.1
4	G	47.9	Very low	53.5	Low	51 Å²	51	122.1 Å²	122.1	53%	0.526	65%	0.645	S	S	.	*	H	α-helix	trans	-76.9	-37.6	-179.4	0	0	0	0	0	114.3	I2 A6	I2-G4 VanDerWaalsContact C-N 3.32Å; I2-G4 PolarHBondContact O-N 3.46Å; G4-A6 PolarHBondContact O-N 3.08Å
5	L	49.4	Very low	53.9	Low	131 Å²	131	120.9 Å²	120.9	69%	0.686	64%	0.638	S	S	*	*	H	α-helix	trans	-69.9	-32	-176.8	-85.9	82	0	0	0	113.1	A8 A9	L5-A8 PolarHBondContact O-N 3.5Å; L5-A9 WeakPolarHBondContact O-CB 3.43Å; L5-A9 PolarHBondContact O-N 3.37Å
6	A	50.6	Low	54.4	Low	68 Å²	68	122.2 Å²	122.2	56%	0.562	64%	0.637	S	S	*	*	H	α-helix	trans	-67.2	-41.5	-177.8	0	0	0	0	0	112.8	G4 A9 S10	G4-A6 PolarHBondContact O-N 3.08Å; A6-A9 PolarHBondContact O-N 3.28Å; A6-S10 PolarHBondContact O-N 3.15Å; A6-S10 VanDerWaalsContact O-N 3.12Å
7	M	49.6	Very low	54.9	Low	152 Å²	152	126.1 Å²	126.1	75%	0.749	64%	0.641	S	S	*	*	H	α-helix	trans	-65.5	-43.3	176.8	-70.8	-68.3	-118.2	0	0	111.5	S10 S11	M7-S10 PolarHBondContact O-N 3.08Å; M7-S11 PolarHBondContact O-N 3.33Å; M7-S11 PolarHBondContact O-OG 3.04Å; M7-S11 VanDerWaalsContact O-OG 3.1Å
8	A	52.1	Low	55.2	Low	53 Å²	53	124.3 Å²	124.3	44%	0.438	63%	0.633	S	S	.	*	H	α-helix	trans	-64.8	-39.7	177.2	0	0	0	0	0	112.8	L5 S10 S11 V12	L5-A8 PolarHBondContact O-N 3.5Å; A8-S10 VanDerWaalsContact C-N 3.33Å; A8-S10 PolarHBondContact O-N 3.47Å; A8-S11 PolarHBondContact O-OG 3.29Å; A8-V12 WeakPolarHBondContact O-CB 3.38Å; A8-V12 VanDerWaalsContact O-CG2 3.25Å; A8-V12 WeakPolarHBondContact O-CG2 3.22Å; A8-V12 PolarHBondContact O-N 3.21Å
9	A	54.3	Low	55.4	Low	52 Å²	52	121.6 Å²	121.6	43%	0.43	63%	0.625	S	S	.	*	H	α-helix	trans	-67.4	-33.4	176.6	0	0	0	0	0	112.7	L5 A6 R13	L5-A9 WeakPolarHBondContact O-CB 3.43Å; L5-A9 PolarHBondContact O-N 3.37Å; A6-A9 PolarHBondContact O-N 3.28Å; A9-R13 WeakPolarHBondContact O-CB 3.38Å; A9-R13 WeakPolarHBondContact O-CG 3.45Å; A9-R13 PolarHBondContact O-N 3.24Å; A9-R13 VanDerWaalsContact O-N 3.13Å
10	S	55.6	Low	55.6	Low	79 Å²	79	120.5 Å²	120.5	55%	0.552	62%	0.62	S	S	*	*	H	α-helix	trans	-68.5	-50.5	175.3	-168.6	0	0	0	0	111.5	A6 M7 A8 V12 R13 W14	A6-S10 PolarHBondContact O-N 3.15Å; A6-S10 VanDerWaalsContact O-N 3.12Å; M7-S10 PolarHBondContact O-N 3.08Å; A8-S10 VanDerWaalsContact C-N 3.33Å; A8-S10 PolarHBondContact O-N 3.47Å; S10-V12 PolarHBondContact O-N 3.48Å; S10-R13 PolarHBondContact O-N 3.17Å; S10-R13 VanDerWaalsContact O-N 3.17Å; S10-W14 PolarHBondContact O-N 3.46Å
11	S	54.1	Low	55.7	Low	61 Å²	61	119.3 Å²	119.3	43%	0.427	62%	0.618	S	S	.	*	H	α-helix	trans	-64.8	-37.9	178.7	52.7	0	0	0	0	112.6	M7 A8 R13 W14 L15	M7-S11 PolarHBondContact O-N 3.33Å; M7-S11 PolarHBondContact O-OG 3.04Å; M7-S11 VanDerWaalsContact O-OG 3.1Å; A8-S11 PolarHBondContact O-OG 3.29Å; S11-R13 PolarHBondContact O-N 3.39Å; S11-W14 PolarHBondContact O-N 3.29Å; S11-L15 WeakPolarHBondContact O-CD1 3.42Å; S11-L15 PolarHBondContact O-N 2.68Å
12	V	59.8	Low	55.9	Low	77 Å²	77	113.5 Å²	113.5	47%	0.467	60%	0.595	S	S	.	*	H	α-helix	trans	-65.7	-35.6	173.2	170.9	0	0	0	0	112.3	A8 S10 K16	A8-V12 WeakPolarHBondContact O-CB 3.38Å; A8-V12 VanDerWaalsContact O-CG2 3.25Å; A8-V12 WeakPolarHBondContact O-CG2 3.22Å; A8-V12 PolarHBondContact O-N 3.21Å; S10-V12 PolarHBondContact O-N 3.48Å; V12-K16 HydrophobicContact CG1-CD 4.31Å; V12-K16 WeakPolarHBondContact O-CB 3.31Å; V12-K16 VanDerWaalsContact O-CG 3.3Å; V12-K16 WeakPolarHBondContact O-CG 3.43Å; V12-K16 PolarHBondContact O-N 3.5Å
13	R	59.8	Low	56	Low	189 Å²	189	112.6 Å²	112.6	71%	0.713	59%	0.591	S	S	*	*	H	α-helix	trans	-69.3	-36.2	172.9	-78.2	176.6	178.9	-177.3	0.4	112.2	A9 S10 S11 R17	A9-R13 WeakPolarHBondContact O-CB 3.38Å; A9-R13 WeakPolarHBondContact O-CG 3.45Å; A9-R13 PolarHBondContact O-N 3.24Å; A9-R13 VanDerWaalsContact O-N 3.13Å; S10-R13 PolarHBondContact O-N 3.17Å; S10-R13 VanDerWaalsContact O-N 3.17Å; S11-R13 PolarHBondContact O-N 3.39Å; R13-R17 WeakPolarHBondContact O-CG 3.38Å; R13-R17 PolarHBondContact O-N 3.08Å
14	W	60.6	Low	56.4	Low	180 Å²	180	107 Å²	107	68%	0.682	58%	0.578	S	S	*	*	H	α-helix	trans	-69.8	-46.4	176.7	-152.8	72.1	0	0	0	111.2	S10 S11 K16 R17 L18	S10-W14 PolarHBondContact O-N 3.46Å; S11-W14 PolarHBondContact O-N 3.29Å; W14-K16 PolarHBondContact O-N 3.44Å; W14-R17 PolarHBondContact O-N 2.99Å; W14-L18 WeakPolarHBondContact O-CB 3.28Å; W14-L18 PolarHBondContact O-N 3.15Å
15	L	60.3	Low	56.6	Low	103 Å²	103	108.7 Å²	108.7	54%	0.539	58%	0.581	S	S	.	*	H	α-helix	trans	-60.4	-40.6	171.6	-91.7	89.4	0	0	0	112.4	S11 R17 L18 C19	S11-L15 WeakPolarHBondContact O-CD1 3.42Å; S11-L15 PolarHBondContact O-N 2.68Å; L15-R17 VanDerWaalsContact C-N 3.34Å; L15-R17 PolarHBondContact O-N 3.19Å; L15-L18 PolarHBondContact O-N 2.99Å; L15-C19 WeakPolarHBondContact O-CB 3.36Å; L15-C19 PolarHBondContact O-N 3.15Å; L15-C19 PolarHBondContact O-SG 3.43Å; L15-C19 VanDerWaalsContact O-SG 3.38Å
16	K	61.5	Low	56.5	Low	142 Å²	142	107.1 Å²	107.1	62%	0.617	58%	0.578	S	S	*	*	H	α-helix	trans	-65.7	-34.8	175.7	-78.2	-175.3	177.4	-166.7	0	112.9	V12 W14 L20	V12-K16 HydrophobicContact CG1-CD 4.31Å; V12-K16 WeakPolarHBondContact O-CB 3.31Å; V12-K16 VanDerWaalsContact O-CG 3.3Å; V12-K16 WeakPolarHBondContact O-CG 3.43Å; V12-K16 PolarHBondContact O-N 3.5Å; W14-K16 PolarHBondContact O-N 3.44Å; K16-L20 WeakPolarHBondContact O-CB 3.37Å; K16-L20 WeakPolarHBondContact O-CG 3.41Å; K16-L20 PolarHBondContact O-N 3.44Å
17	R	62.3	Low	56.5	Low	189 Å²	189	111.1 Å²	111.1	71%	0.713	59%	0.589	S	S	*	*	H	α-helix	trans	-71.4	-39.1	172.5	-75.6	-176.9	177	-151.9	-2	111.9	R13 W14 L15 L20 V21	R13-R17 WeakPolarHBondContact O-CG 3.38Å; R13-R17 PolarHBondContact O-N 3.08Å; W14-R17 PolarHBondContact O-N 2.99Å; L15-R17 VanDerWaalsContact C-N 3.34Å; L15-R17 PolarHBondContact O-N 3.19Å; R17-L20 PolarHBondContact O-N 2.99Å; R17-V21 WeakPolarHBondContact O-CG2 3.42Å; R17-V21 PolarHBondContact O-N 3.12Å
18	L	61.3	Low	56.3	Low	93 Å²	93	112.5 Å²	112.5	49%	0.487	59%	0.591	S	S	.	*	H	α-helix	trans	-63.8	-46.1	174.5	-157.2	82.8	0	0	0	111	W14 L15 L20 V21 V22	W14-L18 WeakPolarHBondContact O-CB 3.28Å; W14-L18 PolarHBondContact O-N 3.15Å; L15-L18 PolarHBondContact O-N 2.99Å; L18-L20 VanDerWaalsContact C-N 3.33Å; L18-L20 PolarHBondContact O-N 3.36Å; L18-V21 PolarHBondContact O-N 3.28Å; L18-V22 WeakPolarHBondContact O-CB 3.27Å; L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.44Å; L18-V22 PolarHBondContact O-N 2.84Å
19	C	58.7	Low	56.1	Low	73 Å²	73	115.6 Å²	115.6	49%	0.493	61%	0.605	S	S	.	*	H	α-helix	trans	-61.4	-37.8	173.1	-74.4	0	0	0	0	112.4	L15 V22 L23	L15-C19 WeakPolarHBondContact O-CB 3.36Å; L15-C19 PolarHBondContact O-N 3.15Å; L15-C19 PolarHBondContact O-SG 3.43Å; L15-C19 VanDerWaalsContact O-SG 3.38Å; C19-V22 PolarHBondContact O-N 3.41Å; C19-L23 VanDerWaalsContact O-CB 3.22Å; C19-L23 WeakPolarHBondContact O-CB 3.35Å; C19-L23 WeakPolarHBondContact O-CD1 3.09Å; C19-L23 WeakPolarHBondContact O-CG 3.21Å; C19-L23 PolarHBondContact O-N 3.22Å
20	L	59.3	Low	55.8	Low	100 Å²	100	117.3 Å²	117.3	52%	0.524	61%	0.613	S	S	.	*	H	α-helix	trans	-65.6	-42.9	173.3	-87.6	161.6	0	0	0	111.9	K16 R17 L18 V22 L23 I24	K16-L20 WeakPolarHBondContact O-CB 3.37Å; K16-L20 WeakPolarHBondContact O-CG 3.41Å; K16-L20 PolarHBondContact O-N 3.44Å; R17-L20 PolarHBondContact O-N 2.99Å; L18-L20 VanDerWaalsContact C-N 3.33Å; L18-L20 PolarHBondContact O-N 3.36Å; L20-V22 VanDerWaalsContact C-N 3.35Å; L20-V22 PolarHBondContact O-N 3.1Å; L20-L23 PolarHBondContact O-N 3.38Å; L20-I24 HydrophobicContact CD2-CD1 4.47Å; L20-I24 VanDerWaalsContact O-CB 3.31Å; L20-I24 WeakPolarHBondContact O-CB 3.48Å; L20-I24 WeakPolarHBondContact O-CD1 3.39Å; L20-I24 WeakPolarHBondContact O-CG1 3.35Å; L20-I24 PolarHBondContact O-N 3.26Å
21	V	58.3	Low	55.6	Low	95 Å²	95	117.4 Å²	117.4	58%	0.576	62%	0.619	S	S	*	*	H	α-helix	trans	-64.6	-39	175.7	171.3	0	0	0	0	111.4	R17 L18 I24 C25	R17-V21 WeakPolarHBondContact O-CG2 3.42Å; R17-V21 PolarHBondContact O-N 3.12Å; L18-V21 PolarHBondContact O-N 3.28Å; V21-I24 PolarHBondContact O-N 3.26Å; V21-C25 PolarHBondContact O-N 3.36Å
22	V	58.4	Low	55.5	Low	101 Å²	101	122 Å²	122	61%	0.612	63%	0.632	S	S	*	*	H	α-helix	trans	-70.9	-33.9	175.3	172.5	0	0	0	0	112.3	L18 C19 L20 I24	L18-V22 WeakPolarHBondContact O-CB 3.27Å; L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.44Å; L18-V22 PolarHBondContact O-N 2.84Å; C19-V22 PolarHBondContact O-N 3.41Å; L20-V22 VanDerWaalsContact C-N 3.35Å; L20-V22 PolarHBondContact O-N 3.1Å; V22-I24 VanDerWaalsContact C-N 3.34Å
23	L	55.8	Low	54.8	Low	139 Å²	139	124.7 Å²	124.7	73%	0.728	64%	0.643	S	S	*	*	H	α-helix	trans	-73.3	-23	172.9	-86.6	158.7	0	0	0	113.4	C19 L20	C19-L23 VanDerWaalsContact O-CB 3.22Å; C19-L23 WeakPolarHBondContact O-CB 3.35Å; C19-L23 WeakPolarHBondContact O-CD1 3.09Å; C19-L23 WeakPolarHBondContact O-CG 3.21Å; C19-L23 PolarHBondContact O-N 3.22Å; L20-L23 PolarHBondContact O-N 3.38Å
24	I	53.8	Low	54.4	Low	120 Å²	120	119.3 Å²	119.3	62%	0.615	63%	0.628	S	S	*	*	H	α-helix	trans	-92	-19.4	179.3	-68.1	165.1	0	0	0	111.8	L20 V21 V22	L20-I24 HydrophobicContact CD2-CD1 4.47Å; L20-I24 VanDerWaalsContact O-CB 3.31Å; L20-I24 WeakPolarHBondContact O-CB 3.48Å; L20-I24 WeakPolarHBondContact O-CD1 3.39Å; L20-I24 WeakPolarHBondContact O-CG1 3.35Å; L20-I24 PolarHBondContact O-N 3.26Å; V21-I24 PolarHBondContact O-N 3.26Å; V22-I24 VanDerWaalsContact C-N 3.34Å
25	C	52.7	Low	54.2	Low	86 Å²	86	117.2 Å²	117.2	58%	0.581	63%	0.629	S	S	*	*			trans	-109.1	74.2	174.7	-86	0	0	0	0	113.3	V21	V21-C25 PolarHBondContact O-N 3.36Å
26	P	48.3	Very low	53.9	Low	98 Å²	98	117 Å²	117	64%	0.636	63%	0.625	S	S	*	*			trans	-130.7	56.3	132.4	39	-29.7	0	0	0	111.9
27	L	49.2	Very low	53.7	Low	152 Å²	152	115 Å²	115	80%	0.796	62%	0.618	S	S	*	*			trans	-109.8	42.1	156.4	-68.9	179.5	0	0	0	110.9	V29	L27-V29 PolarHBondContact O-N 3.37Å
28	F	46.4	Very low	53.4	Low	181 Å²	181	112.1 Å²	112.1	79%	0.794	62%	0.616	S	S	*	*			trans	-67	88.9	144	-77.1	-75.1	0	0	0	106.1	S30	F28-S30 PolarHBondContact O-N 3.19Å
29	V	47.4	Very low	53.1	Low	118 Å²	118	113.2 Å²	113.2	72%	0.715	62%	0.623	S	S	*	*			trans	-56.8	107.7	164.8	176	0	0	0	0	105.3	L27 A31	L27-V29 PolarHBondContact O-N 3.37Å; V29-A31 PolarHBondContact O-N 3.49Å
30	S	49.1	Very low	53.2	Low	87 Å²	87	113.3 Å²	113.3	61%	0.608	62%	0.616	S	S	*	*			trans	-70.7	77.2	173.8	-47.6	0	0	0	0	107.7	F28 F32	F28-S30 PolarHBondContact O-N 3.19Å; S30-F32 VanDerWaalsContact CB-CE2 3.42Å; S30-F32 VanDerWaalsContact O-CD2 3.31Å; S30-F32 WeakPolarHBondContact O-CD2 3.47Å; S30-F32 PolarHBondContact O-N 3.02Å
31	A	49.5	Very low	53.2	Low	81 Å²	81	116 Å²	116	67%	0.669	63%	0.628	S	S	*	*			trans	-68.4	76.2	170.8	0	0	0	0	0	107.8	V29 L33	V29-A31 PolarHBondContact O-N 3.49Å; A31-L33 PolarHBondContact O-N 2.92Å
32	F	53.1	Low	53.7	Low	159 Å²	159	114.8 Å²	114.8	70%	0.697	62%	0.615	S	S	*	*			trans	-68	91.5	165.5	-71.7	-77.6	0	0	0	106.9	S30 N34	S30-F32 VanDerWaalsContact CB-CE2 3.42Å; S30-F32 VanDerWaalsContact O-CD2 3.31Å; S30-F32 WeakPolarHBondContact O-CD2 3.47Å; S30-F32 PolarHBondContact O-N 3.02Å; F32-N34 PolarHBondContact O-N 3.08Å; F32-N34 VanDerWaalsContact O-N 3.11Å
33	L	45.8	Very low	54.7	Low	133 Å²	133	113.6 Å²	113.6	70%	0.696	60%	0.6	S	S	*	*			trans	-55.1	116.7	160.8	-71.7	174.1	0	0	0	106.8	A31 L35 L38	A31-L33 PolarHBondContact O-N 2.92Å; L33-L35 PolarHBondContact O-N 3.04Å; L33-L35 VanDerWaalsContact O-N 3.12Å; L33-L38 HydrophobicContact CB-CD1 4.26Å
34	N	51.2	Low	56	Low	76 Å²	76	107.6 Å²	107.6	41%	0.406	57%	0.572	S	S	.	*			trans	-76.7	98.4	175.3	-179.3	13	0	0	0	107.2	F32 E36 E37 L38	F32-N34 PolarHBondContact O-N 3.08Å; F32-N34 VanDerWaalsContact O-N 3.11Å; N34-E36 PolarHBondContact O-N 3.32Å; N34-E36 VanDerWaalsContact O-N 3.16Å; N34-E36 PolarHBondContact OD1-N 3.43Å; N34-E37 HydrophobicContact CB-CB 3.9Å; N34-E37 WeakPolarHBondContact ND2-CB 3.42Å; N34-E37 PolarHBondContact O-N 3.3Å; N34-L38 PolarHBondContact O-N 3.24Å; N34-L38 VanDerWaalsContact O-N 3.15Å
35	L	56	Low	57.5	Low	135 Å²	135	106.8 Å²	106.8	71%	0.707	57%	0.567	S	S	*	*	H	α-helix	trans	-56.9	-29.9	-179.4	-90.9	75.6	0	0	0	112	L33 L38 N39	L33-L35 PolarHBondContact O-N 3.04Å; L33-L35 VanDerWaalsContact O-N 3.12Å; L35-L38 PolarHBondContact O-N 3.49Å; L35-N39 WeakPolarHBondContact O-CB 3.37Å; L35-N39 PolarHBondContact O-N 2.92Å; L35-N39 VanDerWaalsContact O-N 3.08Å
36	E	54.6	Low	59.3	Low	98 Å²	98	106.6 Å²	106.6	46%	0.458	56%	0.558	S	S	.	*	H	α-helix	trans	-69.8	-34.4	176.5	-152.6	66.5	-114.6	0	0	112.1	N34 L38 N39 E40 L171	N34-E36 PolarHBondContact O-N 3.32Å; N34-E36 VanDerWaalsContact O-N 3.16Å; N34-E36 PolarHBondContact OD1-N 3.43Å; E36-L38 VanDerWaalsContact C-N 3.33Å; E36-N39 CarbonylContact O-C 3.59Å; E36-N39 PolarHBondContact O-N 2.92Å; E36-N39 VanDerWaalsContact O-N 3.14Å; E36-N39 PolarHBondContact OE1-ND2 3.19Å; E36-E40 PolarHBondContact O-N 3.14Å; E36-L171 HydrophobicContact CB-CD2 4.48Å; E36-L171 HydrophobicContact CG-CD2 4.48Å
37	E	56.2	Low	61.3	Low	101 Å²	101	103.2 Å²	103.2	47%	0.472	53%	0.534	S	S	.	.	H	α-helix	trans	-75.9	-22.8	176.1	176.3	158.3	-139.8	0	0	113	N34 N39 K42	N34-E37 HydrophobicContact CB-CB 3.9Å; N34-E37 WeakPolarHBondContact ND2-CB 3.42Å; N34-E37 PolarHBondContact O-N 3.3Å; E37-N39 VanDerWaalsContact C-N 3.33Å; E37-K42 IonicContact OE1-NZ 3.34Å; E37-K42 PolarHBondContact OE1-NZ 3.45Å
38	L	56.4	Low	63.2	Low	128 Å²	128	99 Å²	99	67%	0.67	51%	0.512	S	S	*	.	H	α-helix	trans	-76.5	-21.8	166.8	-74.4	161.5	0	0	0	112.4	L33 N34 L35 E36	L33-L38 HydrophobicContact CB-CD1 4.26Å; N34-L38 PolarHBondContact O-N 3.24Å; N34-L38 VanDerWaalsContact O-N 3.15Å; L35-L38 PolarHBondContact O-N 3.49Å; E36-L38 VanDerWaalsContact C-N 3.33Å
39	N	54.6	Low	65.1	Low	116 Å²	116	93.3 Å²	93.3	62%	0.62	50%	0.495	S	S	*	.	H	α-helix	trans	-93.8	-28.1	-178.8	-163.2	42.6	0	0	0	112.4	L35 E36 E37 M41	L35-N39 WeakPolarHBondContact O-CB 3.37Å; L35-N39 PolarHBondContact O-N 2.92Å; L35-N39 VanDerWaalsContact O-N 3.08Å; E36-N39 CarbonylContact O-C 3.59Å; E36-N39 PolarHBondContact O-N 2.92Å; E36-N39 VanDerWaalsContact O-N 3.14Å; E36-N39 PolarHBondContact OE1-ND2 3.19Å; E37-N39 VanDerWaalsContact C-N 3.33Å; N39-M41 PolarHBondContact O-N 3.41Å; N39-M41 VanDerWaalsContact O-N 3.09Å
40	E	61.7	Low	67	Low	75 Å²	75	91.5 Å²	91.5	35%	0.35	48%	0.481	S	S	.	.	S	Bend	trans	-66.9	101.1	168.7	-77	-174.4	162.8	0	0	110.3	E36 K42 R173	E36-E40 PolarHBondContact O-N 3.14Å; E40-K42 VanDerWaalsContact C-N 3.29Å; E40-K42 HydrophobicContact CB-CG 4.41Å; E40-K42 PolarHBondContact O-N 3.47Å; E40-K42 WeakPolarHBondContact OE2-CE 3.47Å; E40-K42 IonicContact OE2-NZ 3.86Å; E40-R173 IonicContact OE1-CZ 3.44Å; E40-R173 IonicContact OE1-NH2 2.64Å; E40-R173 PolarHBondContact OE1-NH2 3.17Å
41	M	59.2	Low	68.9	Low	157 Å²	157	87.9 Å²	87.9	77%	0.773	46%	0.456	S	S	*	.			trans	-67.5	81.1	172.7	-68.1	-171.8	-177.9	0	0	111.6	N39 Y43 P242	N39-M41 PolarHBondContact O-N 3.41Å; N39-M41 VanDerWaalsContact O-N 3.09Å; M41-Y43 VanDerWaalsContact C-N 3.3Å; M41-Y43 PolarHBondContact O-N 3.04Å; M41-P242 HydrophobicContact CB-CG 4.47Å; M41-P242 WeakPolarHBondContact O-CB 3.46Å; M41-P242 WeakPolarHBondContact O-CG 3.34Å
42	K	68	Low	70.8	Confident	70 Å²	70	85 Å²	85	30%	0.304	43%	0.43	S	S	.	.			trans	-69.9	-25.2	-179.7	-65	176.7	-172	-173.7	0	113.4	E37 E40 Q243	E37-K42 IonicContact OE1-NZ 3.34Å; E37-K42 PolarHBondContact OE1-NZ 3.45Å; E40-K42 VanDerWaalsContact C-N 3.29Å; E40-K42 HydrophobicContact CB-CG 4.41Å; E40-K42 PolarHBondContact O-N 3.47Å; E40-K42 WeakPolarHBondContact OE2-CE 3.47Å; E40-K42 IonicContact OE2-NZ 3.86Å; K42-Q243 PolarHBondContact O-N 3.22Å
43	Y	79	Confident	72.3	Confident	75 Å²	75	79.9 Å²	79.9	29%	0.294	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.4	-176	-57.3	-75.9	0	0	0	111.4	M41 P78 A81 Q243 I245	M41-Y43 VanDerWaalsContact C-N 3.3Å; M41-Y43 PolarHBondContact O-N 3.04Å; Y43-P78 HydrophobicContact CD1-CG 4.06Å; Y43-P78 HydrophobicContact CE1-CB 4.31Å; Y43-P78 HydrophobicContact CE1-CG 3.94Å; Y43-A81 HydrophobicContact CE1-CB 4.18Å; Y43-Q243 WeakPolarHBondContact CA-O 3.48Å; Y43-Q243 HydrophobicContact CD1-CB 3.82Å; Y43-Q243 HydrophobicContact CE1-CB 4.1Å; Y43-I245 HydrophobicContact CD1-CD1 4.32Å; Y43-I245 HydrophobicContact CD1-CG1 4.33Å; Y43-I245 HydrophobicContact CG-CD1 4.14Å
44	G	83	Confident	74.1	Confident	14 Å²	14	77.9 Å²	77.9	14%	0.144	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.5	171.4	0	0	0	0	0	110.1	Q243 G244 I245	G44-Q243 PolarHBondContact N-O 2.81Å; G44-G244 CarbonylContact O-C 3.49Å; G44-G244 WeakPolarHBondContact O-CA 3.33Å; G44-I245 PolarHBondContact O-N 3.44Å
45	I	86.9	Confident	75.1	Confident	102 Å²	102	76 Å²	76	52%	0.523	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	136.3	178.2	-58.4	174.4	0	0	0	109.2	I47	I45-I47 HydrophobicContact CG2-CG1 4.11Å
46	Q	88.8	Confident	75.8	Confident	83 Å²	83	76.6 Å²	76.6	39%	0.388	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118	172.3	-63.5	-178.8	11.8	0	0	108.3	I245 C247	Q46-I245 PolarHBondContact N-O 3.01Å; Q46-C247 PolarHBondContact O-N 3.41Å
47	I	90.9	Very high	76.2	Confident	26 Å²	26	74.1 Å²	74.1	13%	0.133	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116	176.2	-52	175.5	0	0	0	106.9	I45 Y73 C247 L640 N643 Y644	I45-I47 HydrophobicContact CG2-CG1 4.11Å; I47-Y73 HydrophobicContact CG2-CD1 4.12Å; I47-Y73 HydrophobicContact CG2-CE1 3.62Å; I47-C247 WeakPolarHBondContact CA-O 3.28Å; I47-C247 HydrophobicContact CG1-CB 4.46Å; I47-L640 HydrophobicContact CB-CD2 4.05Å; I47-L640 HydrophobicContact CG1-CD2 4.23Å; I47-N643 HydrophobicContact CB-CB 4.18Å; I47-N643 HydrophobicContact CG2-CB 3.81Å; I47-N643 PolarHBondContact O-ND2 3.45Å; I47-Y644 HydrophobicContact CD1-CD2 4Å; I47-Y644 HydrophobicContact CD1-CG 4.45Å
48	L	89.3	Confident	76.4	Confident	64 Å²	64	78.6 Å²	78.6	34%	0.335	41%	0.406	S	S	.	.			trans	-90.4	158.1	177.6	-57.1	-178.1	0	0	0	110.9	V246 C247 Q248 P249	L48-V246 HydrophobicContact CD1-CG1 3.6Å; L48-V246 HydrophobicContact CG-CG1 3.99Å; L48-C247 PolarHBondContact N-O 3.48Å; L48-Q248 HydrophobicContact CB-CG 4.32Å; L48-Q248 HydrophobicContact CD1-CG 4.09Å; L48-P249 WeakPolarHBondContact O-CD 3.48Å
49	S	85.8	Confident	76.8	Confident	61 Å²	61	75.9 Å²	75.9	43%	0.427	40%	0.395	S	S	.	.	S	Bend	trans	-71.5	-32.6	170.2	47.2	0	0	0	0	112.8	P51	S49-P51 WeakPolarHBondContact O-CD 3.45Å
50	D	87.6	Confident	77.3	Confident	81 Å²	81	77.5 Å²	77.5	43%	0.433	40%	0.399	S	S	.	.	S	Bend	trans	-84.1	119	-160.7	-57.2	-16.7	0	0	0	111.1	Q248	D50-Q248 PolarHBondContact O-NE2 2.84Å
51	P	89.5	Confident	78	Confident	11 Å²	11	78 Å²	78	7%	0.071	40%	0.401	C	S	.	.			trans	-75.6	160.9	-172.1	30.5	-35	0	0	0	113.1	S49 P249 L251 Y256 Y259	S49-P51 WeakPolarHBondContact O-CD 3.45Å; P51-P249 CarbonylContact C-O 3.57Å; P51-P249 WeakPolarHBondContact CA-O 3.42Å; P51-P249 HydrophobicContact CB-CB 4.22Å; P51-P249 WeakPolarHBondContact CB-O 3.46Å; P51-L251 HydrophobicContact CB-CB 4.48Å; P51-L251 HydrophobicContact CB-CD1 3.42Å; P51-L251 VanDerWaalsContact CB-CD1 3.42Å; P51-L251 HydrophobicContact CB-CG 3.63Å; P51-L251 HydrophobicContact CG-CD1 3.78Å; P51-Y256 HydrophobicContact CB-CD2 4.45Å; P51-Y256 HydrophobicContact CG-CD2 4.21Å; P51-Y256 HydrophobicContact CG-CE2 4.32Å; P51-Y256 WeakPolarHBondContact O-CE2 3.41Å; P51-Y259 VanDerWaalsContact CD-CZ 3.44Å; P51-Y259 HydrophobicContact CG-CD1 3.63Å; P51-Y259 HydrophobicContact CG-CD2 3.75Å; P51-Y259 HydrophobicContact CG-CE1 3.8Å; P51-Y259 HydrophobicContact CG-CE2 3.89Å; P51-Y259 HydrophobicContact CG-CG 3.61Å
52	V	88.9	Confident	79.1	Confident	21 Å²	21	72.1 Å²	72.1	13%	0.127	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	152.3	173.9	-65.3	0	0	0	0	111.2	L54 E74 Q248 P249 L251	V52-L54 PolarHBondContact O-N 3.23Å; V52-E74 HydrophobicContact CG2-CB 3.73Å; V52-E74 HydrophobicContact CG2-CG 4.42Å; V52-Q248 HydrophobicContact CG1-CB 3.96Å; V52-Q248 HydrophobicContact CG1-CG 4.37Å; V52-Q248 HydrophobicContact CG2-CB 4.01Å; V52-P249 PolarHBondContact N-O 2.71Å; V52-L251 PolarHBondContact O-N 3.44Å
53	I	85.8	Confident	80	Confident	50 Å²	50	73.4 Å²	73.4	26%	0.256	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	119.8	178	-56.2	175.5	0	0	0	109.4	G55 Q56 A253 Y256	I53-G55 PolarHBondContact O-N 3.31Å; I53-Q56 WeakPolarHBondContact O-CB 3.45Å; I53-Q56 PolarHBondContact O-N 3.16Å; I53-A253 HydrophobicContact CG2-CB 4.3Å; I53-Y256 HydrophobicContact CD1-CD1 3.68Å; I53-Y256 HydrophobicContact CD1-CE1 3.98Å; I53-Y256 HydrophobicContact CD1-CG 4.09Å; I53-Y256 HydrophobicContact CG1-CD1 3.68Å; I53-Y256 HydrophobicContact CG1-CD2 3.88Å; I53-Y256 HydrophobicContact CG1-CE1 4.13Å; I53-Y256 HydrophobicContact CG1-CE2 4.32Å; I53-Y256 HydrophobicContact CG1-CG 3.54Å
54	L	83.2	Confident	80.4	Confident	92 Å²	92	74.1 Å²	74.1	48%	0.482	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	119.2	-175.4	-174.5	147.1	0	0	0	112.5	V52 M64 L72 A250 L251	V52-L54 PolarHBondContact O-N 3.23Å; L54-M64 HydrophobicContact CD1-CE 4.43Å; L54-L72 HydrophobicContact CD1-CD1 4.07Å; L54-A250 HydrophobicContact CB-CB 4.45Å; L54-A250 HydrophobicContact CD1-CB 4.34Å; L54-L251 WeakPolarHBondContact CB-O 3.41Å; L54-L251 PolarHBondContact N-O 3.34Å
55	G	70.8	Confident	80.7	Confident	36 Å²	36	76.5 Å²	76.5	37%	0.371	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	12.6	172.5	0	0	0	0	0	115.7	I53 T57	I53-G55 PolarHBondContact O-N 3.31Å; G55-T57 VanDerWaalsContact C-N 3.33Å
56	Q	70.7	Confident	80.9	Confident	147 Å²	147	75.3 Å²	75.3	69%	0.687	40%	0.401	S	S	*	.	S	Bend	trans	-68.1	-32.5	172.4	-173.6	173	-5.3	0	0	112.1	I53	I53-Q56 WeakPolarHBondContact O-CB 3.45Å; I53-Q56 PolarHBondContact O-N 3.16Å
57	T	64.3	Low	80.9	Confident	47 Å²	47	71.8 Å²	71.8	29%	0.288	39%	0.385	S	S	.	.			trans	-105.9	123.1	172.3	74.6	0	0	0	0	110.6	G55 E74	G55-T57 VanDerWaalsContact C-N 3.33Å; T57-E74 PolarHBondContact OG1-OE1 3.43Å; T57-E74 VanDerWaalsContact OG1-OE1 3.05Å
58	K	60.8	Low	80.8	Confident	195 Å²	195	77.3 Å²	77.3	85%	0.848	41%	0.408	S	S	*	.			trans	-117.9	68.3	175.2	-70.9	-176.1	-178.7	175.9	0	109.5
59	T	64.8	Low	80.7	Confident	70 Å²	70	77.3 Å²	77.3	43%	0.429	40%	0.404	S	S	.	.			trans	-103.5	153.5	170.9	56.3	0	0	0	0	109.7	E61 V62	T59-E61 PolarHBondContact O-N 3.14Å; T59-E61 VanDerWaalsContact O-N 3.1Å; T59-V62 PolarHBondContact O-N 2.9Å; T59-V62 WeakPolarHBondContact OG1-CG2 3.43Å
60	E	64.8	Low	80.7	Confident	151 Å²	151	83 Å²	83	71%	0.706	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-6.3	172.8	-60.1	-175.5	169.2	0	0	112.5	V82 Q86	E60-V82 HydrophobicContact CB-CG1 4.3Å; E60-Q86 PolarHBondContact OE2-NE2 2.66Å
61	E	75	Confident	80.7	Confident	85 Å²	85	79.8 Å²	79.8	40%	0.397	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-4	180	-56.4	175.7	150.3	0	0	113	T59 L77 V82	T59-E61 PolarHBondContact O-N 3.14Å; T59-E61 VanDerWaalsContact O-N 3.1Å; E61-L77 PolarHBondContact O-N 3.32Å; E61-V82 HydrophobicContact CB-CG2 4.38Å; E61-V82 HydrophobicContact CG-CG2 4.1Å
62	V	83.9	Confident	80.7	Confident	33 Å²	33	82.9 Å²	82.9	20%	0.2	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.1	-177	169.8	0	0	0	0	111.4	T59 M64 E74 R76	T59-V62 PolarHBondContact O-N 2.9Å; T59-V62 WeakPolarHBondContact OG1-CG2 3.43Å; V62-M64 HydrophobicContact CG1-SD 4.41Å; V62-E74 HydrophobicContact CG1-CG 3.44Å; V62-E74 VanDerWaalsContact CG1-CG 3.44Å; V62-R76 HydrophobicContact CG2-CG 4.17Å
63	M	86.7	Confident	80.8	Confident	98 Å²	98	82.3 Å²	82.3	48%	0.483	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131.4	174.7	178.8	177	-77.3	0	0	110.3	V65 C75 L77	M63-V65 HydrophobicContact CG-CG2 4.08Å; M63-V65 HydrophobicContact SD-CG2 4.32Å; M63-C75 PolarHBondContact N-O 2.88Å; M63-C75 WeakPolarHBondContact O-CB 3.27Å; M63-C75 PolarHBondContact O-N 3.19Å; M63-L77 HydrophobicContact CB-CD1 4.12Å; M63-L77 HydrophobicContact CB-CG 4.38Å; M63-L77 HydrophobicContact CE-CD1 4.02Å
64	M	87.3	Confident	81.1	Confident	89 Å²	89	80.1 Å²	80.1	44%	0.438	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.8	173.2	-60	-54.7	-59.2	0	0	110.6	L54 V62 Y73 E74 A250	L54-M64 HydrophobicContact CD1-CE 4.43Å; V62-M64 HydrophobicContact CG1-SD 4.41Å; M64-Y73 WeakPolarHBondContact CA-O 3.3Å; M64-Y73 WeakPolarHBondContact CE-O 3.43Å; M64-E74 HydrophobicContact CE-CB 4.35Å; M64-E74 HydrophobicContact SD-CB 4.11Å; M64-E74 HydrophobicContact SD-CG 4.13Å; M64-A250 HydrophobicContact CE-CB 3.6Å
65	V	89.8	Confident	81.5	Confident	65 Å²	65	76 Å²	76	39%	0.394	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.3	179	-172.9	0	0	0	0	109.3	M63 Y73 C75	M63-V65 HydrophobicContact CG-CG2 4.08Å; M63-V65 HydrophobicContact SD-CG2 4.32Å; V65-Y73 PolarHBondContact N-O 3Å; V65-Y73 PolarHBondContact O-N 3.12Å; V65-C75 HydrophobicContact CG2-CB 4.4Å
66	S	89.9	Confident	82.3	Confident	76 Å²	76	79.6 Å²	79.6	53%	0.531	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.9	172.9	58.6	0	0	0	0	110.6	Q71	S66-Q71 WeakPolarHBondContact CA-O 3.24Å
67	N	88.8	Confident	83	Confident	10 Å²	10	74.4 Å²	74.4	5%	0.053	36%	0.362	C	S	.	.			trans	-74.7	174.8	171.4	74.8	0.8	0	0	0	111.6	Y69 K70 Q71 Y73 Y644	N67-Y69 PolarHBondContact O-N 3.08Å; N67-Y69 VanDerWaalsContact O-N 3.15Å; N67-Y69 VanDerWaalsContact OD1-C 3.22Å; N67-Y69 WeakPolarHBondContact OD1-CA 2.76Å; N67-Y69 WeakPolarHBondContact OD1-CB 3.48Å; N67-Y69 PolarHBondContact OD1-N 2.83Å; N67-K70 PolarHBondContact O-N 3.43Å; N67-K70 PolarHBondContact OD1-N 3.1Å; N67-Q71 PolarHBondContact N-O 3.46Å; N67-Q71 WeakPolarHBondContact OD1-CB 3.46Å; N67-Q71 PolarHBondContact OD1-N 3.27Å; N67-Q71 PolarHBondContact OD1-O 3.1Å; N67-Y73 HydrophobicContact CB-CD2 4.48Å; N67-Y73 HydrophobicContact CB-CE2 3.93Å; N67-Y644 HydrophobicContact CB-CD2 4.04Å; N67-Y644 HydrophobicContact CB-CE1 4.43Å; N67-Y644 HydrophobicContact CB-CE2 3.5Å; N67-Y644 VanDerWaalsContact CB-CE2 3.5Å; N67-Y644 PolarHBondContact ND2-O 3.48Å
68	K	89.7	Confident	83.8	Confident	142 Å²	142	73.2 Å²	73.2	62%	0.617	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.5	177	71.5	-178.1	-173.7	178.8	0	113.8	Y644	K68-Y644 HydrophobicContact CD-CE1 4.2Å; K68-Y644 HydrophobicContact CG-CE1 4.07Å; K68-Y644 PolarHBondContact N-OH 3.48Å; K68-Y644 VanDerWaalsContact N-OH 3.13Å
69	Y	87.4	Confident	84.2	Confident	63 Å²	63	65.4 Å²	65.4	25%	0.247	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	7.4	178	-53	-81.1	0	0	0	113.3	N67 Q71 Y644 R645 V647	N67-Y69 PolarHBondContact O-N 3.08Å; N67-Y69 VanDerWaalsContact O-N 3.15Å; N67-Y69 VanDerWaalsContact OD1-C 3.22Å; N67-Y69 WeakPolarHBondContact OD1-CA 2.76Å; N67-Y69 WeakPolarHBondContact OD1-CB 3.48Å; N67-Y69 PolarHBondContact OD1-N 2.83Å; Y69-Q71 PolarHBondContact O-N 3.42Å; Y69-Y644 HydrophobicContact CE2-CD1 4.49Å; Y69-Y644 HydrophobicContact CE2-CE1 4.29Å; Y69-R645 HydrophobicContact CE2-CB 4.33Å; Y69-R645 HydrophobicContact CE2-CG 4.14Å; Y69-V647 VanDerWaalsContact CB-CG2 3.45Å; Y69-V647 HydrophobicContact CG-CG2 3.98Å
70	K	85.8	Confident	84.3	Confident	181 Å²	181	66.6 Å²	66.6	79%	0.787	33%	0.328	S	S	*	.			trans	65.9	7.5	-178	-47.7	168.1	-172.4	158.5	0	115.6	N67 L72	N67-K70 PolarHBondContact O-N 3.43Å; N67-K70 PolarHBondContact OD1-N 3.1Å; K70-L72 PolarHBondContact O-N 3.09Å
71	Q	87.1	Confident	84.2	Confident	14 Å²	14	60.5 Å²	60.5	7%	0.065	30%	0.303	C	S	.	.			trans	-63.8	128.7	165.4	177.9	59.9	56.1	0	0	108.5	S66 N67 Y69 Y73	S66-Q71 WeakPolarHBondContact CA-O 3.24Å; N67-Q71 PolarHBondContact N-O 3.46Å; N67-Q71 WeakPolarHBondContact OD1-CB 3.46Å; N67-Q71 PolarHBondContact OD1-N 3.27Å; N67-Q71 PolarHBondContact OD1-O 3.1Å; Y69-Q71 PolarHBondContact O-N 3.42Å; Q71-Y73 HydrophobicContact CB-CE2 3.87Å; Q71-Y73 HydrophobicContact CG-CD2 4.26Å; Q71-Y73 HydrophobicContact CG-CE2 3.5Å; Q71-Y73 VanDerWaalsContact CG-CE2 3.5Å; Q71-Y73 WeakPolarHBondContact O-CD2 3.43Å
72	L	90.1	Very high	83.6	Confident	75 Å²	75	57.6 Å²	57.6	39%	0.393	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	145.4	176.5	-71.6	167.1	0	0	0	110.3	L54 K70 A250	L54-L72 HydrophobicContact CD1-CD1 4.07Å; K70-L72 PolarHBondContact O-N 3.09Å; L72-A250 HydrophobicContact CB-CB 4.19Å; L72-A250 PolarHBondContact O-N 3.34Å
73	Y	91	Very high	82.4	Confident	9 Å²	9	64.4 Å²	64.4	4%	0.035	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.1	177.4	-69.2	-96.1	0	0	0	110.1	I47 M64 V65 N67 Q71 Q248 P249 N643 F646	I47-Y73 HydrophobicContact CG2-CD1 4.12Å; I47-Y73 HydrophobicContact CG2-CE1 3.62Å; M64-Y73 WeakPolarHBondContact CA-O 3.3Å; M64-Y73 WeakPolarHBondContact CE-O 3.43Å; V65-Y73 PolarHBondContact N-O 3Å; V65-Y73 PolarHBondContact O-N 3.12Å; N67-Y73 HydrophobicContact CB-CD2 4.48Å; N67-Y73 HydrophobicContact CB-CE2 3.93Å; Q71-Y73 HydrophobicContact CB-CE2 3.87Å; Q71-Y73 HydrophobicContact CG-CD2 4.26Å; Q71-Y73 HydrophobicContact CG-CE2 3.5Å; Q71-Y73 VanDerWaalsContact CG-CE2 3.5Å; Q71-Y73 WeakPolarHBondContact O-CD2 3.43Å; Y73-Q248 CarbonylContact C-O 3.56Å; Y73-Q248 WeakPolarHBondContact CA-O 3.27Å; Y73-P249 HydrophobicContact CD1-CG 4.32Å; Y73-P249 HydrophobicContact CE1-CB 4.28Å; Y73-P249 HydrophobicContact CE1-CG 3.81Å; Y73-N643 PolarHBondContact OH-O 3.33Å; Y73-F646 PolarHBondContact OH-O 3.31Å
74	E	91.3	Very high	80.8	Confident	4 Å²	4	66.6 Å²	66.6	2%	0.019	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	111	167.1	-171.9	178.2	113.4	0	0	107.6	V52 T57 V62 M64 R76 C247 Q248 A250	V52-E74 HydrophobicContact CG2-CB 3.73Å; V52-E74 HydrophobicContact CG2-CG 4.42Å; T57-E74 PolarHBondContact OG1-OE1 3.43Å; T57-E74 VanDerWaalsContact OG1-OE1 3.05Å; V62-E74 HydrophobicContact CG1-CG 3.44Å; V62-E74 VanDerWaalsContact CG1-CG 3.44Å; M64-E74 HydrophobicContact CE-CB 4.35Å; M64-E74 HydrophobicContact SD-CB 4.11Å; M64-E74 HydrophobicContact SD-CG 4.13Å; E74-R76 IonicContact OE1-NE 3.68Å; E74-R76 IonicContact OE1-NH2 3.93Å; E74-R76 PolarHBondContact OE1-NH2 2.78Å; E74-C247 WeakPolarHBondContact O-CA 3.48Å; E74-Q248 PolarHBondContact N-O 2.93Å; E74-Q248 PolarHBondContact O-N 3.42Å; E74-A250 HydrophobicContact CB-CB 4.33Å
75	C	90.9	Very high	78.9	Confident	7 Å²	7	70.8 Å²	70.8	5%	0.047	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.1	179.4	-65.4	0	0	0	0	110.8	M63 V65 I245 V246 C247	M63-C75 PolarHBondContact N-O 2.88Å; M63-C75 WeakPolarHBondContact O-CB 3.27Å; M63-C75 PolarHBondContact O-N 3.19Å; V65-C75 HydrophobicContact CG2-CB 4.4Å; C75-I245 HydrophobicContact CB-CG2 4.25Å; C75-V246 CarbonylContact C-O 3.49Å; C75-V246 WeakPolarHBondContact CA-O 3.29Å; C75-C247 HydrophobicContact CB-CB 4.16Å; C75-C247 WeakPolarHBondContact CB-SG 3.38Å; C75-C247 WeakPolarHBondContact SG-CB 3.42Å; C75-C247 CovalentContact SG-SG 2.04Å; C75-C247 PolarHBondContact SG-SG 2.92Å
76	R	88.4	Confident	76.8	Confident	110 Å²	110	73.9 Å²	73.9	42%	0.415	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	120.4	176.9	-65.3	-175.9	-178.3	170	7.3	110.4	V62 E74 V246	V62-R76 HydrophobicContact CG2-CG 4.17Å; E74-R76 IonicContact OE1-NE 3.68Å; E74-R76 IonicContact OE1-NH2 3.93Å; E74-R76 PolarHBondContact OE1-NH2 2.78Å; R76-V246 PolarHBondContact N-O 2.88Å; R76-V246 PolarHBondContact O-N 3.18Å
77	L	85.7	Confident	74.2	Confident	39 Å²	39	75.5 Å²	75.5	20%	0.204	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-90.9	136.7	177.8	-63.2	176.4	0	0	0	110.1	E61 M63 A81 V82 I245	E61-L77 PolarHBondContact O-N 3.32Å; M63-L77 HydrophobicContact CB-CD1 4.12Å; M63-L77 HydrophobicContact CB-CG 4.38Å; M63-L77 HydrophobicContact CE-CD1 4.02Å; L77-A81 HydrophobicContact CB-CB 4.41Å; L77-V82 HydrophobicContact CB-CG2 4.35Å; L77-I245 HydrophobicContact CD2-CD1 3.99Å; L77-I245 HydrophobicContact CD2-CG1 4.21Å; L77-I245 HydrophobicContact CD2-CG2 4.07Å
78	P	81.4	Confident	71.9	Confident	21 Å²	21	81 Å²	81	14%	0.136	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-57.1	142	171.6	-25.7	34.7	0	0	0	111.9	Y43 Q80 A81 Q243	Y43-P78 HydrophobicContact CD1-CG 4.06Å; Y43-P78 HydrophobicContact CE1-CB 4.31Å; Y43-P78 HydrophobicContact CE1-CG 3.94Å; P78-Q80 PolarHBondContact O-N 3.31Å; P78-A81 WeakPolarHBondContact O-CA 3.48Å; P78-A81 VanDerWaalsContact O-CB 3.27Å; P78-A81 WeakPolarHBondContact O-CB 3.35Å; P78-A81 PolarHBondContact O-N 3.06Å; P78-Q243 HydrophobicContact CB-CB 4.38Å; P78-Q243 VanDerWaalsContact CB-OE1 3.22Å; P78-Q243 HydrophobicContact CG-CB 3.77Å
79	A	69.3	Low	69.6	Low	32 Å²	32	78.2 Å²	78.2	26%	0.264	39%	0.391	S	S	.	.	H	α-helix	trans	-55.4	-25.4	-177.9	0	0	0	0	0	114	R83	A79-R83 PolarHBondContact O-N 3.28Å
80	Q	65.9	Low	67.3	Low	95 Å²	95	79.8 Å²	79.8	44%	0.444	41%	0.411	S	S	.	.	H	α-helix	trans	-64.8	-39.8	172.3	-64.9	78.5	7.1	0	0	112.2	P78 V82 R83 F84	P78-Q80 PolarHBondContact O-N 3.31Å; Q80-V82 VanDerWaalsContact C-N 3.33Å; Q80-V82 PolarHBondContact O-N 3.3Å; Q80-R83 PolarHBondContact O-N 3.43Å; Q80-F84 WeakPolarHBondContact O-CD2 3.34Å; Q80-F84 VanDerWaalsContact O-CE2 3.28Å; Q80-F84 WeakPolarHBondContact O-CE2 3.4Å
81	A	62.9	Low	65.3	Low	22 Å²	22	78 Å²	78	18%	0.182	41%	0.405	C	S	.	.	H	α-helix	trans	-64.9	-36	178.7	0	0	0	0	0	112.1	Y43 L77 P78 F84	Y43-A81 HydrophobicContact CE1-CB 4.18Å; L77-A81 HydrophobicContact CB-CB 4.41Å; P78-A81 WeakPolarHBondContact O-CA 3.48Å; P78-A81 VanDerWaalsContact O-CB 3.27Å; P78-A81 WeakPolarHBondContact O-CB 3.35Å; P78-A81 PolarHBondContact O-N 3.06Å; A81-F84 WeakPolarHBondContact O-CD2 3.36Å
82	V	63	Low	63.2	Low	25 Å²	25	83.4 Å²	83.4	15%	0.152	45%	0.445	C	S	.	.	H	α-helix	trans	-70.1	-33.6	-179.7	-173.4	0	0	0	0	111.9	E60 E61 L77 Q80 F84 H85	E60-V82 HydrophobicContact CB-CG1 4.3Å; E61-V82 HydrophobicContact CB-CG2 4.38Å; E61-V82 HydrophobicContact CG-CG2 4.1Å; L77-V82 HydrophobicContact CB-CG2 4.35Å; Q80-V82 VanDerWaalsContact C-N 3.33Å; Q80-V82 PolarHBondContact O-N 3.3Å; V82-F84 VanDerWaalsContact C-N 3.31Å; V82-F84 PolarHBondContact O-N 3.09Å; V82-H85 PolarHBondContact O-N 2.95Å
83	R	58.1	Low	60.9	Low	176 Å²	176	83.7 Å²	83.7	66%	0.664	45%	0.446	S	S	*	.	H	α-helix	trans	-69.2	-21	-177.7	-74.6	-176.6	179.4	141.7	7.2	114.9	A79 Q80 H85 Q86	A79-R83 PolarHBondContact O-N 3.28Å; Q80-R83 PolarHBondContact O-N 3.43Å; R83-H85 PolarHBondContact O-N 2.67Å; R83-H85 VanDerWaalsContact O-N 3.09Å; R83-Q86 PolarHBondContact O-N 3.49Å; R83-Q86 VanDerWaalsContact O-N 3.14Å
84	F	52.5	Low	59.1	Low	144 Å²	144	87.3 Å²	87.3	63%	0.632	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.8	175.7	-71.4	-83.6	0	0	0	113.8	Q80 A81 V82	Q80-F84 WeakPolarHBondContact O-CD2 3.34Å; Q80-F84 VanDerWaalsContact O-CE2 3.28Å; Q80-F84 WeakPolarHBondContact O-CE2 3.4Å; A81-F84 WeakPolarHBondContact O-CD2 3.36Å; V82-F84 VanDerWaalsContact C-N 3.31Å; V82-F84 PolarHBondContact O-N 3.09Å
85	H	48.8	Very low	57.1	Low	176 Å²	176	94.7 Å²	94.7	82%	0.815	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-11.3	178.4	-75.9	-60.6	0	0	0	115.1	V82 R83	V82-H85 PolarHBondContact O-N 2.95Å; R83-H85 PolarHBondContact O-N 2.67Å; R83-H85 VanDerWaalsContact O-N 3.09Å
86	Q	44.5	Very low	55.3	Low	131 Å²	131	97.5 Å²	97.5	61%	0.612	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-26.1	-172.9	-65.8	-171.5	10.7	0	0	114.5	E60 R83	E60-Q86 PolarHBondContact OE2-NE2 2.66Å; R83-Q86 PolarHBondContact O-N 3.49Å; R83-Q86 VanDerWaalsContact O-N 3.14Å
87	D	35.6	Very low	54.2	Low	109 Å²	109	95.2 Å²	95.2	58%	0.583	53%	0.53	S	S	*	.			trans	-124.9	124.1	177.4	-79.4	-51.4	0	0	0	112.8	A89	D87-A89 VanDerWaalsContact C-N 3.32Å; D87-A89 PolarHBondContact O-N 3.06Å
88	P	41.1	Very low	53.5	Low	127 Å²	127	100.2 Å²	100.2	83%	0.825	56%	0.562	S	S	*	*	S	Bend	trans	-74.6	87.3	170.3	31.7	-32.9	0	0	0	109.7	S90	P88-S90 PolarHBondContact O-N 3.16Å
89	A	41.2	Very low	53.1	Low	83 Å²	83	100.9 Å²	100.9	69%	0.686	57%	0.573	S	S	*	*			trans	43.5	71.7	170.9	0	0	0	0	0	113.9	D87 E91	D87-A89 VanDerWaalsContact C-N 3.32Å; D87-A89 PolarHBondContact O-N 3.06Å; A89-E91 PolarHBondContact O-N 3.31Å
90	S	38.3	Very low	53.7	Low	95 Å²	95	101.5 Å²	101.5	66%	0.664	57%	0.574	S	S	*	*			trans	-57.7	102.4	144.4	41.7	0	0	0	0	106.5	P88 S92	P88-S90 PolarHBondContact O-N 3.16Å; S90-S92 PolarHBondContact O-N 3.09Å; S90-S92 VanDerWaalsContact O-N 3.13Å
91	E	43.7	Very low	54.6	Low	145 Å²	145	100.7 Å²	100.7	68%	0.678	57%	0.573	S	S	*	*			trans	-52.2	123	176.5	-59.6	-168.3	114.1	0	0	107.2	A89 D93	A89-E91 PolarHBondContact O-N 3.31Å; E91-D93 VanDerWaalsContact C-N 3.32Å; E91-D93 VanDerWaalsContact O-CA 3.22Å; E91-D93 WeakPolarHBondContact O-CA 3.43Å; E91-D93 WeakPolarHBondContact O-CB 3.21Å; E91-D93 PolarHBondContact O-N 2.65Å
92	S	42.6	Very low	55.7	Low	127 Å²	127	99.8 Å²	99.8	89%	0.888	57%	0.565	S	S	*	*			trans	-65.5	101	178.3	52	0	0	0	0	107.4	S90 S94	S90-S92 PolarHBondContact O-N 3.09Å; S90-S92 VanDerWaalsContact O-N 3.13Å; S92-S94 PolarHBondContact O-N 3.34Å
93	D	43.7	Very low	56.8	Low	80 Å²	80	99.9 Å²	99.9	43%	0.428	57%	0.566	S	S	.	*			trans	-76.1	130.5	-140.4	-146.1	-31.4	0	0	0	111.5	E91 Q95 G96	E91-D93 VanDerWaalsContact C-N 3.32Å; E91-D93 VanDerWaalsContact O-CA 3.22Å; E91-D93 WeakPolarHBondContact O-CA 3.43Å; E91-D93 WeakPolarHBondContact O-CB 3.21Å; E91-D93 PolarHBondContact O-N 2.65Å; D93-Q95 HydrophobicContact CB-CB 4.15Å; D93-Q95 VanDerWaalsContact CG-CD 3.45Å; D93-Q95 PolarHBondContact O-N 3.49Å; D93-Q95 WeakPolarHBondContact OD1-CG 3.31Å; D93-Q95 PolarHBondContact OD1-N 2.95Å; D93-Q95 PolarHBondContact OD1-NE2 3.1Å; D93-Q95 PolarHBondContact OD2-NE2 2.98Å; D93-G96 PolarHBondContact O-N 3.46Å
94	S	52	Low	58.3	Low	85 Å²	85	95.6 Å²	95.6	59%	0.594	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-64.7	-3.5	169.8	45.2	0	0	0	0	112.7	S92 G96	S92-S94 PolarHBondContact O-N 3.34Å; S94-G96 VanDerWaalsContact C-N 3.28Å; S94-G96 PolarHBondContact O-N 2.68Å
95	Q	49.8	Very low	60	Low	159 Å²	159	89.5 Å²	89.5	74%	0.743	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-75.3	-4	173.9	-65.1	168.8	56	0	0	114.6	D93	D93-Q95 HydrophobicContact CB-CB 4.15Å; D93-Q95 VanDerWaalsContact CG-CD 3.45Å; D93-Q95 PolarHBondContact O-N 3.49Å; D93-Q95 WeakPolarHBondContact OD1-CG 3.31Å; D93-Q95 PolarHBondContact OD1-N 2.95Å; D93-Q95 PolarHBondContact OD1-NE2 3.1Å; D93-Q95 PolarHBondContact OD2-NE2 2.98Å
96	G	51.8	Low	62	Low	67 Å²	67	81.1 Å²	81.1	69%	0.691	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-82.7	-14.9	179.1	0	0	0	0	0	116.4	D93 S94	D93-G96 PolarHBondContact O-N 3.46Å; S94-G96 VanDerWaalsContact C-N 3.28Å; S94-G96 PolarHBondContact O-N 2.68Å
97	Y	66.9	Low	64.1	Low	61 Å²	61	81.8 Å²	81.8	24%	0.239	49%	0.486	C	S	.	.			trans	-96.4	108.1	-174.6	-174.5	-106.9	0	0	0	112.3	G99 P100 Q230 H231 P232	Y97-G99 WeakPolarHBondContact CE1-O 3.48Å; Y97-G99 VanDerWaalsContact CZ-CA 3.4Å; Y97-P100 WeakPolarHBondContact CE1-O 3.25Å; Y97-P100 PolarHBondContact OH-O 3.31Å; Y97-P100 VanDerWaalsContact OH-O 3.09Å; Y97-Q230 WeakPolarHBondContact CE2-O 3.42Å; Y97-H231 AromaticContact CD1-CD2 3.84Å; Y97-H231 AromaticContact CD1-NE2 3.91Å; Y97-H231 AromaticContact CE1-CD2 3.34Å; Y97-H231 WeakPolarHBondContact CE1-CD2 3.34Å; Y97-H231 AromaticContact CE1-NE2 3.85Å; Y97-H231 AromaticContact CZ-CD2 3.79Å; Y97-P232 VanDerWaalsContact CD2-CD 3.45Å; Y97-P232 HydrophobicContact CD2-CG 3.99Å; Y97-P232 HydrophobicContact CG-CG 4.21Å
98	T	69.6	Low	66.7	Low	145 Å²	145	79.7 Å²	79.7	89%	0.89	48%	0.478	S	S	*	.			trans	-99	16.6	174.7	-37	0	0	0	0	112.2
99	G	74.6	Confident	69	Low	34 Å²	34	74.1 Å²	74.1	35%	0.351	44%	0.441	S	S	.	.	S	Bend	trans	-86.2	177.5	-179.6	0	0	0	0	0	113.5	Y97	Y97-G99 WeakPolarHBondContact CE1-O 3.48Å; Y97-G99 VanDerWaalsContact CZ-CA 3.4Å
100	P	81.5	Confident	71.4	Confident	46 Å²	46	74.7 Å²	74.7	30%	0.299	43%	0.429	S	S	.	.			trans	-68	150.7	178	29.4	-36.2	0	0	0	112.8	Y97 E104 L105	Y97-P100 WeakPolarHBondContact CE1-O 3.25Å; Y97-P100 PolarHBondContact OH-O 3.31Å; Y97-P100 VanDerWaalsContact OH-O 3.09Å; P100-E104 HydrophobicContact CB-CB 4.05Å; P100-E104 HydrophobicContact CB-CG 3.75Å; P100-E104 VanDerWaalsContact CB-OE2 3.26Å; P100-E104 WeakPolarHBondContact CB-OE2 3.36Å; P100-L105 HydrophobicContact CG-CD2 3.61Å; P100-L105 HydrophobicContact CG-CG 4.04Å
101	D	83.7	Confident	73.8	Confident	78 Å²	78	79.6 Å²	79.6	42%	0.417	44%	0.438	S	S	.	.			trans	-60.6	154.4	176.4	-101.4	-8.1	0	0	0	111.8	E104 L105 N159	D101-E104 WeakPolarHBondContact O-CA 3.14Å; D101-E104 VanDerWaalsContact O-CB 3.29Å; D101-E104 WeakPolarHBondContact O-CB 3.33Å; D101-E104 PolarHBondContact O-N 3.03Å; D101-L105 PolarHBondContact O-N 3.18Å; D101-L105 VanDerWaalsContact O-N 3.1Å; D101-N159 PolarHBondContact OD2-ND2 3.33Å
102	I	86.2	Confident	75.9	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.01	42%	0.421	C	S	.	.	H	α-helix	trans	-54.4	-45.5	-176	-70.6	161.1	0	0	0	113.8	E104 L105 L106 W158 H175 H231 L234	I102-E104 PolarHBondContact O-N 3.1Å; I102-L105 WeakPolarHBondContact O-CB 3.49Å; I102-L105 PolarHBondContact O-N 3.5Å; I102-L106 HydrophobicContact CG2-CD1 4.26Å; I102-L106 PolarHBondContact O-N 3.2Å; I102-W158 HydrophobicContact CD1-CD2 3.81Å; I102-W158 VanDerWaalsContact CD1-CE2 3.41Å; I102-W158 HydrophobicContact CD1-CG 3.97Å; I102-W158 HydrophobicContact CD1-CZ2 3.92Å; I102-W158 VanDerWaalsContact CD1-NE1 3.25Å; I102-H175 HydrophobicContact CG2-CB 3.68Å; I102-H231 HydrophobicContact CD1-CB 4.48Å; I102-H231 HydrophobicContact CG1-CB 3.99Å; I102-L234 HydrophobicContact CB-CD1 4.36Å; I102-L234 HydrophobicContact CD1-CD1 3.59Å; I102-L234 HydrophobicContact CD1-CD2 4.47Å; I102-L234 HydrophobicContact CD1-CG 3.78Å; I102-L234 HydrophobicContact CG1-CD1 3.74Å; I102-L234 HydrophobicContact CG1-CG 4.36Å; I102-L234 HydrophobicContact CG2-CD1 3.67Å
103	P	86.9	Confident	78.3	Confident	28 Å²	28	74 Å²	74	18%	0.182	42%	0.415	C	S	.	.	H	α-helix	trans	-59.8	-30.9	173.1	-27.5	36.8	0	0	0	113.7	L106 R107 E155	P103-L106 PolarHBondContact O-N 3.29Å; P103-R107 WeakPolarHBondContact O-CG 3.37Å; P103-R107 PolarHBondContact O-N 3.13Å; P103-E155 WeakPolarHBondContact CB-OE1 3.48Å; P103-E155 WeakPolarHBondContact CG-OE1 3.39Å
104	E	88.4	Confident	80.7	Confident	85 Å²	85	72.4 Å²	72.4	40%	0.397	41%	0.409	S	S	.	.	H	α-helix	trans	-72.3	-36.8	177.4	-179.5	161.3	-124.6	0	0	112.5	P100 D101 I102 L106 R107	P100-E104 HydrophobicContact CB-CB 4.05Å; P100-E104 HydrophobicContact CB-CG 3.75Å; P100-E104 VanDerWaalsContact CB-OE2 3.26Å; P100-E104 WeakPolarHBondContact CB-OE2 3.36Å; D101-E104 WeakPolarHBondContact O-CA 3.14Å; D101-E104 VanDerWaalsContact O-CB 3.29Å; D101-E104 WeakPolarHBondContact O-CB 3.33Å; D101-E104 PolarHBondContact O-N 3.03Å; I102-E104 PolarHBondContact O-N 3.1Å; E104-L106 PolarHBondContact O-N 3.21Å; E104-R107 VanDerWaalsContact CD-NH1 3.34Å; E104-R107 PolarHBondContact O-N 3.49Å; E104-R107 IonicContact OE1-CZ 3.12Å; E104-R107 IonicContact OE1-NH1 3.69Å; E104-R107 PolarHBondContact OE1-NH1 3.01Å; E104-R107 IonicContact OE1-NH2 2.88Å
105	L	88.8	Confident	82.8	Confident	16 Å²	16	69.6 Å²	69.6	8%	0.084	39%	0.388	C	S	.	.	H	α-helix	trans	-60	-33	169.2	-68.3	170.8	0	0	0	112.4	P100 D101 I102 P108 Q230 H231	P100-L105 HydrophobicContact CG-CD2 3.61Å; P100-L105 HydrophobicContact CG-CG 4.04Å; D101-L105 PolarHBondContact O-N 3.18Å; D101-L105 VanDerWaalsContact O-N 3.1Å; I102-L105 WeakPolarHBondContact O-CB 3.49Å; I102-L105 PolarHBondContact O-N 3.5Å; L105-P108 WeakPolarHBondContact O-CD 3.44Å; L105-Q230 HydrophobicContact CD1-CB 4.43Å; L105-Q230 HydrophobicContact CD2-CB 4.39Å; L105-H231 HydrophobicContact CD1-CB 4.02Å
106	L	90.5	Very high	84.9	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-87.7	-18.8	-179.4	-67.3	170.9	0	0	0	114.1	I102 P103 E104 P108 M109 Y128 H175 F198 T225 T228	I102-L106 HydrophobicContact CG2-CD1 4.26Å; I102-L106 PolarHBondContact O-N 3.2Å; P103-L106 PolarHBondContact O-N 3.29Å; E104-L106 PolarHBondContact O-N 3.21Å; L106-P108 VanDerWaalsContact C-N 3.29Å; L106-P108 VanDerWaalsContact O-N 3.09Å; L106-M109 HydrophobicContact CD2-SD 3.67Å; L106-M109 VanDerWaalsContact O-CB 3.31Å; L106-M109 WeakPolarHBondContact O-CB 3.42Å; L106-M109 PolarHBondContact O-N 2.63Å; L106-Y128 HydrophobicContact CB-CE2 3.75Å; L106-Y128 VanDerWaalsContact CB-OH 3.26Å; L106-Y128 WeakPolarHBondContact CB-OH 3.45Å; L106-Y128 HydrophobicContact CD1-CE2 4.25Å; L106-Y128 HydrophobicContact CG-CE2 4.44Å; L106-H175 VanDerWaalsContact CD1-CD2 3.48Å; L106-H175 WeakPolarHBondContact CD1-CD2 3.31Å; L106-F198 HydrophobicContact CD1-CB 4.39Å; L106-F198 HydrophobicContact CD1-CD1 4.25Å; L106-F198 HydrophobicContact CD1-CD2 4.06Å; L106-F198 HydrophobicContact CD1-CE2 4.44Å; L106-F198 HydrophobicContact CD1-CG 3.96Å; L106-F198 HydrophobicContact CD2-CD1 3.78Å; L106-F198 HydrophobicContact CD2-CE1 4.23Å; L106-F198 HydrophobicContact CD2-CG 4.2Å; L106-T225 HydrophobicContact CD2-CG2 4.08Å; L106-T228 HydrophobicContact CD1-CG2 4.27Å; L106-T228 HydrophobicContact CD2-CG2 3.73Å; L106-T228 HydrophobicContact CG-CG2 3.99Å
107	R	89.6	Confident	87	Confident	146 Å²	146	66.7 Å²	66.7	55%	0.551	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-46.5	-38.5	177.5	-79	176.9	-163	156.7	11.5	115.3	P103 E104 M109 H110	P103-R107 WeakPolarHBondContact O-CG 3.37Å; P103-R107 PolarHBondContact O-N 3.13Å; E104-R107 VanDerWaalsContact CD-NH1 3.34Å; E104-R107 PolarHBondContact O-N 3.49Å; E104-R107 IonicContact OE1-CZ 3.12Å; E104-R107 IonicContact OE1-NH1 3.69Å; E104-R107 PolarHBondContact OE1-NH1 3.01Å; E104-R107 IonicContact OE1-NH2 2.88Å; R107-M109 PolarHBondContact O-N 3.08Å; R107-H110 VanDerWaalsContact O-CB 3.31Å; R107-H110 WeakPolarHBondContact O-CB 3.41Å; R107-H110 PolarHBondContact O-N 3.45Å; R107-H110 VanDerWaalsContact O-N 3.12Å
108	P	90.1	Very high	88.3	Confident	65 Å²	65	67.4 Å²	67.4	42%	0.422	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-57.1	-30.9	176.6	-27.2	37.1	0	0	0	113.8	L105 L106 H110 K111 A112	L105-P108 WeakPolarHBondContact O-CD 3.44Å; L106-P108 VanDerWaalsContact C-N 3.29Å; L106-P108 VanDerWaalsContact O-N 3.09Å; P108-H110 PolarHBondContact O-N 2.71Å; P108-K111 PolarHBondContact O-N 3.08Å; P108-K111 VanDerWaalsContact O-N 3.11Å; P108-A112 PolarHBondContact O-N 3.03Å
109	M	90.1	Very high	89.3	Confident	9 Å²	9	64.4 Å²	64.4	4%	0.044	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-64.7	-25.1	178.6	-61.3	-176.9	70.1	0	0	112.9	L106 R107 K111 A112 L115 Y128 F198 D206 V223	L106-M109 HydrophobicContact CD2-SD 3.67Å; L106-M109 VanDerWaalsContact O-CB 3.31Å; L106-M109 WeakPolarHBondContact O-CB 3.42Å; L106-M109 PolarHBondContact O-N 2.63Å; R107-M109 PolarHBondContact O-N 3.08Å; M109-K111 PolarHBondContact O-N 2.95Å; M109-A112 PolarHBondContact O-N 3.47Å; M109-A112 VanDerWaalsContact O-N 3.13Å; M109-L115 HydrophobicContact CE-CD1 3.87Å; M109-Y128 HydrophobicContact CB-CD1 4.13Å; M109-Y128 HydrophobicContact CB-CD2 3.99Å; M109-Y128 HydrophobicContact CB-CG 3.69Å; M109-Y128 HydrophobicContact SD-CD2 4.3Å; M109-F198 HydrophobicContact CE-CE1 4.2Å; M109-F198 HydrophobicContact SD-CD1 4.49Å; M109-F198 HydrophobicContact SD-CE1 4.15Å; M109-D206 HydrophobicContact CE-CB 4.02Å; M109-V223 HydrophobicContact CE-CG1 4.31Å
110	H	90	Very high	90	Very high	95 Å²	95	69.3 Å²	69.3	44%	0.44	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-63.8	-22.5	175.2	-167.2	-49	0	0	0	112.5	R107 P108 Y128 H130	R107-H110 VanDerWaalsContact O-CB 3.31Å; R107-H110 WeakPolarHBondContact O-CB 3.41Å; R107-H110 PolarHBondContact O-N 3.45Å; R107-H110 VanDerWaalsContact O-N 3.12Å; P108-H110 PolarHBondContact O-N 2.71Å; H110-Y128 HydrophobicContact CB-CD1 3.87Å; H110-Y128 HydrophobicContact CB-CE1 4.35Å; H110-H130 AromaticContact CE1-CE1 3.32Å; H110-H130 PolarHBondContact CE1-CE1 3.42Å; H110-H130 AromaticContact CE1-NE2 3.22Å; H110-H130 PolarHBondContact CE1-NE2 3.38Å; H110-H130 AromaticContact ND1-NE2 3.6Å; H110-H130 AromaticContact NE2-CE1 3.79Å; H110-H130 AromaticContact NE2-NE2 3.97Å
111	K	88.8	Confident	90.3	Very high	198 Å²	198	74.6 Å²	74.6	86%	0.861	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-104.1	-5.7	175.6	-64.2	-178	-178.5	177.3	0	113.2	P108 M109	P108-K111 PolarHBondContact O-N 3.08Å; P108-K111 VanDerWaalsContact O-N 3.11Å; M109-K111 PolarHBondContact O-N 2.95Å
112	A	88.7	Confident	90.8	Very high	38 Å²	38	75 Å²	75	31%	0.314	37%	0.374	S	S	.	.	S	Bend	trans	-78.5	160.2	178.8	0	0	0	0	0	110.8	P108 M109	P108-A112 PolarHBondContact O-N 3.03Å; M109-A112 PolarHBondContact O-N 3.47Å; M109-A112 VanDerWaalsContact O-N 3.13Å
113	P	92.6	Very high	91.2	Very high	116 Å²	116	75 Å²	75	75%	0.753	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-55.5	147.6	165.3	-22.8	34.5	0	0	0	111.4
114	C	95.1	Very high	91.6	Very high	47 Å²	47	74.5 Å²	74.5	32%	0.318	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-66.6	144.1	176.9	-53.6	0	0	0	0	111.1	E125 F126 C127	C114-E125 HydrophobicContact CB-CG 3.44Å; C114-E125 VanDerWaalsContact CB-CG 3.44Å; C114-F126 CarbonylContact C-O 3.59Å; C114-F126 WeakPolarHBondContact CA-O 3.39Å; C114-F126 WeakPolarHBondContact CB-O 3.35Å; C114-C127 HydrophobicContact CB-CB 4.01Å; C114-C127 WeakPolarHBondContact CB-SG 3.48Å; C114-C127 VanDerWaalsContact SG-CA 3.55Å; C114-C127 WeakPolarHBondContact SG-CB 2.96Å; C114-C127 CovalentContact SG-SG 2.04Å; C114-C127 PolarHBondContact SG-SG 2.87Å
115	L	95.1	Very high	92	Very high	27 Å²	27	71.6 Å²	71.6	14%	0.141	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.4	-177.9	-52.7	-175.9	0	0	0	109.6	M109 E125 F126 D206 V208 V223	M109-L115 HydrophobicContact CE-CD1 3.87Å; L115-E125 CarbonylContact O-C 3.49Å; L115-E125 WeakPolarHBondContact O-CA 3.26Å; L115-F126 HydrophobicContact CB-CB 4.47Å; L115-F126 HydrophobicContact CB-CD1 4.44Å; L115-F126 HydrophobicContact CD1-CD1 4.14Å; L115-F126 HydrophobicContact CG-CD1 4.32Å; L115-F126 PolarHBondContact N-O 3.47Å; L115-F126 PolarHBondContact O-N 2.91Å; L115-D206 HydrophobicContact CD1-CB 4.17Å; L115-D206 HydrophobicContact CD2-CB 4.12Å; L115-D206 WeakPolarHBondContact CD2-O 3.39Å; L115-V208 HydrophobicContact CB-CG2 3.77Å; L115-V208 HydrophobicContact CD1-CG2 4.41Å; L115-V223 HydrophobicContact CD1-CG1 3.75Å
116	V	95	Very high	92.4	Very high	77 Å²	77	70.9 Å²	70.9	47%	0.467	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.5	-178.6	-176.6	0	0	0	0	110.4	T123 Y124 E125	V116-T123 HydrophobicContact CG1-CG2 3.46Å; V116-T123 VanDerWaalsContact CG1-CG2 3.46Å; V116-Y124 CarbonylContact C-O 3.57Å; V116-Y124 WeakPolarHBondContact CA-O 3.2Å; V116-E125 HydrophobicContact CG2-CB 4.22Å; V116-E125 HydrophobicContact CG2-CG 3.98Å
117	K	94.9	Very high	92.7	Very high	87 Å²	87	71.2 Å²	71.2	38%	0.378	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	118.1	173.9	179.3	66.8	173.8	-173.6	0	110.4	Y124 V208	K117-Y124 PolarHBondContact N-O 3.42Å; K117-Y124 WeakPolarHBondContact O-CD2 3.41Å; K117-Y124 PolarHBondContact O-N 3.45Å; K117-V208 HydrophobicContact CB-CB 3.89Å; K117-V208 HydrophobicContact CB-CG1 4.31Å; K117-V208 HydrophobicContact CG-CB 4.45Å
118	T	93.4	Very high	92.9	Very high	76 Å²	76	65.2 Å²	65.2	47%	0.466	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	133.5	167.3	-51.5	0	0	0	0	109.6	T123	T118-T123 PolarHBondContact OG1-OG1 3.27Å
119	K	91.1	Very high	93	Very high	82 Å²	82	62.9 Å²	62.9	36%	0.357	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	114	173.6	-175.8	-167.8	179.2	-173.2	0	107.2	W121 W122 Y124 V211	K119-W121 PolarHBondContact O-N 3.07Å; K119-W122 PolarHBondContact N-O 3.11Å; K119-W122 PolarHBondContact O-N 2.95Å; K119-Y124 HydrophobicContact CB-CD2 4.49Å; K119-Y124 HydrophobicContact CB-CE2 4.12Å; K119-V211 HydrophobicContact CD-CB 4.43Å; K119-V211 PolarHBondContact NZ-O 2.87Å
120	D	88.8	Confident	93.3	Very high	138 Å²	138	66.9 Å²	66.9	74%	0.738	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	-126.2	-177.1	-42.2	-45.2	0	0	0	111	W122	D120-W122 VanDerWaalsContact C-N 3.3Å; D120-W122 PolarHBondContact O-N 3.4Å
121	W	89	Confident	93.5	Very high	157 Å²	157	64.6 Å²	64.6	60%	0.595	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-21.6	176.8	-175.5	-95.5	0	0	0	114.1	K119 H136	K119-W121 PolarHBondContact O-N 3.07Å; W121-H136 AromaticContact CD1-ND1 3.9Å; W121-H136 AromaticContact CD2-CE1 3.59Å; W121-H136 AromaticContact CD2-ND1 3.51Å; W121-H136 AromaticContact CE2-CD2 3.94Å; W121-H136 AromaticContact CE2-CE1 3.64Å; W121-H136 AromaticContact CE2-CG 3.62Å; W121-H136 AromaticContact CE2-ND1 3.42Å; W121-H136 AromaticContact CE2-NE2 3.96Å; W121-H136 AromaticContact CE3-CE1 3.56Å; W121-H136 AromaticContact CE3-ND1 3.98Å; W121-H136 AromaticContact CG-ND1 3.84Å; W121-H136 AromaticContact CH2-CD2 3.96Å; W121-H136 AromaticContact CH2-CE1 3.67Å; W121-H136 AromaticContact CH2-NE2 3.45Å; W121-H136 WeakPolarHBondContact CH2-NE2 3.49Å; W121-H136 AromaticContact CZ2-CD2 3.59Å; W121-H136 AromaticContact CZ2-CE1 3.7Å; W121-H136 AromaticContact CZ2-CG 3.77Å; W121-H136 AromaticContact CZ2-ND1 3.83Å; W121-H136 AromaticContact CZ2-NE2 3.56Å; W121-H136 AromaticContact CZ3-CE1 3.6Å; W121-H136 AromaticContact CZ3-NE2 3.79Å; W121-H136 AromaticContact NE1-CG 3.7Å; W121-H136 AromaticContact NE1-ND1 3.66Å; W121-H136 PolarHBondContact O-ND1 3.48Å
122	W	93.3	Very high	93.9	Very high	87 Å²	87	55.1 Å²	55.1	33%	0.33	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.1	-166.9	-66.9	112.9	0	0	0	112.8	K119 D120 Y124 Q134 L147	K119-W122 PolarHBondContact N-O 3.11Å; K119-W122 PolarHBondContact O-N 2.95Å; D120-W122 VanDerWaalsContact C-N 3.3Å; D120-W122 PolarHBondContact O-N 3.4Å; W122-Y124 HydrophobicContact CB-CD2 4.39Å; W122-Y124 HydrophobicContact CB-CE2 3.55Å; W122-Q134 HydrophobicContact CB-CG 4.09Å; W122-Q134 HydrophobicContact CD2-CG 3.81Å; W122-Q134 HydrophobicContact CE3-CG 3.57Å; W122-Q134 HydrophobicContact CG-CG 4.07Å; W122-Q134 HydrophobicContact CZ3-CG 4.24Å; W122-L147 HydrophobicContact CH2-CD1 4.19Å
123	T	95.2	Very high	94.3	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.9	166	-59.8	0	0	0	0	109.7	V116 T118 Q134 Y135 L137	V116-T123 HydrophobicContact CG1-CG2 3.46Å; V116-T123 VanDerWaalsContact CG1-CG2 3.46Å; T118-T123 PolarHBondContact OG1-OG1 3.27Å; T123-Q134 CarbonylContact O-C 3.43Å; T123-Q134 WeakPolarHBondContact O-CA 3.38Å; T123-Y135 WeakPolarHBondContact CA-O 3.28Å; T123-Y135 WeakPolarHBondContact CB-O 3.48Å; T123-Y135 HydrophobicContact CG2-CE1 4.34Å; T123-Y135 HydrophobicContact CG2-CE2 3.78Å; T123-Y135 PolarHBondContact N-O 3.32Å; T123-Y135 PolarHBondContact O-N 3.36Å; T123-L137 HydrophobicContact CG2-CD1 3.86Å; T123-L137 HydrophobicContact CG2-CG 4.45Å
124	Y	96.3	Very high	94.4	Very high	17 Å²	17	51 Å²	51	7%	0.067	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.4	177.7	-59.2	-92	0	0	0	108.5	V116 K117 K119 W122 R133 Q134 L149 V211	V116-Y124 CarbonylContact C-O 3.57Å; V116-Y124 WeakPolarHBondContact CA-O 3.2Å; K117-Y124 PolarHBondContact N-O 3.42Å; K117-Y124 WeakPolarHBondContact O-CD2 3.41Å; K117-Y124 PolarHBondContact O-N 3.45Å; K119-Y124 HydrophobicContact CB-CD2 4.49Å; K119-Y124 HydrophobicContact CB-CE2 4.12Å; W122-Y124 HydrophobicContact CB-CD2 4.39Å; W122-Y124 HydrophobicContact CB-CE2 3.55Å; Y124-R133 CarbonylContact C-O 3.57Å; Y124-R133 WeakPolarHBondContact CA-O 3.43Å; Y124-Q134 HydrophobicContact CD1-CB 4.19Å; Y124-Q134 HydrophobicContact CD1-CG 4.18Å; Y124-Q134 HydrophobicContact CE1-CB 4.21Å; Y124-Q134 HydrophobicContact CE1-CG 3.79Å; Y124-Q134 VanDerWaalsContact CE1-NE2 3.31Å; Y124-Q134 PolarHBondContact OH-NE2 3.43Å; Y124-L149 HydrophobicContact CD1-CD1 3.66Å; Y124-L149 HydrophobicContact CE1-CD1 3.78Å; Y124-V211 HydrophobicContact CD1-CG1 3.8Å; Y124-V211 HydrophobicContact CD2-CB 4.38Å; Y124-V211 HydrophobicContact CD2-CG1 4.09Å; Y124-V211 HydrophobicContact CD2-CG2 4.04Å; Y124-V211 HydrophobicContact CE1-CG1 3.62Å; Y124-V211 HydrophobicContact CE2-CB 4.41Å; Y124-V211 HydrophobicContact CE2-CG1 3.95Å; Y124-V211 HydrophobicContact CG-CG1 4.04Å; Y124-V211 HydrophobicContact CG-CG2 4.07Å
125	E	96.3	Very high	94.4	Very high	24 Å²	24	49.3 Å²	49.3	11%	0.112	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129	167.7	-178.6	-172.5	-85.6	0	0	109.8	C114 L115 V116 C127 I132 R133 Y135	C114-E125 HydrophobicContact CB-CG 3.44Å; C114-E125 VanDerWaalsContact CB-CG 3.44Å; L115-E125 CarbonylContact O-C 3.49Å; L115-E125 WeakPolarHBondContact O-CA 3.26Å; V116-E125 HydrophobicContact CG2-CB 4.22Å; V116-E125 HydrophobicContact CG2-CG 3.98Å; E125-C127 PolarHBondContact OE2-SG 3.29Å; E125-I132 WeakPolarHBondContact O-CA 3.27Å; E125-R133 HydrophobicContact CB-CG 3.81Å; E125-R133 VanDerWaalsContact CD-NE 3.26Å; E125-R133 PolarHBondContact N-O 3.34Å; E125-R133 PolarHBondContact O-N 2.93Å; E125-R133 IonicContact OE1-CZ 3.98Å; E125-R133 IonicContact OE1-NE 3.43Å; E125-R133 IonicContact OE1-NH2 3.65Å; E125-R133 PolarHBondContact OE1-NH2 3Å; E125-R133 IonicContact OE2-CZ 2.73Å; E125-R133 IonicContact OE2-NE 2.95Å; E125-R133 PolarHBondContact OE2-NE 3.14Å; E125-R133 IonicContact OE2-NH2 3.56Å; E125-R133 PolarHBondContact OE2-NH2 3.14Å; E125-Y135 HydrophobicContact CB-CE1 3.97Å
126	F	97.1	Very high	94.3	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	110.6	178.6	171.6	-104.3	0	0	0	110.2	C114 L115 Y128 I132 Y179 V196 F198 V208 L221 V223	C114-F126 CarbonylContact C-O 3.59Å; C114-F126 WeakPolarHBondContact CA-O 3.39Å; C114-F126 WeakPolarHBondContact CB-O 3.35Å; L115-F126 HydrophobicContact CB-CB 4.47Å; L115-F126 HydrophobicContact CB-CD1 4.44Å; L115-F126 HydrophobicContact CD1-CD1 4.14Å; L115-F126 HydrophobicContact CG-CD1 4.32Å; L115-F126 PolarHBondContact N-O 3.47Å; L115-F126 PolarHBondContact O-N 2.91Å; F126-Y128 HydrophobicContact CE1-CD2 4.29Å; F126-Y128 HydrophobicContact CZ-CD2 4.13Å; F126-I132 HydrophobicContact CD2-CD1 3.9Å; F126-I132 HydrophobicContact CD2-CG1 3.88Å; F126-I132 HydrophobicContact CE2-CD1 4.21Å; F126-I132 HydrophobicContact CE2-CG1 4.35Å; F126-Y179 HydrophobicContact CE2-CE1 4.18Å; F126-Y179 HydrophobicContact CE2-CE2 4.03Å; F126-Y179 AromaticContact CE2-CZ 3.65Å; F126-V196 HydrophobicContact CD2-CG1 4.46Å; F126-V196 HydrophobicContact CD2-CG2 4.16Å; F126-V196 HydrophobicContact CE2-CB 4.36Å; F126-V196 HydrophobicContact CE2-CG1 3.92Å; F126-V196 HydrophobicContact CE2-CG2 3.78Å; F126-V196 HydrophobicContact CZ-CG1 4Å; F126-F198 HydrophobicContact CE1-CE1 4.14Å; F126-F198 HydrophobicContact CE1-CZ 4.11Å; F126-F198 HydrophobicContact CZ-CE1 4.27Å; F126-F198 AromaticContact CZ-CZ 3.76Å; F126-F198 HydrophobicContact CZ-CZ 3.76Å; F126-V208 HydrophobicContact CB-CG2 4.15Å; F126-L221 HydrophobicContact CB-CD2 4.36Å; F126-L221 HydrophobicContact CD2-CD2 4.48Å; F126-V223 HydrophobicContact CD1-CG2 4.23Å; F126-V223 HydrophobicContact CE1-CG2 4.36Å
127	C	95.8	Very high	94.1	Very high	8 Å²	8	48.6 Å²	48.6	5%	0.054	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	109.1	172.8	-62.1	0	0	0	0	109.7	C114 E125 G129 H130 H131	C114-C127 HydrophobicContact CB-CB 4.01Å; C114-C127 WeakPolarHBondContact CB-SG 3.48Å; C114-C127 VanDerWaalsContact SG-CA 3.55Å; C114-C127 WeakPolarHBondContact SG-CB 2.96Å; C114-C127 CovalentContact SG-SG 2.04Å; C114-C127 PolarHBondContact SG-SG 2.87Å; E125-C127 PolarHBondContact OE2-SG 3.29Å; C127-G129 PolarHBondContact O-N 3.47Å; C127-H130 HydrophobicContact CB-CB 3.92Å; C127-H130 PolarHBondContact O-N 3.36Å; C127-H131 PolarHBondContact N-O 2.97Å; C127-H131 PolarHBondContact O-N 3.04Å
128	Y	95.1	Very high	93.8	Very high	19 Å²	19	49.2 Å²	49.2	8%	0.075	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	127.8	-176.5	-178.3	-85.6	0	0	0	112.5	L106 M109 H110 F126 H130 Q177 F198	L106-Y128 HydrophobicContact CB-CE2 3.75Å; L106-Y128 VanDerWaalsContact CB-OH 3.26Å; L106-Y128 WeakPolarHBondContact CB-OH 3.45Å; L106-Y128 HydrophobicContact CD1-CE2 4.25Å; L106-Y128 HydrophobicContact CG-CE2 4.44Å; M109-Y128 HydrophobicContact CB-CD1 4.13Å; M109-Y128 HydrophobicContact CB-CD2 3.99Å; M109-Y128 HydrophobicContact CB-CG 3.69Å; M109-Y128 HydrophobicContact SD-CD2 4.3Å; H110-Y128 HydrophobicContact CB-CD1 3.87Å; H110-Y128 HydrophobicContact CB-CE1 4.35Å; F126-Y128 HydrophobicContact CE1-CD2 4.29Å; F126-Y128 HydrophobicContact CZ-CD2 4.13Å; Y128-H130 PolarHBondContact O-N 3.39Å; Y128-Q177 PolarHBondContact OH-NE2 2.88Å; Y128-F198 AromaticContact CD2-CE1 3.85Å; Y128-F198 HydrophobicContact CD2-CE1 3.85Å; Y128-F198 AromaticContact CD2-CZ 3.58Å; Y128-F198 HydrophobicContact CD2-CZ 3.58Å; Y128-F198 AromaticContact CE2-CE1 3.97Å; Y128-F198 HydrophobicContact CE2-CE1 3.97Å; Y128-F198 HydrophobicContact CE2-CE2 4.25Å; Y128-F198 AromaticContact CE2-CZ 3.56Å; Y128-F198 HydrophobicContact CE2-CZ 3.56Å
129	G	92.5	Very high	93.3	Very high	16 Å²	16	52.8 Å²	52.8	17%	0.165	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	4.8	179.3	0	0	0	0	0	114.8	C127 Y152 Y179	C127-G129 PolarHBondContact O-N 3.47Å; G129-Y152 WeakPolarHBondContact O-CB 3.41Å; G129-Y179 PolarHBondContact N-OH 3.15Å
130	H	94.4	Very high	92.9	Very high	93 Å²	93	54.6 Å²	54.6	43%	0.431	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-81.7	-176	-69.8	-50.4	0	0	0	112.4	H110 C127 Y128 Y152	H110-H130 AromaticContact CE1-CE1 3.32Å; H110-H130 PolarHBondContact CE1-CE1 3.42Å; H110-H130 AromaticContact CE1-NE2 3.22Å; H110-H130 PolarHBondContact CE1-NE2 3.38Å; H110-H130 AromaticContact ND1-NE2 3.6Å; H110-H130 AromaticContact NE2-CE1 3.79Å; H110-H130 AromaticContact NE2-NE2 3.97Å; C127-H130 HydrophobicContact CB-CB 3.92Å; C127-H130 PolarHBondContact O-N 3.36Å; Y128-H130 PolarHBondContact O-N 3.39Å; H130-Y152 PolarHBondContact O-N 3.35Å
131	H	95.8	Very high	92.8	Very high	47 Å²	47	53.4 Å²	53.4	22%	0.218	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	165.6	-171.9	68.2	-84.2	0	0	0	111.4	C127 F148 G150	C127-H131 PolarHBondContact N-O 2.97Å; C127-H131 PolarHBondContact O-N 3.04Å; H131-F148 HydrophobicContact CB-CD1 4.31Å; H131-F148 HydrophobicContact CB-CE1 4.48Å; H131-F148 AromaticContact CD2-CD1 3.82Å; H131-F148 AromaticContact CD2-CE1 3.45Å; H131-F148 VanDerWaalsContact CD2-CE1 3.45Å; H131-F148 WeakPolarHBondContact CD2-CE1 3.4Å; H131-F148 AromaticContact NE2-CE1 3.95Å; H131-G150 WeakPolarHBondContact CA-O 3.36Å
132	I	97.4	Very high	92.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.2	178.4	-44.5	-174.2	0	0	0	107	E125 F126 F148 L149 G150 Y179 T194 V196 L221	E125-I132 WeakPolarHBondContact O-CA 3.27Å; F126-I132 HydrophobicContact CD2-CD1 3.9Å; F126-I132 HydrophobicContact CD2-CG1 3.88Å; F126-I132 HydrophobicContact CE2-CD1 4.21Å; F126-I132 HydrophobicContact CE2-CG1 4.35Å; I132-F148 CarbonylContact O-C 3.59Å; I132-F148 WeakPolarHBondContact O-CA 3.47Å; I132-L149 HydrophobicContact CB-CB 4.19Å; I132-L149 HydrophobicContact CG2-CB 4.14Å; I132-L149 HydrophobicContact CG2-CD1 4.16Å; I132-L149 HydrophobicContact CG2-CG 4.4Å; I132-L149 PolarHBondContact O-N 2.94Å; I132-G150 PolarHBondContact N-O 3.37Å; I132-Y179 HydrophobicContact CD1-CD1 3.83Å; I132-Y179 HydrophobicContact CD1-CD2 3.88Å; I132-Y179 HydrophobicContact CD1-CE1 4.34Å; I132-Y179 HydrophobicContact CD1-CE2 4.4Å; I132-Y179 HydrophobicContact CD1-CG 3.61Å; I132-Y179 HydrophobicContact CG1-CD1 3.66Å; I132-Y179 HydrophobicContact CG1-CE1 4.1Å; I132-Y179 HydrophobicContact CG1-CG 3.97Å; I132-T194 HydrophobicContact CD1-CG2 3.54Å; I132-V196 HydrophobicContact CD1-CG2 3.46Å; I132-V196 VanDerWaalsContact CD1-CG2 3.46Å; I132-L221 HydrophobicContact CD1-CD2 4.34Å; I132-L221 HydrophobicContact CG2-CD2 3.86Å
133	R	95.7	Very high	92.4	Very high	63 Å²	63	50.7 Å²	50.7	24%	0.238	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151	178.3	63.7	172.8	-179.6	169.4	2.7	111.8	Y124 E125 Y135 V146 L147	Y124-R133 CarbonylContact C-O 3.57Å; Y124-R133 WeakPolarHBondContact CA-O 3.43Å; E125-R133 HydrophobicContact CB-CG 3.81Å; E125-R133 VanDerWaalsContact CD-NE 3.26Å; E125-R133 PolarHBondContact N-O 3.34Å; E125-R133 PolarHBondContact O-N 2.93Å; E125-R133 IonicContact OE1-CZ 3.98Å; E125-R133 IonicContact OE1-NE 3.43Å; E125-R133 IonicContact OE1-NH2 3.65Å; E125-R133 PolarHBondContact OE1-NH2 3Å; E125-R133 IonicContact OE2-CZ 2.73Å; E125-R133 IonicContact OE2-NE 2.95Å; E125-R133 PolarHBondContact OE2-NE 3.14Å; E125-R133 IonicContact OE2-NH2 3.56Å; E125-R133 PolarHBondContact OE2-NH2 3.14Å; R133-Y135 HydrophobicContact CG-CD1 4Å; R133-Y135 HydrophobicContact CG-CE1 3.91Å; R133-V146 HydrophobicContact CB-CG1 3.95Å; R133-V146 HydrophobicContact CG-CG1 4.5Å; R133-L147 CarbonylContact C-O 3.58Å; R133-L147 VanDerWaalsContact CA-O 3.28Å; R133-L147 WeakPolarHBondContact CA-O 3.39Å
134	Q	94.9	Very high	91.9	Very high	5 Å²	5	54 Å²	54	2%	0.023	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130.1	178.3	177.9	-168.9	54.9	0	0	107.5	W122 T123 Y124 L147 L149	W122-Q134 HydrophobicContact CB-CG 4.09Å; W122-Q134 HydrophobicContact CD2-CG 3.81Å; W122-Q134 HydrophobicContact CE3-CG 3.57Å; W122-Q134 HydrophobicContact CG-CG 4.07Å; W122-Q134 HydrophobicContact CZ3-CG 4.24Å; T123-Q134 CarbonylContact O-C 3.43Å; T123-Q134 WeakPolarHBondContact O-CA 3.38Å; Y124-Q134 HydrophobicContact CD1-CB 4.19Å; Y124-Q134 HydrophobicContact CD1-CG 4.18Å; Y124-Q134 HydrophobicContact CE1-CB 4.21Å; Y124-Q134 HydrophobicContact CE1-CG 3.79Å; Y124-Q134 VanDerWaalsContact CE1-NE2 3.31Å; Y124-Q134 PolarHBondContact OH-NE2 3.43Å; Q134-L147 HydrophobicContact CB-CB 4.34Å; Q134-L147 PolarHBondContact N-O 3.01Å; Q134-L147 PolarHBondContact O-N 2.99Å; Q134-L149 HydrophobicContact CB-CD1 4.09Å; Q134-L149 HydrophobicContact CB-CD2 3.75Å; Q134-L149 HydrophobicContact CB-CG 3.95Å
135	Y	95.1	Very high	91.3	Very high	11 Å²	11	59.9 Å²	59.9	4%	0.043	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	162.5	-177.4	55.2	-86.5	0	0	0	110.6	T123 E125 R133 L137 I142	T123-Y135 WeakPolarHBondContact CA-O 3.28Å; T123-Y135 WeakPolarHBondContact CB-O 3.48Å; T123-Y135 HydrophobicContact CG2-CE1 4.34Å; T123-Y135 HydrophobicContact CG2-CE2 3.78Å; T123-Y135 PolarHBondContact N-O 3.32Å; T123-Y135 PolarHBondContact O-N 3.36Å; E125-Y135 HydrophobicContact CB-CE1 3.97Å; R133-Y135 HydrophobicContact CG-CD1 4Å; R133-Y135 HydrophobicContact CG-CE1 3.91Å; Y135-L137 HydrophobicContact CD2-CD2 4.13Å; Y135-L137 HydrophobicContact CD2-CG 4.01Å; Y135-L137 HydrophobicContact CE2-CD1 4.01Å; Y135-L137 HydrophobicContact CE2-CD2 3.76Å; Y135-L137 HydrophobicContact CE2-CG 3.66Å; Y135-I142 HydrophobicContact CD2-CB 4.38Å; Y135-I142 HydrophobicContact CD2-CD1 3.9Å; Y135-I142 HydrophobicContact CD2-CG1 3.71Å; Y135-I142 HydrophobicContact CD2-CG2 3.98Å; Y135-I142 HydrophobicContact CE2-CD1 3.94Å; Y135-I142 HydrophobicContact CE2-CG1 3.88Å; Y135-I142 HydrophobicContact CG-CD1 4.35Å; Y135-I142 HydrophobicContact CG-CG2 4.23Å
136	H	93	Very high	91.2	Very high	29 Å²	29	61.3 Å²	61.3	13%	0.134	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	145.1	173.4	-177.4	62.3	0	0	0	110.5	W121 I142 R143	W121-H136 AromaticContact CD1-ND1 3.9Å; W121-H136 AromaticContact CD2-CE1 3.59Å; W121-H136 AromaticContact CD2-ND1 3.51Å; W121-H136 AromaticContact CE2-CD2 3.94Å; W121-H136 AromaticContact CE2-CE1 3.64Å; W121-H136 AromaticContact CE2-CG 3.62Å; W121-H136 AromaticContact CE2-ND1 3.42Å; W121-H136 AromaticContact CE2-NE2 3.96Å; W121-H136 AromaticContact CE3-CE1 3.56Å; W121-H136 AromaticContact CE3-ND1 3.98Å; W121-H136 AromaticContact CG-ND1 3.84Å; W121-H136 AromaticContact CH2-CD2 3.96Å; W121-H136 AromaticContact CH2-CE1 3.67Å; W121-H136 AromaticContact CH2-NE2 3.45Å; W121-H136 WeakPolarHBondContact CH2-NE2 3.49Å; W121-H136 AromaticContact CZ2-CD2 3.59Å; W121-H136 AromaticContact CZ2-CE1 3.7Å; W121-H136 AromaticContact CZ2-CG 3.77Å; W121-H136 AromaticContact CZ2-ND1 3.83Å; W121-H136 AromaticContact CZ2-NE2 3.56Å; W121-H136 AromaticContact CZ3-CE1 3.6Å; W121-H136 AromaticContact CZ3-NE2 3.79Å; W121-H136 AromaticContact NE1-CG 3.7Å; W121-H136 AromaticContact NE1-ND1 3.66Å; W121-H136 PolarHBondContact O-ND1 3.48Å; H136-I142 WeakPolarHBondContact O-CA 3.45Å; H136-R143 PolarHBondContact O-N 3.06Å
137	L	90.3	Very high	91	Very high	60 Å²	60	63.1 Å²	63.1	31%	0.314	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	126	175.6	-79.2	179	0	0	0	109.9	T123 Y135 E141 I142	T123-L137 HydrophobicContact CG2-CD1 3.86Å; T123-L137 HydrophobicContact CG2-CG 4.45Å; Y135-L137 HydrophobicContact CD2-CD2 4.13Å; Y135-L137 HydrophobicContact CD2-CG 4.01Å; Y135-L137 HydrophobicContact CE2-CD1 4.01Å; Y135-L137 HydrophobicContact CE2-CD2 3.76Å; Y135-L137 HydrophobicContact CE2-CG 3.66Å; L137-E141 WeakPolarHBondContact CA-O 3.4Å; L137-I142 HydrophobicContact CD2-CG1 3.89Å
138	E	88.9	Confident	91.1	Very high	99 Å²	99	66 Å²	66	46%	0.463	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.6	173.3	-166.3	179.6	-151.7	0	0	106.9	S140 E141 R143	E138-S140 PolarHBondContact O-N 3.47Å; E138-S140 VanDerWaalsContact O-N 3.07Å; E138-E141 PolarHBondContact N-O 3.22Å; E138-E141 PolarHBondContact O-N 3.35Å; E138-R143 HydrophobicContact CB-CB 4.5Å; E138-R143 HydrophobicContact CB-CG 3.65Å
139	D	83.7	Confident	91.1	Very high	151 Å²	151	65.1 Å²	65.1	81%	0.807	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	29.2	-175.7	-63.4	-29.5	0	0	0	115.6	E141	D139-E141 PolarHBondContact O-N 3.02Å
140	S	82.4	Confident	91.2	Very high	120 Å²	120	64.4 Å²	64.4	84%	0.839	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	6.8	-170.9	-41.5	0	0	0	0	115.9	E138	E138-S140 PolarHBondContact O-N 3.47Å; E138-S140 VanDerWaalsContact O-N 3.07Å
141	E	87.6	Confident	91.4	Very high	114 Å²	114	63.7 Å²	63.7	53%	0.533	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	146.3	170.5	-65.5	-173.4	157.4	0	0	111.2	L137 E138 D139 R143	L137-E141 WeakPolarHBondContact CA-O 3.4Å; E138-E141 PolarHBondContact N-O 3.22Å; E138-E141 PolarHBondContact O-N 3.35Å; D139-E141 PolarHBondContact O-N 3.02Å; E141-R143 PolarHBondContact O-N 3.14Å; E141-R143 IonicContact OE2-CZ 3.54Å; E141-R143 IonicContact OE2-NE 2.81Å; E141-R143 IonicContact OE2-NH2 3.42Å; E141-R143 PolarHBondContact OE2-NH2 2.95Å
142	I	88.6	Confident	91.4	Very high	74 Å²	74	65.4 Å²	65.4	38%	0.379	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.2	173.5	-59.2	-178.9	0	0	0	109	Y135 H136 L137 V146	Y135-I142 HydrophobicContact CD2-CB 4.38Å; Y135-I142 HydrophobicContact CD2-CD1 3.9Å; Y135-I142 HydrophobicContact CD2-CG1 3.71Å; Y135-I142 HydrophobicContact CD2-CG2 3.98Å; Y135-I142 HydrophobicContact CE2-CD1 3.94Å; Y135-I142 HydrophobicContact CE2-CG1 3.88Å; Y135-I142 HydrophobicContact CG-CD1 4.35Å; Y135-I142 HydrophobicContact CG-CG2 4.23Å; H136-I142 WeakPolarHBondContact O-CA 3.45Å; L137-I142 HydrophobicContact CD2-CG1 3.89Å; I142-V146 HydrophobicContact CG2-CG2 3.9Å
143	R	83.8	Confident	91.3	Very high	113 Å²	113	71 Å²	71	43%	0.426	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.9	177.4	-67	-70.5	168.4	143.9	-10.7	111	H136 E138 E141	H136-R143 PolarHBondContact O-N 3.06Å; E138-R143 HydrophobicContact CB-CB 4.5Å; E138-R143 HydrophobicContact CB-CG 3.65Å; E141-R143 PolarHBondContact O-N 3.14Å; E141-R143 IonicContact OE2-CZ 3.54Å; E141-R143 IonicContact OE2-NE 2.81Å; E141-R143 IonicContact OE2-NH2 3.42Å; E141-R143 PolarHBondContact OE2-NH2 2.95Å
144	G	84.5	Confident	91.1	Very high	71 Å²	71	70.2 Å²	70.2	73%	0.732	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	77.7	-158.9	-179.4	0	0	0	0	0	113.9
145	D	85.4	Confident	90.8	Very high	140 Å²	140	73.3 Å²	73.3	75%	0.749	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	140	-176.2	-67.1	-42.1	0	0	0	112.4
146	V	92.9	Very high	90.4	Very high	54 Å²	54	74.7 Å²	74.7	33%	0.327	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	110.8	171	-178.2	0	0	0	0	109	R133 I142 F148	R133-V146 HydrophobicContact CB-CG1 3.95Å; R133-V146 HydrophobicContact CG-CG1 4.5Å; I142-V146 HydrophobicContact CG2-CG2 3.9Å; V146-F148 HydrophobicContact CG1-CE2 4.45Å
147	L	93.9	Very high	89.8	Confident	39 Å²	39	77.4 Å²	77.4	20%	0.204	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	134.4	178.3	-64.5	173.5	0	0	0	110.2	W122 R133 Q134	W122-L147 HydrophobicContact CH2-CD1 4.19Å; R133-L147 CarbonylContact C-O 3.58Å; R133-L147 VanDerWaalsContact CA-O 3.28Å; R133-L147 WeakPolarHBondContact CA-O 3.39Å; Q134-L147 HydrophobicContact CB-CB 4.34Å; Q134-L147 PolarHBondContact N-O 3.01Å; Q134-L147 PolarHBondContact O-N 2.99Å
148	F	96.4	Very high	89.1	Confident	69 Å²	69	75.5 Å²	75.5	30%	0.303	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.7	171.1	-71	-99.6	0	0	0	109	H131 I132 V146 H151 G182 S183	H131-F148 HydrophobicContact CB-CD1 4.31Å; H131-F148 HydrophobicContact CB-CE1 4.48Å; H131-F148 AromaticContact CD2-CD1 3.82Å; H131-F148 AromaticContact CD2-CE1 3.45Å; H131-F148 VanDerWaalsContact CD2-CE1 3.45Å; H131-F148 WeakPolarHBondContact CD2-CE1 3.4Å; H131-F148 AromaticContact NE2-CE1 3.95Å; I132-F148 CarbonylContact O-C 3.59Å; I132-F148 WeakPolarHBondContact O-CA 3.47Å; V146-F148 HydrophobicContact CG1-CE2 4.45Å; F148-H151 AromaticContact CD1-CE1 3.64Å; F148-H151 AromaticContact CD1-NE2 3.87Å; F148-G182 CarbonylContact O-C 3.54Å; F148-G182 WeakPolarHBondContact O-CA 3.32Å; F148-S183 PolarHBondContact N-OG 2.94Å; F148-S183 PolarHBondContact O-N 3.14Å; F148-S183 PolarHBondContact O-OG 2.98Å
149	L	95.4	Very high	88.2	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-13.6	177.3	-50.5	-171.4	0	0	0	112.5	Y124 I132 Q134 R192 E193 T194 Y219	Y124-L149 HydrophobicContact CD1-CD1 3.66Å; Y124-L149 HydrophobicContact CE1-CD1 3.78Å; I132-L149 HydrophobicContact CB-CB 4.19Å; I132-L149 HydrophobicContact CG2-CB 4.14Å; I132-L149 HydrophobicContact CG2-CD1 4.16Å; I132-L149 HydrophobicContact CG2-CG 4.4Å; I132-L149 PolarHBondContact O-N 2.94Å; Q134-L149 HydrophobicContact CB-CD1 4.09Å; Q134-L149 HydrophobicContact CB-CD2 3.75Å; Q134-L149 HydrophobicContact CB-CG 3.95Å; L149-R192 CarbonylContact O-C 3.37Å; L149-E193 CarbonylContact O-C 3.58Å; L149-E193 WeakPolarHBondContact O-CA 3.3Å; L149-E193 PolarHBondContact O-N 2.86Å; L149-T194 WeakPolarHBondContact CB-OG1 3.42Å; L149-T194 PolarHBondContact O-OG1 3.18Å; L149-Y219 HydrophobicContact CB-CD2 4.13Å; L149-Y219 HydrophobicContact CD1-CD1 4.13Å; L149-Y219 HydrophobicContact CD1-CD2 4.11Å; L149-Y219 HydrophobicContact CD1-CE1 4.41Å; L149-Y219 HydrophobicContact CD1-CE2 4.42Å; L149-Y219 HydrophobicContact CD1-CG 3.99Å; L149-Y219 HydrophobicContact CD2-CD2 4.07Å; L149-Y219 HydrophobicContact CD2-CE2 3.69Å; L149-Y219 HydrophobicContact CG-CD2 4.34Å; L149-Y219 HydrophobicContact CG-CE2 4.44Å
150	G	95.9	Very high	87.7	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.6	162.9	172.3	0	0	0	0	0	112.7	H131 I132 V180	H131-G150 WeakPolarHBondContact CA-O 3.36Å; I132-G150 PolarHBondContact N-O 3.37Å; G150-V180 CarbonylContact C-O 3.36Å; G150-V180 WeakPolarHBondContact CA-O 3.33Å
151	H	96.9	Very high	86.6	Confident	79 Å²	79	71.6 Å²	71.6	37%	0.366	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	145.1	169	-64.7	-80.4	0	0	0	108.9	F148 E153 Y179 V180	F148-H151 AromaticContact CD1-CE1 3.64Å; F148-H151 AromaticContact CD1-NE2 3.87Å; H151-E153 PolarHBondContact O-N 3.46Å; H151-Y179 CarbonylContact O-C 3.59Å; H151-Y179 WeakPolarHBondContact O-CA 3.37Å; H151-V180 PolarHBondContact N-O 2.97Å; H151-V180 PolarHBondContact O-N 3.46Å
152	Y	96.3	Very high	85.2	Confident	83 Å²	83	71.7 Å²	71.7	33%	0.325	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	129.7	-178	177	-97.1	0	0	0	111.5	G129 H130 E155 Q177 Y179	G129-Y152 WeakPolarHBondContact O-CB 3.41Å; H130-Y152 PolarHBondContact O-N 3.35Å; Y152-E155 HydrophobicContact CE2-CB 4.43Å; Y152-E155 WeakPolarHBondContact OH-CG 3.34Å; Y152-E155 PolarHBondContact OH-OE2 2.98Å; Y152-Q177 HydrophobicContact CE2-CG 4.28Å; Y152-Y179 HydrophobicContact CD2-CE1 4.2Å; Y152-Y179 HydrophobicContact CD2-CE2 4.17Å; Y152-Y179 AromaticContact CD2-CZ 3.79Å; Y152-Y179 HydrophobicContact CG-CE1 4.45Å; Y152-Y179 VanDerWaalsContact N-CD1 3.31Å
153	E	95.1	Very high	83.6	Confident	116 Å²	116	69.2 Å²	69.2	54%	0.542	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	-51.7	177	174	-174.8	-120.1	0	0	112	H151 T178 V180	H151-E153 PolarHBondContact O-N 3.46Å; E153-T178 PolarHBondContact N-O 2.93Å; E153-T178 VanDerWaalsContact N-O 3.11Å; E153-V180 HydrophobicContact CB-CG2 3.78Å; E153-V180 VanDerWaalsContact CD-CG2 3.41Å; E153-V180 HydrophobicContact CG-CG2 4.13Å; E153-V180 WeakPolarHBondContact OE1-CG2 3.24Å; E153-V180 WeakPolarHBondContact OE2-CG2 3.47Å
154	S	92.4	Very high	82.1	Confident	47 Å²	47	68.4 Å²	68.4	33%	0.329	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	156.7	-171.4	58.4	0	0	0	0	112.6	T178	S154-T178 PolarHBondContact N-O 2.88Å; S154-T178 PolarHBondContact O-N 2.82Å; S154-T178 PolarHBondContact OG-OG1 3Å
155	E	89.4	Confident	80.4	Confident	70 Å²	70	69 Å²	69	33%	0.327	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	158.5	174.3	67.8	-173.5	-176.1	0	0	110.9	P103 Y152 D157 Q177	P103-E155 WeakPolarHBondContact CB-OE1 3.48Å; P103-E155 WeakPolarHBondContact CG-OE1 3.39Å; Y152-E155 HydrophobicContact CE2-CB 4.43Å; Y152-E155 WeakPolarHBondContact OH-CG 3.34Å; Y152-E155 PolarHBondContact OH-OE2 2.98Å; E155-D157 PolarHBondContact O-N 3.4Å; E155-Q177 HydrophobicContact CB-CG 3.75Å; E155-Q177 PolarHBondContact OE2-NE2 3.31Å; E155-Q177 VanDerWaalsContact OE2-NE2 3.14Å
156	F	84.9	Confident	78.8	Confident	41 Å²	41	64.5 Å²	64.5	18%	0.18	34%	0.343	C	S	.	.			trans	-76.1	113.2	-175.7	-177.7	-100.6	0	0	0	111.9	W158 H169 H175 S176	F156-W158 AromaticContact CD1-CD2 3.94Å; F156-W158 HydrophobicContact CD1-CD2 3.94Å; F156-W158 AromaticContact CD1-CE2 3.61Å; F156-W158 HydrophobicContact CD1-CG 4.27Å; F156-W158 AromaticContact CD1-CZ2 3.92Å; F156-W158 HydrophobicContact CD1-CZ2 3.92Å; F156-W158 AromaticContact CD1-NE1 3.8Å; F156-W158 AromaticContact CE1-CD2 3.85Å; F156-W158 HydrophobicContact CE1-CD2 3.85Å; F156-W158 AromaticContact CE1-CE2 3.77Å; F156-W158 AromaticContact CE1-CE3 3.96Å; F156-W158 HydrophobicContact CE1-CE3 3.96Å; F156-W158 AromaticContact CE1-CH2 3.94Å; F156-W158 HydrophobicContact CE1-CH2 3.94Å; F156-W158 AromaticContact CE1-CZ2 3.82Å; F156-W158 HydrophobicContact CE1-CZ2 3.82Å; F156-W158 HydrophobicContact CE1-CZ3 4.02Å; F156-W158 PolarHBondContact O-N 3.17Å; F156-H169 AromaticContact CE1-CE1 3.43Å; F156-H169 VanDerWaalsContact CE1-CE1 3.43Å; F156-H169 WeakPolarHBondContact CE1-CE1 2.92Å; F156-H169 AromaticContact CE1-ND1 3.7Å; F156-H169 AromaticContact CE2-CE1 3.77Å; F156-H169 AromaticContact CE2-NE2 3.62Å; F156-H169 AromaticContact CZ-CD2 3.75Å; F156-H169 AromaticContact CZ-CE1 3.01Å; F156-H169 WeakPolarHBondContact CZ-CE1 3.41Å; F156-H169 AromaticContact CZ-CG 3.97Å; F156-H169 AromaticContact CZ-ND1 3.54Å; F156-H169 AromaticContact CZ-NE2 3.13Å; F156-H169 WeakPolarHBondContact CZ-NE2 3.34Å; F156-H175 PolarHBondContact O-CE1 3.26Å; F156-S176 VanDerWaalsContact CB-O 3.23Å; F156-S176 WeakPolarHBondContact CB-O 3.37Å; F156-S176 WeakPolarHBondContact CB-OG 3.42Å; F156-S176 PolarHBondContact N-O 3.4Å
157	D	81.4	Confident	76.8	Confident	86 Å²	86	69.2 Å²	69.2	46%	0.46	36%	0.359	S	S	.	.			trans	-77.6	110.2	177.5	-180	13.6	0	0	0	111.7	E155 N159 N160	E155-D157 PolarHBondContact O-N 3.4Å; D157-N159 VanDerWaalsContact C-N 3.28Å; D157-N159 PolarHBondContact O-N 2.93Å; D157-N159 WeakPolarHBondContact OD1-CA 3.43Å; D157-N159 WeakPolarHBondContact OD1-CB 3.1Å; D157-N159 PolarHBondContact OD1-N 3.17Å; D157-N160 HydrophobicContact CB-CB 4.47Å
158	W	75.1	Confident	74.5	Confident	20 Å²	20	72.9 Å²	72.9	8%	0.076	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-17.4	176.7	-67.2	93.2	0	0	0	113.6	I102 F156 K164 H175 F233 L234	I102-W158 HydrophobicContact CD1-CD2 3.81Å; I102-W158 VanDerWaalsContact CD1-CE2 3.41Å; I102-W158 HydrophobicContact CD1-CG 3.97Å; I102-W158 HydrophobicContact CD1-CZ2 3.92Å; I102-W158 VanDerWaalsContact CD1-NE1 3.25Å; F156-W158 AromaticContact CD1-CD2 3.94Å; F156-W158 HydrophobicContact CD1-CD2 3.94Å; F156-W158 AromaticContact CD1-CE2 3.61Å; F156-W158 HydrophobicContact CD1-CG 4.27Å; F156-W158 AromaticContact CD1-CZ2 3.92Å; F156-W158 HydrophobicContact CD1-CZ2 3.92Å; F156-W158 AromaticContact CD1-NE1 3.8Å; F156-W158 AromaticContact CE1-CD2 3.85Å; F156-W158 HydrophobicContact CE1-CD2 3.85Å; F156-W158 AromaticContact CE1-CE2 3.77Å; F156-W158 AromaticContact CE1-CE3 3.96Å; F156-W158 HydrophobicContact CE1-CE3 3.96Å; F156-W158 AromaticContact CE1-CH2 3.94Å; F156-W158 HydrophobicContact CE1-CH2 3.94Å; F156-W158 AromaticContact CE1-CZ2 3.82Å; F156-W158 HydrophobicContact CE1-CZ2 3.82Å; F156-W158 HydrophobicContact CE1-CZ3 4.02Å; F156-W158 PolarHBondContact O-N 3.17Å; W158-K164 WeakPolarHBondContact O-CE 3.46Å; W158-H175 AromaticContact CD1-ND1 3.99Å; W158-H175 HydrophobicContact CZ2-CB 4.33Å; W158-H175 AromaticContact NE1-CG 3.99Å; W158-H175 AromaticContact NE1-ND1 3.22Å; W158-H175 PolarHBondContact NE1-ND1 2.81Å; W158-F233 AromaticContact CE3-CD2 3.92Å; W158-F233 HydrophobicContact CE3-CD2 3.92Å; W158-F233 HydrophobicContact CZ3-CB 4.19Å; W158-F233 HydrophobicContact CZ3-CD2 4.08Å; W158-L234 HydrophobicContact CH2-CD2 3.98Å; W158-L234 HydrophobicContact CZ2-CD2 3.77Å
159	N	69.7	Low	72.3	Confident	95 Å²	95	70.7 Å²	70.7	51%	0.508	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.7	-177.8	-67.1	-49.5	0	0	0	113.1	D101 D157 E161	D101-N159 PolarHBondContact OD2-ND2 3.33Å; D157-N159 VanDerWaalsContact C-N 3.28Å; D157-N159 PolarHBondContact O-N 2.93Å; D157-N159 WeakPolarHBondContact OD1-CA 3.43Å; D157-N159 WeakPolarHBondContact OD1-CB 3.1Å; D157-N159 PolarHBondContact OD1-N 3.17Å; N159-E161 PolarHBondContact O-N 3.43Å
160	N	73.3	Confident	70.2	Confident	69 Å²	69	78.9 Å²	78.9	37%	0.369	40%	0.402	S	S	.	.			trans	-77	111.2	-179.2	-169.8	-25.7	0	0	0	112.7	D157 T162 A163 K164	D157-N160 HydrophobicContact CB-CB 4.47Å; N160-T162 VanDerWaalsContact C-N 3.25Å; N160-T162 PolarHBondContact O-N 3.19Å; N160-T162 VanDerWaalsContact OD1-CB 3.24Å; N160-T162 WeakPolarHBondContact OD1-CB 3.39Å; N160-T162 PolarHBondContact OD1-N 2.8Å; N160-T162 PolarHBondContact OD1-OG1 2.65Å; N160-A163 HydrophobicContact CB-CB 4.02Å; N160-A163 WeakPolarHBondContact O-CA 3.43Å; N160-A163 VanDerWaalsContact O-CB 3.26Å; N160-A163 WeakPolarHBondContact O-CB 3.47Å; N160-A163 PolarHBondContact O-N 3.06Å; N160-K164 PolarHBondContact O-N 3.27Å
161	E	59	Low	68.3	Low	124 Å²	124	83.7 Å²	83.7	58%	0.579	43%	0.427	S	S	*	.	H	α-helix	trans	-56.9	-32.9	178.2	-63.8	-56.1	137.5	0	0	114.2	N159 A163 K164 A165	N159-E161 PolarHBondContact O-N 3.43Å; E161-A163 PolarHBondContact O-N 2.93Å; E161-K164 PolarHBondContact O-N 2.83Å; E161-K164 IonicContact OE1-NZ 3.69Å; E161-K164 PolarHBondContact OE1-NZ 3.14Å; E161-A165 WeakPolarHBondContact O-CB 3.5Å; E161-A165 PolarHBondContact O-N 3.12Å
162	T	59.3	Low	66.8	Low	116 Å²	116	81.8 Å²	81.8	71%	0.712	42%	0.418	S	S	*	.	H	α-helix	trans	-63.8	-33.3	176	-34.6	0	0	0	0	111.3	N160	N160-T162 VanDerWaalsContact C-N 3.25Å; N160-T162 PolarHBondContact O-N 3.19Å; N160-T162 VanDerWaalsContact OD1-CB 3.24Å; N160-T162 WeakPolarHBondContact OD1-CB 3.39Å; N160-T162 PolarHBondContact OD1-N 2.8Å; N160-T162 PolarHBondContact OD1-OG1 2.65Å
163	A	53.8	Low	66	Low	21 Å²	21	82.8 Å²	82.8	17%	0.174	42%	0.421	C	S	.	.	H	α-helix	trans	-78.8	-49	179.7	0	0	0	0	0	109.1	N160 E161 A165 S166 H169	N160-A163 HydrophobicContact CB-CB 4.02Å; N160-A163 WeakPolarHBondContact O-CA 3.43Å; N160-A163 VanDerWaalsContact O-CB 3.26Å; N160-A163 WeakPolarHBondContact O-CB 3.47Å; N160-A163 PolarHBondContact O-N 3.06Å; E161-A163 PolarHBondContact O-N 2.93Å; A163-A165 PolarHBondContact O-N 2.7Å; A163-A165 VanDerWaalsContact O-N 3.16Å; A163-S166 WeakPolarHBondContact O-CA 3.49Å; A163-S166 WeakPolarHBondContact O-CB 3.02Å; A163-S166 PolarHBondContact O-N 3.24Å; A163-S166 PolarHBondContact O-OG 3.42Å; A163-H169 VanDerWaalsContact C-CD2 3.42Å; A163-H169 VanDerWaalsContact C-CE1 3.47Å; A163-H169 WeakPolarHBondContact CA-NE2 3.39Å; A163-H169 WeakPolarHBondContact CB-CE1 3.29Å; A163-H169 WeakPolarHBondContact CB-NE2 3.3Å; A163-H169 PolarHBondContact O-CD2 3.31Å; A163-H169 PolarHBondContact O-NE2 3.38Å; A163-H169 VanDerWaalsContact O-NE2 3.07Å
164	K	53.4	Low	65.6	Low	96 Å²	96	79.3 Å²	79.3	42%	0.417	40%	0.403	S	S	.	.	H	α-helix	trans	-52.2	-36.2	172.4	-65.6	179.3	-171.3	168.7	0	113.8	W158 N160 E161 S166	W158-K164 WeakPolarHBondContact O-CE 3.46Å; N160-K164 PolarHBondContact O-N 3.27Å; E161-K164 PolarHBondContact O-N 2.83Å; E161-K164 IonicContact OE1-NZ 3.69Å; E161-K164 PolarHBondContact OE1-NZ 3.14Å; K164-S166 PolarHBondContact O-N 2.96Å
165	A	48.8	Very low	65.5	Low	83 Å²	83	77.1 Å²	77.1	69%	0.686	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-25	176	0	0	0	0	0	113.3	E161 A163 K167	E161-A165 WeakPolarHBondContact O-CB 3.5Å; E161-A165 PolarHBondContact O-N 3.12Å; A163-A165 PolarHBondContact O-N 2.7Å; A163-A165 VanDerWaalsContact O-N 3.16Å; A165-K167 PolarHBondContact O-N 2.94Å
166	S	52.4	Low	65.6	Low	47 Å²	47	74.4 Å²	74.4	33%	0.329	38%	0.376	S	S	.	.	S	Bend	trans	-75.9	111.6	165.7	79.4	0	0	0	0	109.2	A163 K164 Q168 H169	A163-S166 WeakPolarHBondContact O-CA 3.49Å; A163-S166 WeakPolarHBondContact O-CB 3.02Å; A163-S166 PolarHBondContact O-N 3.24Å; A163-S166 PolarHBondContact O-OG 3.42Å; K164-S166 PolarHBondContact O-N 2.96Å; S166-Q168 PolarHBondContact O-N 3.41Å; S166-H169 PolarHBondContact O-N 3.38Å; S166-H169 PolarHBondContact OG-CD2 3.32Å; S166-H169 VanDerWaalsContact OG-CD2 3.31Å
167	K	49.3	Very low	66.1	Low	152 Å²	152	72.4 Å²	72.4	66%	0.661	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-12.5	177.6	-66.9	-174.1	176.3	-175.2	0	113.8	A165 H169 K170	A165-K167 PolarHBondContact O-N 2.94Å; K167-H169 PolarHBondContact O-N 3Å; K167-K170 PolarHBondContact O-N 2.99Å; K167-K170 VanDerWaalsContact O-N 3.1Å
168	Q	46.6	Very low	66.7	Low	116 Å²	116	70.8 Å²	70.8	54%	0.542	36%	0.361	S	S	.	.	H	α-helix	trans	-55.5	-27.2	170.5	-157.2	169.8	11.7	0	0	113.4	S166 K170 L171 K172	S166-Q168 PolarHBondContact O-N 3.41Å; Q168-K170 VanDerWaalsContact C-N 3.33Å; Q168-K170 PolarHBondContact O-N 3.47Å; Q168-L171 PolarHBondContact O-N 3.36Å; Q168-K172 HydrophobicContact CG-CD 4.42Å; Q168-K172 HydrophobicContact CG-CG 4.29Å; Q168-K172 WeakPolarHBondContact O-CG 3.43Å; Q168-K172 PolarHBondContact O-N 2.98Å
169	H	50.2	Low	67.8	Low	23 Å²	23	69.8 Å²	69.8	11%	0.106	36%	0.357	C	S	.	.	H	α-helix	trans	-64.6	-32.4	174.1	-78.9	-124.1	0	0	0	113.5	F156 A163 S166 K167 L171	F156-H169 AromaticContact CE1-CE1 3.43Å; F156-H169 VanDerWaalsContact CE1-CE1 3.43Å; F156-H169 WeakPolarHBondContact CE1-CE1 2.92Å; F156-H169 AromaticContact CE1-ND1 3.7Å; F156-H169 AromaticContact CE2-CE1 3.77Å; F156-H169 AromaticContact CE2-NE2 3.62Å; F156-H169 AromaticContact CZ-CD2 3.75Å; F156-H169 AromaticContact CZ-CE1 3.01Å; F156-H169 WeakPolarHBondContact CZ-CE1 3.41Å; F156-H169 AromaticContact CZ-CG 3.97Å; F156-H169 AromaticContact CZ-ND1 3.54Å; F156-H169 AromaticContact CZ-NE2 3.13Å; F156-H169 WeakPolarHBondContact CZ-NE2 3.34Å; A163-H169 VanDerWaalsContact C-CD2 3.42Å; A163-H169 VanDerWaalsContact C-CE1 3.47Å; A163-H169 WeakPolarHBondContact CA-NE2 3.39Å; A163-H169 WeakPolarHBondContact CB-CE1 3.29Å; A163-H169 WeakPolarHBondContact CB-NE2 3.3Å; A163-H169 PolarHBondContact O-CD2 3.31Å; A163-H169 PolarHBondContact O-NE2 3.38Å; A163-H169 VanDerWaalsContact O-NE2 3.07Å; S166-H169 PolarHBondContact O-N 3.38Å; S166-H169 PolarHBondContact OG-CD2 3.32Å; S166-H169 VanDerWaalsContact OG-CD2 3.31Å; K167-H169 PolarHBondContact O-N 3Å; H169-L171 VanDerWaalsContact C-N 3.26Å; H169-L171 PolarHBondContact O-N 2.84Å
170	K	51.5	Low	69	Low	173 Å²	173	66.2 Å²	66.2	75%	0.752	34%	0.338	S	S	*	.	H	α-helix	trans	-75.6	-16.7	176.3	-64.7	-167.2	176.7	-168.9	0	112.6	K167 Q168	K167-K170 PolarHBondContact O-N 2.99Å; K167-K170 VanDerWaalsContact O-N 3.1Å; Q168-K170 VanDerWaalsContact C-N 3.33Å; Q168-K170 PolarHBondContact O-N 3.47Å
171	L	54.9	Low	70.1	Confident	101 Å²	101	68.3 Å²	68.3	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-100.3	-29.5	-177.6	-64.7	167.2	0	0	0	112.5	E36 Q168 H169 R173	E36-L171 HydrophobicContact CB-CD2 4.48Å; E36-L171 HydrophobicContact CG-CD2 4.48Å; Q168-L171 PolarHBondContact O-N 3.36Å; H169-L171 VanDerWaalsContact C-N 3.26Å; H169-L171 PolarHBondContact O-N 2.84Å; L171-R173 PolarHBondContact O-N 3.49Å; L171-R173 VanDerWaalsContact O-N 3.09Å
172	K	65.3	Low	71.8	Confident	38 Å²	38	62.9 Å²	62.9	17%	0.165	33%	0.327	C	S	.	.			trans	-79.7	86.3	175.3	-70.3	-169.9	174.9	-151	0	111.1	Q168 Y174	Q168-K172 HydrophobicContact CG-CD 4.42Å; Q168-K172 HydrophobicContact CG-CG 4.29Å; Q168-K172 WeakPolarHBondContact O-CG 3.43Å; Q168-K172 PolarHBondContact O-N 2.98Å; K172-Y174 HydrophobicContact CB-CD1 4.24Å; K172-Y174 HydrophobicContact CB-CE1 3.99Å; K172-Y174 HydrophobicContact CD-CE1 4.26Å; K172-Y174 HydrophobicContact CD-CE2 3.99Å; K172-Y174 WeakPolarHBondContact CD-OH 3.38Å; K172-Y174 WeakPolarHBondContact CE-OH 3.46Å; K172-Y174 HydrophobicContact CG-CE1 3.81Å; K172-Y174 HydrophobicContact CG-CE2 4.42Å; K172-Y174 PolarHBondContact NZ-OH 2.84Å; K172-Y174 PolarHBondContact O-N 3.35Å
173	R	79.4	Confident	73.4	Confident	105 Å²	105	58.8 Å²	58.8	40%	0.396	30%	0.303	S	S	.	.			trans	-72.1	36.8	168.3	-57.9	179.5	-174.7	153.1	4	112.5	E40 L171	E40-R173 IonicContact OE1-CZ 3.44Å; E40-R173 IonicContact OE1-NH2 2.64Å; E40-R173 PolarHBondContact OE1-NH2 3.17Å; L171-R173 PolarHBondContact O-N 3.49Å; L171-R173 VanDerWaalsContact O-N 3.09Å
174	Y	88	Confident	75.4	Confident	43 Å²	43	65.9 Å²	65.9	17%	0.169	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	148.6	178.9	63.9	-96.4	0	0	0	111	K172 R197 F198	K172-Y174 HydrophobicContact CB-CD1 4.24Å; K172-Y174 HydrophobicContact CB-CE1 3.99Å; K172-Y174 HydrophobicContact CD-CE1 4.26Å; K172-Y174 HydrophobicContact CD-CE2 3.99Å; K172-Y174 WeakPolarHBondContact CD-OH 3.38Å; K172-Y174 WeakPolarHBondContact CE-OH 3.46Å; K172-Y174 HydrophobicContact CG-CE1 3.81Å; K172-Y174 HydrophobicContact CG-CE2 4.42Å; K172-Y174 PolarHBondContact NZ-OH 2.84Å; K172-Y174 PolarHBondContact O-N 3.35Å; Y174-R197 HydrophobicContact CD2-CB 3.74Å; Y174-R197 HydrophobicContact CD2-CG 3.63Å; Y174-R197 HydrophobicContact CE2-CB 4.26Å; Y174-R197 HydrophobicContact CE2-CG 3.62Å; Y174-R197 HydrophobicContact CG-CB 4.15Å; Y174-R197 HydrophobicContact CG-CG 4.37Å; Y174-F198 WeakPolarHBondContact CA-O 3.36Å; Y174-F198 WeakPolarHBondContact CB-O 3.38Å
175	H	90.1	Very high	77.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	134.8	168.9	172.1	69.2	0	0	0	109.9	I102 L106 F156 W158 R197 F198 L234	I102-H175 HydrophobicContact CG2-CB 3.68Å; L106-H175 VanDerWaalsContact CD1-CD2 3.48Å; L106-H175 WeakPolarHBondContact CD1-CD2 3.31Å; F156-H175 PolarHBondContact O-CE1 3.26Å; W158-H175 AromaticContact CD1-ND1 3.99Å; W158-H175 HydrophobicContact CZ2-CB 4.33Å; W158-H175 AromaticContact NE1-CG 3.99Å; W158-H175 AromaticContact NE1-ND1 3.22Å; W158-H175 PolarHBondContact NE1-ND1 2.81Å; H175-R197 CarbonylContact O-C 3.56Å; H175-R197 WeakPolarHBondContact O-CA 3.33Å; H175-F198 HydrophobicContact CB-CB 4.43Å; H175-F198 AromaticContact CD2-CD2 3.87Å; H175-F198 PolarHBondContact N-O 3.37Å; H175-F198 PolarHBondContact O-N 3Å; H175-L234 HydrophobicContact CB-CD1 4.04Å
176	S	91.8	Very high	79.3	Confident	13 Å²	13	63.8 Å²	63.8	9%	0.091	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.5	-178.8	55.8	0	0	0	0	112.6	F156 V196	F156-S176 VanDerWaalsContact CB-O 3.23Å; F156-S176 WeakPolarHBondContact CB-O 3.37Å; F156-S176 WeakPolarHBondContact CB-OG 3.42Å; F156-S176 PolarHBondContact N-O 3.4Å; S176-V196 CarbonylContact C-O 3.59Å; S176-V196 VanDerWaalsContact CA-O 3.27Å; S176-V196 WeakPolarHBondContact CA-O 3.16Å
177	Q	94.3	Very high	81.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.4	167.1	-70.3	-174	-20.6	0	0	110.6	Y128 Y152 E155 Y179 V196 F198	Y128-Q177 PolarHBondContact OH-NE2 2.88Å; Y152-Q177 HydrophobicContact CE2-CG 4.28Å; E155-Q177 HydrophobicContact CB-CG 3.75Å; E155-Q177 PolarHBondContact OE2-NE2 3.31Å; E155-Q177 VanDerWaalsContact OE2-NE2 3.14Å; Q177-Y179 HydrophobicContact CB-CD2 4.3Å; Q177-Y179 HydrophobicContact CB-CE2 3.64Å; Q177-Y179 PolarHBondContact OE1-OH 3.23Å; Q177-V196 HydrophobicContact CB-CB 4.47Å; Q177-V196 PolarHBondContact N-O 3.41Å; Q177-V196 PolarHBondContact O-N 2.74Å; Q177-F198 HydrophobicContact CB-CE2 4.22Å; Q177-F198 HydrophobicContact CG-CE2 3.8Å
178	T	95.4	Very high	83	Confident	51 Å²	51	63.9 Å²	63.9	31%	0.313	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.8	-179.5	-39.1	0	0	0	0	109.9	E153 S154 V180	E153-T178 PolarHBondContact N-O 2.93Å; E153-T178 VanDerWaalsContact N-O 3.11Å; S154-T178 PolarHBondContact N-O 2.88Å; S154-T178 PolarHBondContact O-N 2.82Å; S154-T178 PolarHBondContact OG-OG1 3Å; T178-V180 HydrophobicContact CG2-CG1 3.87Å
179	Y	97	Very high	85.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.7	176.9	-68.1	-112.4	0	0	0	108.5	F126 G129 I132 H151 Y152 Q177 E193 T194 V196	F126-Y179 HydrophobicContact CE2-CE1 4.18Å; F126-Y179 HydrophobicContact CE2-CE2 4.03Å; F126-Y179 AromaticContact CE2-CZ 3.65Å; G129-Y179 PolarHBondContact N-OH 3.15Å; I132-Y179 HydrophobicContact CD1-CD1 3.83Å; I132-Y179 HydrophobicContact CD1-CD2 3.88Å; I132-Y179 HydrophobicContact CD1-CE1 4.34Å; I132-Y179 HydrophobicContact CD1-CE2 4.4Å; I132-Y179 HydrophobicContact CD1-CG 3.61Å; I132-Y179 HydrophobicContact CG1-CD1 3.66Å; I132-Y179 HydrophobicContact CG1-CE1 4.1Å; I132-Y179 HydrophobicContact CG1-CG 3.97Å; H151-Y179 CarbonylContact O-C 3.59Å; H151-Y179 WeakPolarHBondContact O-CA 3.37Å; Y152-Y179 HydrophobicContact CD2-CE1 4.2Å; Y152-Y179 HydrophobicContact CD2-CE2 4.17Å; Y152-Y179 AromaticContact CD2-CZ 3.79Å; Y152-Y179 HydrophobicContact CG-CE1 4.45Å; Y152-Y179 VanDerWaalsContact N-CD1 3.31Å; Q177-Y179 HydrophobicContact CB-CD2 4.3Å; Q177-Y179 HydrophobicContact CB-CE2 3.64Å; Q177-Y179 PolarHBondContact OE1-OH 3.23Å; Y179-E193 CarbonylContact O-C 3.59Å; Y179-E193 WeakPolarHBondContact O-CA 3.31Å; Y179-T194 PolarHBondContact N-O 3.08Å; Y179-T194 PolarHBondContact O-N 2.75Å; Y179-V196 HydrophobicContact CD2-CB 4.39Å; Y179-V196 HydrophobicContact CD2-CG2 3.62Å; Y179-V196 HydrophobicContact CE2-CB 4.1Å; Y179-V196 HydrophobicContact CE2-CG2 3.61Å
180	V	96	Very high	87.2	Confident	19 Å²	19	64 Å²	64	12%	0.115	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	-175.2	-173.7	-56.5	0	0	0	0	111.5	G150 H151 E153 T178 G182 E193	G150-V180 CarbonylContact C-O 3.36Å; G150-V180 WeakPolarHBondContact CA-O 3.33Å; H151-V180 PolarHBondContact N-O 2.97Å; H151-V180 PolarHBondContact O-N 3.46Å; E153-V180 HydrophobicContact CB-CG2 3.78Å; E153-V180 VanDerWaalsContact CD-CG2 3.41Å; E153-V180 HydrophobicContact CG-CG2 4.13Å; E153-V180 WeakPolarHBondContact OE1-CG2 3.24Å; E153-V180 WeakPolarHBondContact OE2-CG2 3.47Å; T178-V180 HydrophobicContact CG2-CG1 3.87Å; V180-G182 PolarHBondContact O-N 3.17Å; V180-E193 HydrophobicContact CG1-CB 4.27Å
181	N	95.1	Very high	89.3	Confident	114 Å²	114	58.8 Å²	58.8	61%	0.61	32%	0.315	S	S	*	.	S	Bend	trans	57.7	31.2	179.4	-62.5	-46.8	0	0	0	113.9
182	G	94.4	Very high	91.2	Very high	9 Å²	9	54.7 Å²	54.7	9%	0.093	29%	0.293	C	S	.	.			trans	-66.1	178	172.5	0	0	0	0	0	113.1	F148 V180 P191 R192	F148-G182 CarbonylContact O-C 3.54Å; F148-G182 WeakPolarHBondContact O-CA 3.32Å; V180-G182 PolarHBondContact O-N 3.17Å; G182-P191 WeakPolarHBondContact O-CB 3.4Å; G182-R192 WeakPolarHBondContact CA-O 3.42Å; G182-R192 PolarHBondContact N-O 2.98Å
183	S	94.4	Very high	92.7	Very high	31 Å²	31	56.1 Å²	56.1	22%	0.217	30%	0.3	C	S	.	.	S	Bend	trans	-53.3	144	174.2	59.3	0	0	0	0	111.5	F148 C185 R192	F148-S183 PolarHBondContact N-OG 2.94Å; F148-S183 PolarHBondContact O-N 3.14Å; F148-S183 PolarHBondContact O-OG 2.98Å; S183-C185 PolarHBondContact O-N 2.81Å; S183-R192 WeakPolarHBondContact O-CG 3.28Å; S183-R192 PolarHBondContact O-N 3.29Å; S183-R192 PolarHBondContact O-NH1 3.29Å; S183-R192 PolarHBondContact OG-NH1 3.48Å
184	K	94.3	Very high	93.5	Very high	170 Å²	170	51.3 Å²	51.3	74%	0.739	28%	0.282	S	S	*	.	B	Isolated β-bridge	trans	-63.8	133	-177.5	-67.7	-172.7	179.9	-175.4	0	111.2	R192	K184-R192 PolarHBondContact O-NH1 3.29Å
185	C	92.9	Very high	93.9	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.027	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-68.6	131.8	170.2	-165.5	0	0	0	0	109.8	S183 N188 G189 N190 C217	S183-C185 PolarHBondContact O-N 2.81Å; C185-N188 WeakPolarHBondContact CB-OD1 3.46Å; C185-N188 PolarHBondContact SG-OD1 3.05Å; C185-G189 WeakPolarHBondContact O-CA 3.42Å; C185-G189 PolarHBondContact O-N 3.23Å; C185-N190 VanDerWaalsContact CB-O 3.23Å; C185-N190 WeakPolarHBondContact CB-O 3.31Å; C185-N190 PolarHBondContact N-O 2.88Å; C185-C217 HydrophobicContact CB-CB 3.56Å; C185-C217 WeakPolarHBondContact CB-SG 3.43Å; C185-C217 WeakPolarHBondContact SG-CB 3.24Å; C185-C217 CovalentContact SG-SG 2.03Å; C185-C217 PolarHBondContact SG-SG 2.59Å
186	D	91.4	Very high	94.2	Very high	131 Å²	131	51.5 Å²	51.5	70%	0.701	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-36.4	173.6	58.3	-42.4	0	0	0	112	R192	D186-R192 IonicContact OD1-NH2 2.7Å
187	L	90.7	Very high	94.3	Very high	126 Å²	126	54.1 Å²	54.1	66%	0.66	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-36.9	-177.2	-62.4	174.4	0	0	0	114.2
188	N	90	Very high	94.3	Very high	74 Å²	74	54.1 Å²	54.1	40%	0.396	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-4.2	-172.9	70.2	25.7	0	0	0	115.1	C185 N190	C185-N188 WeakPolarHBondContact CB-OD1 3.46Å; C185-N188 PolarHBondContact SG-OD1 3.05Å; N188-N190 PolarHBondContact O-N 3.29Å; N188-N190 VanDerWaalsContact OD1-CB 3.28Å; N188-N190 WeakPolarHBondContact OD1-CB 3.4Å; N188-N190 PolarHBondContact OD1-N 3.08Å; N188-N190 PolarHBondContact OD1-ND2 2.85Å
189	G	91.4	Very high	94.1	Very high	46 Å²	46	53.6 Å²	53.6	47%	0.474	29%	0.289	S	S	.	.			trans	75	-9.9	179.2	0	0	0	0	0	116.2	C185	C185-G189 WeakPolarHBondContact O-CA 3.42Å; C185-G189 PolarHBondContact O-N 3.23Å
190	N	93.4	Very high	93.7	Very high	97 Å²	97	54 Å²	54	52%	0.519	29%	0.292	S	S	.	.	S	Bend	trans	-74.4	153	179.7	-61.5	-41.2	0	0	0	110.9	C185 N188	C185-N190 VanDerWaalsContact CB-O 3.23Å; C185-N190 WeakPolarHBondContact CB-O 3.31Å; C185-N190 PolarHBondContact N-O 2.88Å; N188-N190 PolarHBondContact O-N 3.29Å; N188-N190 VanDerWaalsContact OD1-CB 3.28Å; N188-N190 WeakPolarHBondContact OD1-CB 3.4Å; N188-N190 PolarHBondContact OD1-N 3.08Å; N188-N190 PolarHBondContact OD1-ND2 2.85Å
191	P	95.4	Very high	93.4	Very high	62 Å²	62	55.7 Å²	55.7	40%	0.403	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-62.6	143.1	167.5	28.7	-34.2	0	0	0	110.2	G182	G182-P191 WeakPolarHBondContact O-CB 3.4Å
192	R	95.5	Very high	92.7	Very high	16 Å²	16	55.1 Å²	55.1	6%	0.06	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-62.6	144.8	169.5	-73	173.7	179.3	82	5.9	110.6	L149 G182 S183 K184 D186 C217 Y219	L149-R192 CarbonylContact O-C 3.37Å; G182-R192 WeakPolarHBondContact CA-O 3.42Å; G182-R192 PolarHBondContact N-O 2.98Å; S183-R192 WeakPolarHBondContact O-CG 3.28Å; S183-R192 PolarHBondContact O-N 3.29Å; S183-R192 PolarHBondContact O-NH1 3.29Å; S183-R192 PolarHBondContact OG-NH1 3.48Å; K184-R192 PolarHBondContact O-NH1 3.29Å; D186-R192 IonicContact OD1-NH2 2.7Å; R192-C217 WeakPolarHBondContact CA-O 3.34Å; R192-C217 HydrophobicContact CG-CB 3.77Å; R192-Y219 HydrophobicContact CB-CE2 4.44Å; R192-Y219 HydrophobicContact CG-CE2 4.16Å
193	E	95.9	Very high	91.7	Very high	68 Å²	68	58.9 Å²	58.9	32%	0.318	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155.7	173.8	60.5	171.5	-132.1	0	0	111.3	L149 Y179 V180 C217 R218 Y219	L149-E193 CarbonylContact O-C 3.58Å; L149-E193 WeakPolarHBondContact O-CA 3.3Å; L149-E193 PolarHBondContact O-N 2.86Å; Y179-E193 CarbonylContact O-C 3.59Å; Y179-E193 WeakPolarHBondContact O-CA 3.31Å; V180-E193 HydrophobicContact CG1-CB 4.27Å; E193-C217 PolarHBondContact N-O 2.88Å; E193-R218 HydrophobicContact CG-CB 4.34Å; E193-R218 HydrophobicContact CG-CG 3.98Å; E193-R218 WeakPolarHBondContact O-CA 3.15Å; E193-R218 IonicContact OE1-CZ 3.13Å; E193-R218 IonicContact OE1-NE 2.71Å; E193-R218 PolarHBondContact OE1-NE 3.31Å; E193-R218 IonicContact OE1-NH2 2.7Å; E193-R218 PolarHBondContact OE1-NH2 3.43Å; E193-Y219 PolarHBondContact O-N 2.69Å
194	T	97.1	Very high	90.8	Very high	3 Å²	3	58.6 Å²	58.6	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	130.8	-175.5	-54.9	0	0	0	0	111.7	I132 L149 Y179 V196 Y219 L221	I132-T194 HydrophobicContact CD1-CG2 3.54Å; L149-T194 WeakPolarHBondContact CB-OG1 3.42Å; L149-T194 PolarHBondContact O-OG1 3.18Å; Y179-T194 PolarHBondContact N-O 3.08Å; Y179-T194 PolarHBondContact O-N 2.75Å; T194-V196 HydrophobicContact CG2-CG2 4.06Å; T194-Y219 CarbonylContact C-O 3.56Å; T194-Y219 VanDerWaalsContact CA-O 3.31Å; T194-Y219 WeakPolarHBondContact CA-O 3.22Å; T194-L221 HydrophobicContact CG2-CB 4.48Å; T194-L221 HydrophobicContact CG2-CD1 3.8Å
195	E	95.9	Very high	90.4	Very high	48 Å²	48	55 Å²	55	22%	0.224	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.3	163.8	-170.6	-166.1	159.8	0	0	109.1	R197 Y219 V220 L221	E195-R197 VanDerWaalsContact CD-NE 3.28Å; E195-R197 HydrophobicContact CG-CG 4.34Å; E195-R197 IonicContact OE1-CZ 3.45Å; E195-R197 IonicContact OE1-NE 3.82Å; E195-R197 PolarHBondContact OE1-NE 3.1Å; E195-R197 IonicContact OE1-NH2 2.69Å; E195-R197 PolarHBondContact OE1-NH2 3.07Å; E195-R197 IonicContact OE2-CZ 3.47Å; E195-R197 IonicContact OE2-NE 3.64Å; E195-R197 PolarHBondContact OE2-NE 3.3Å; E195-R197 IonicContact OE2-NH2 2.98Å; E195-R197 PolarHBondContact OE2-NH2 3.25Å; E195-Y219 PolarHBondContact N-O 3.47Å; E195-V220 CarbonylContact O-C 3.52Å; E195-V220 VanDerWaalsContact O-CA 3.32Å; E195-V220 WeakPolarHBondContact O-CA 3.43Å; E195-L221 PolarHBondContact O-N 2.96Å
196	V	96	Very high	90.3	Very high	0 Å²	0	56 Å²	56	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.5	174.7	-176.4	0	0	0	0	109.1	F126 I132 S176 Q177 Y179 T194 F198 L221 V223	F126-V196 HydrophobicContact CD2-CG1 4.46Å; F126-V196 HydrophobicContact CD2-CG2 4.16Å; F126-V196 HydrophobicContact CE2-CB 4.36Å; F126-V196 HydrophobicContact CE2-CG1 3.92Å; F126-V196 HydrophobicContact CE2-CG2 3.78Å; F126-V196 HydrophobicContact CZ-CG1 4Å; I132-V196 HydrophobicContact CD1-CG2 3.46Å; I132-V196 VanDerWaalsContact CD1-CG2 3.46Å; S176-V196 CarbonylContact C-O 3.59Å; S176-V196 VanDerWaalsContact CA-O 3.27Å; S176-V196 WeakPolarHBondContact CA-O 3.16Å; Q177-V196 HydrophobicContact CB-CB 4.47Å; Q177-V196 PolarHBondContact N-O 3.41Å; Q177-V196 PolarHBondContact O-N 2.74Å; Y179-V196 HydrophobicContact CD2-CB 4.39Å; Y179-V196 HydrophobicContact CD2-CG2 3.62Å; Y179-V196 HydrophobicContact CE2-CB 4.1Å; Y179-V196 HydrophobicContact CE2-CG2 3.61Å; T194-V196 HydrophobicContact CG2-CG2 4.06Å; V196-F198 HydrophobicContact CB-CE2 4.34Å; V196-F198 HydrophobicContact CG1-CD2 4.39Å; V196-F198 HydrophobicContact CG1-CE1 4.42Å; V196-F198 HydrophobicContact CG1-CE2 3.76Å; V196-F198 HydrophobicContact CG1-CZ 3.78Å; V196-L221 CarbonylContact C-O 3.57Å; V196-L221 WeakPolarHBondContact CA-O 3.14Å; V196-L221 HydrophobicContact CG1-CB 4.47Å; V196-L221 HydrophobicContact CG2-CB 4.26Å; V196-V223 HydrophobicContact CG1-CG2 3.79Å
197	R	94.3	Very high	90.5	Very high	68 Å²	68	54 Å²	54	26%	0.257	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.4	-177.5	-60.9	-176.4	178.7	152.8	10.2	110	Y174 H175 E195 V220 L221 T222 V223	Y174-R197 HydrophobicContact CD2-CB 3.74Å; Y174-R197 HydrophobicContact CD2-CG 3.63Å; Y174-R197 HydrophobicContact CE2-CB 4.26Å; Y174-R197 HydrophobicContact CE2-CG 3.62Å; Y174-R197 HydrophobicContact CG-CB 4.15Å; Y174-R197 HydrophobicContact CG-CG 4.37Å; H175-R197 CarbonylContact O-C 3.56Å; H175-R197 WeakPolarHBondContact O-CA 3.33Å; E195-R197 VanDerWaalsContact CD-NE 3.28Å; E195-R197 HydrophobicContact CG-CG 4.34Å; E195-R197 IonicContact OE1-CZ 3.45Å; E195-R197 IonicContact OE1-NE 3.82Å; E195-R197 PolarHBondContact OE1-NE 3.1Å; E195-R197 IonicContact OE1-NH2 2.69Å; E195-R197 PolarHBondContact OE1-NH2 3.07Å; E195-R197 IonicContact OE2-CZ 3.47Å; E195-R197 IonicContact OE2-NE 3.64Å; E195-R197 PolarHBondContact OE2-NE 3.3Å; E195-R197 IonicContact OE2-NH2 2.98Å; E195-R197 PolarHBondContact OE2-NH2 3.25Å; R197-V220 HydrophobicContact CG-CG1 4.41Å; R197-L221 PolarHBondContact N-O 3.32Å; R197-T222 WeakPolarHBondContact O-CA 3.41Å; R197-V223 PolarHBondContact O-N 2.88Å
198	F	92.9	Very high	90.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	112.4	174.3	-60.4	-90.2	0	0	0	109.5	L106 M109 F126 Y128 Y174 H175 Q177 V196 V223 T225	L106-F198 HydrophobicContact CD1-CB 4.39Å; L106-F198 HydrophobicContact CD1-CD1 4.25Å; L106-F198 HydrophobicContact CD1-CD2 4.06Å; L106-F198 HydrophobicContact CD1-CE2 4.44Å; L106-F198 HydrophobicContact CD1-CG 3.96Å; L106-F198 HydrophobicContact CD2-CD1 3.78Å; L106-F198 HydrophobicContact CD2-CE1 4.23Å; L106-F198 HydrophobicContact CD2-CG 4.2Å; M109-F198 HydrophobicContact CE-CE1 4.2Å; M109-F198 HydrophobicContact SD-CD1 4.49Å; M109-F198 HydrophobicContact SD-CE1 4.15Å; F126-F198 HydrophobicContact CE1-CE1 4.14Å; F126-F198 HydrophobicContact CE1-CZ 4.11Å; F126-F198 HydrophobicContact CZ-CE1 4.27Å; F126-F198 AromaticContact CZ-CZ 3.76Å; F126-F198 HydrophobicContact CZ-CZ 3.76Å; Y128-F198 AromaticContact CD2-CE1 3.85Å; Y128-F198 HydrophobicContact CD2-CE1 3.85Å; Y128-F198 AromaticContact CD2-CZ 3.58Å; Y128-F198 HydrophobicContact CD2-CZ 3.58Å; Y128-F198 AromaticContact CE2-CE1 3.97Å; Y128-F198 HydrophobicContact CE2-CE1 3.97Å; Y128-F198 HydrophobicContact CE2-CE2 4.25Å; Y128-F198 AromaticContact CE2-CZ 3.56Å; Y128-F198 HydrophobicContact CE2-CZ 3.56Å; Y174-F198 WeakPolarHBondContact CA-O 3.36Å; Y174-F198 WeakPolarHBondContact CB-O 3.38Å; H175-F198 HydrophobicContact CB-CB 4.43Å; H175-F198 AromaticContact CD2-CD2 3.87Å; H175-F198 PolarHBondContact N-O 3.37Å; H175-F198 PolarHBondContact O-N 3Å; Q177-F198 HydrophobicContact CB-CE2 4.22Å; Q177-F198 HydrophobicContact CG-CE2 3.8Å; V196-F198 HydrophobicContact CB-CE2 4.34Å; V196-F198 HydrophobicContact CG1-CD2 4.39Å; V196-F198 HydrophobicContact CG1-CE1 4.42Å; V196-F198 HydrophobicContact CG1-CE2 3.76Å; V196-F198 HydrophobicContact CG1-CZ 3.78Å; F198-V223 WeakPolarHBondContact CA-O 3.47Å; F198-V223 HydrophobicContact CD1-CB 4.01Å; F198-V223 HydrophobicContact CD1-CG1 3.99Å; F198-V223 HydrophobicContact CE1-CB 4.23Å; F198-V223 HydrophobicContact CE1-CG1 4.11Å; F198-T225 HydrophobicContact CB-CG2 4.31Å; F198-T225 HydrophobicContact CD1-CG2 4.25Å
199	V	91.6	Very high	90.8	Very high	40 Å²	40	45.8 Å²	45.8	24%	0.242	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.1	177.5	-178.7	0	0	0	0	108.2	T222 V223 H224 T225	V199-T222 HydrophobicContact CB-CG2 4.45Å; V199-T222 HydrophobicContact CG2-CG2 3.65Å; V199-V223 PolarHBondContact N-O 2.97Å; V199-H224 WeakPolarHBondContact O-CA 3.44Å; V199-T225 PolarHBondContact O-N 3.42Å
200	C	89.8	Confident	90.9	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.054	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	132	171.5	158.1	0	0	0	0	110.3	T225 C229 L234 P236	C200-T225 WeakPolarHBondContact CA-O 3.48Å; C200-C229 VanDerWaalsContact CA-SG 3.5Å; C200-C229 HydrophobicContact CB-CB 4.06Å; C200-C229 WeakPolarHBondContact CB-SG 3.43Å; C200-C229 WeakPolarHBondContact SG-CA 3.08Å; C200-C229 WeakPolarHBondContact SG-CB 3.47Å; C200-C229 CovalentContact SG-SG 2.03Å; C200-C229 PolarHBondContact SG-SG 2.89Å; C200-L234 WeakPolarHBondContact CB-O 3.44Å; C200-P236 WeakPolarHBondContact SG-CD 3.08Å
201	E	88.3	Confident	91	Very high	55 Å²	55	46.1 Å²	46.1	26%	0.257	26%	0.258	S	S	.	.			trans	-134.8	124.5	166	-174	173.4	-112.3	0	0	108.7	S204 Y207 H224 T225 S226 C229	E201-S204 WeakPolarHBondContact CG-OG 3.29Å; E201-S204 VanDerWaalsContact OE2-CB 3.28Å; E201-S204 WeakPolarHBondContact OE2-CB 3.43Å; E201-S204 PolarHBondContact OE2-OG 3.15Å; E201-Y207 PolarHBondContact OE1-OH 2.98Å; E201-Y207 WeakPolarHBondContact OE2-CE1 3.46Å; E201-Y207 VanDerWaalsContact OE2-CZ 3.31Å; E201-Y207 PolarHBondContact OE2-OH 3.45Å; E201-H224 HydrophobicContact CB-CB 4.04Å; E201-H224 IonicContact OE1-CE1 2.72Å; E201-H224 PolarHBondContact OE1-CE1 3.45Å; E201-H224 IonicContact OE1-ND1 2.59Å; E201-H224 PolarHBondContact OE1-ND1 3.21Å; E201-H224 WeakPolarHBondContact OE2-CB 3.21Å; E201-H224 IonicContact OE2-CG 3.03Å; E201-H224 IonicContact OE2-ND1 2.69Å; E201-H224 PolarHBondContact OE2-ND1 3.22Å; E201-H224 VanDerWaalsContact OE2-ND1 3.12Å; E201-T225 PolarHBondContact N-O 3.16Å; E201-S226 WeakPolarHBondContact O-CA 3.38Å; E201-S226 WeakPolarHBondContact O-CB 3.34Å; E201-C229 PolarHBondContact N-SG 3.38Å; E201-C229 VanDerWaalsContact N-SG 3.4Å
202	D	81.8	Confident	90.9	Very high	101 Å²	101	45.5 Å²	45.5	54%	0.54	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	135.4	178.9	-75.8	-37.6	0	0	0	109.8	S204 C229	D202-S204 PolarHBondContact O-N 2.84Å; D202-C229 WeakPolarHBondContact OD1-CB 3.49Å
203	G	73.6	Confident	90.9	Very high	88 Å²	88	48.9 Å²	48.9	91%	0.907	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	-7.1	173.4	0	0	0	0	0	116.9
204	S	74.9	Confident	90.7	Very high	25 Å²	25	50 Å²	50	18%	0.175	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-100.4	155.5	176.2	66.7	0	0	0	0	113.8	E201 D202 S226	E201-S204 WeakPolarHBondContact CG-OG 3.29Å; E201-S204 VanDerWaalsContact OE2-CB 3.28Å; E201-S204 WeakPolarHBondContact OE2-CB 3.43Å; E201-S204 PolarHBondContact OE2-OG 3.15Å; D202-S204 PolarHBondContact O-N 2.84Å; S204-S226 WeakPolarHBondContact O-CB 3.32Å; S204-S226 PolarHBondContact O-OG 3.14Å
205	S	85.4	Confident	90.4	Very high	95 Å²	95	55.2 Å²	55.2	66%	0.664	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-75.4	168.1	166.3	55.8	0	0	0	0	110.7	Y207	S205-Y207 VanDerWaalsContact O-CD1 3.29Å; S205-Y207 WeakPolarHBondContact O-CD1 3.26Å; S205-Y207 PolarHBondContact O-N 3.32Å
206	D	92.1	Very high	90.2	Very high	24 Å²	24	56 Å²	56	13%	0.128	32%	0.316	C	S	.	.	S	Bend	trans	-67.7	121.4	178.7	-53.7	-46.7	0	0	0	110.8	M109 L115 H224 T225 R227	M109-D206 HydrophobicContact CE-CB 4.02Å; L115-D206 HydrophobicContact CD1-CB 4.17Å; L115-D206 HydrophobicContact CD2-CB 4.12Å; L115-D206 WeakPolarHBondContact CD2-O 3.39Å; D206-H224 WeakPolarHBondContact CA-O 3.4Å; D206-T225 WeakPolarHBondContact OD1-CB 3.47Å; D206-T225 PolarHBondContact OD1-OG1 2.96Å; D206-R227 IonicContact OD1-NE 3.94Å; D206-R227 PolarHBondContact OD1-NE 2.92Å; D206-R227 IonicContact OD2-CZ 2.64Å; D206-R227 IonicContact OD2-NE 2.62Å; D206-R227 PolarHBondContact OD2-NE 2.93Å; D206-R227 IonicContact OD2-NH2 2.96Å; D206-R227 PolarHBondContact OD2-NH2 3.46Å
207	Y	93.6	Very high	90.1	Very high	89 Å²	89	56.3 Å²	56.3	35%	0.349	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158	174.3	70.9	-87.8	0	0	0	113.8	E201 S205 A209 V223 H224	E201-Y207 PolarHBondContact OE1-OH 2.98Å; E201-Y207 WeakPolarHBondContact OE2-CE1 3.46Å; E201-Y207 VanDerWaalsContact OE2-CZ 3.31Å; E201-Y207 PolarHBondContact OE2-OH 3.45Å; S205-Y207 VanDerWaalsContact O-CD1 3.29Å; S205-Y207 WeakPolarHBondContact O-CD1 3.26Å; S205-Y207 PolarHBondContact O-N 3.32Å; Y207-A209 HydrophobicContact CD2-CB 4.27Å; Y207-A209 HydrophobicContact CE2-CB 3.72Å; Y207-A209 PolarHBondContact O-N 3.13Å; Y207-V223 WeakPolarHBondContact O-CA 3.43Å; Y207-H224 HydrophobicContact CD1-CB 4.4Å; Y207-H224 HydrophobicContact CE1-CB 3.94Å; Y207-H224 HydrophobicContact CE2-CB 4.46Å; Y207-H224 AromaticContact CZ-ND1 3.88Å; Y207-H224 PolarHBondContact N-O 3.38Å; Y207-H224 VanDerWaalsContact N-O 3.11Å; Y207-H224 PolarHBondContact O-N 3.02Å; Y207-H224 PolarHBondContact OH-ND1 2.91Å
208	V	95.5	Very high	90.1	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.024	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	103.5	172.2	-173.3	0	0	0	0	108.8	L115 K117 F126 V211 L221 V223	L115-V208 HydrophobicContact CB-CG2 3.77Å; L115-V208 HydrophobicContact CD1-CG2 4.41Å; K117-V208 HydrophobicContact CB-CB 3.89Å; K117-V208 HydrophobicContact CB-CG1 4.31Å; K117-V208 HydrophobicContact CG-CB 4.45Å; F126-V208 HydrophobicContact CB-CG2 4.15Å; V208-V211 HydrophobicContact CG1-CG2 3.79Å; V208-L221 HydrophobicContact CG1-CG 4.37Å; V208-V223 HydrophobicContact CG2-CG2 4.35Å
209	A	92.9	Very high	90.2	Very high	25 Å²	25	59 Å²	59	21%	0.207	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-45.1	-179.9	0	0	0	0	0	111.9	Y207 T222	Y207-A209 HydrophobicContact CD2-CB 4.27Å; Y207-A209 HydrophobicContact CE2-CB 3.72Å; Y207-A209 PolarHBondContact O-N 3.13Å; A209-T222 PolarHBondContact N-O 3.37Å
210	R	93.2	Very high	90.5	Very high	143 Å²	143	57.9 Å²	57.9	54%	0.54	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	148.1	-176.8	-65.4	175.6	56.3	141.1	3.8	112.7	D212 L221 T222	R210-D212 IonicContact CZ-OD2 3.78Å; R210-D212 VanDerWaalsContact CZ-OD2 3.32Å; R210-D212 IonicContact NE-OD2 3.71Å; R210-D212 PolarHBondContact NE-OD2 3.38Å; R210-D212 IonicContact NH2-OD1 2.72Å; R210-D212 PolarHBondContact NH2-OD1 3.41Å; R210-D212 IonicContact NH2-OD2 3.5Å; R210-D212 PolarHBondContact NH2-OD2 2.94Å; R210-L221 WeakPolarHBondContact O-CA 3.33Å; R210-T222 PolarHBondContact N-O 3.49Å; R210-T222 PolarHBondContact O-N 2.89Å
211	V	95.1	Very high	90.8	Very high	7 Å²	7	57.5 Å²	57.5	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	112	170.9	-176.9	0	0	0	0	107.1	K119 Y124 V208 L221	K119-V211 HydrophobicContact CD-CB 4.43Å; K119-V211 PolarHBondContact NZ-O 2.87Å; Y124-V211 HydrophobicContact CD1-CG1 3.8Å; Y124-V211 HydrophobicContact CD2-CB 4.38Å; Y124-V211 HydrophobicContact CD2-CG1 4.09Å; Y124-V211 HydrophobicContact CD2-CG2 4.04Å; Y124-V211 HydrophobicContact CE1-CG1 3.62Å; Y124-V211 HydrophobicContact CE2-CB 4.41Å; Y124-V211 HydrophobicContact CE2-CG1 3.95Å; Y124-V211 HydrophobicContact CG-CG1 4.04Å; Y124-V211 HydrophobicContact CG-CG2 4.07Å; V208-V211 HydrophobicContact CG1-CG2 3.79Å; V211-L221 HydrophobicContact CB-CD1 4.48Å; V211-L221 HydrophobicContact CG1-CD1 3.83Å; V211-L221 HydrophobicContact CG2-CD1 4.4Å; V211-L221 HydrophobicContact CG2-CG 4.21Å
212	D	94.4	Very high	91.1	Very high	48 Å²	48	55.9 Å²	55.9	26%	0.257	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.8	-176.3	-68.7	-48.2	0	0	0	109.7	R210 P214 Y219 V220	R210-D212 IonicContact CZ-OD2 3.78Å; R210-D212 VanDerWaalsContact CZ-OD2 3.32Å; R210-D212 IonicContact NE-OD2 3.71Å; R210-D212 PolarHBondContact NE-OD2 3.38Å; R210-D212 IonicContact NH2-OD1 2.72Å; R210-D212 PolarHBondContact NH2-OD1 3.41Å; R210-D212 IonicContact NH2-OD2 3.5Å; R210-D212 PolarHBondContact NH2-OD2 2.94Å; D212-P214 VanDerWaalsContact C-CD 3.43Å; D212-P214 WeakPolarHBondContact O-CD 3.31Å; D212-Y219 CarbonylContact O-C 3.54Å; D212-V220 PolarHBondContact N-O 2.64Å; D212-V220 PolarHBondContact O-N 2.95Å
213	E	94.3	Very high	91.7	Very high	88 Å²	88	51 Å²	51	41%	0.411	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	78.2	175.6	-172.2	175.7	170.3	0	0	108.9	Q215 S216 C217 Y219	E213-Q215 WeakPolarHBondContact CG-O 3.26Å; E213-Q215 PolarHBondContact O-N 3.45Å; E213-S216 VanDerWaalsContact OE1-CA 3.32Å; E213-S216 WeakPolarHBondContact OE1-CA 3.32Å; E213-C217 PolarHBondContact OE1-N 3.13Å; E213-Y219 HydrophobicContact CB-CD1 3.93Å; E213-Y219 HydrophobicContact CB-CE1 3.83Å; E213-Y219 VanDerWaalsContact CD-CZ 3.45Å; E213-Y219 HydrophobicContact CG-CD1 4.01Å; E213-Y219 HydrophobicContact CG-CE1 3.64Å; E213-Y219 PolarHBondContact OE1-OH 2.98Å; E213-Y219 WeakPolarHBondContact OE2-CE1 3.37Å; E213-Y219 PolarHBondContact OE2-OH 3.33Å
214	P	92.6	Very high	92.7	Very high	91 Å²	91	48.7 Å²	48.7	59%	0.591	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	-19.6	-175.4	27.6	-37.1	0	0	0	113.8	D212 R218 V220	D212-P214 VanDerWaalsContact C-CD 3.43Å; D212-P214 WeakPolarHBondContact O-CD 3.31Å; P214-R218 WeakPolarHBondContact CD-O 3.49Å; P214-V220 HydrophobicContact CG-CG2 3.92Å
215	Q	91.4	Very high	93.5	Very high	112 Å²	112	47.5 Å²	47.5	52%	0.523	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	143.9	172.7	-64.7	-178.1	-7.6	0	0	108.2	E213 C217 R218	E213-Q215 WeakPolarHBondContact CG-O 3.26Å; E213-Q215 PolarHBondContact O-N 3.45Å; Q215-C217 PolarHBondContact O-N 3.46Å; Q215-R218 HydrophobicContact CB-CB 4.2Å; Q215-R218 HydrophobicContact CB-CG 4.34Å; Q215-R218 PolarHBondContact O-N 3.1Å; Q215-R218 VanDerWaalsContact O-O 3.06Å; Q215-R218 VanDerWaalsContact OE1-CD 3.3Å
216	S	91.3	Very high	93.8	Very high	66 Å²	66	45.3 Å²	45.3	46%	0.462	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	126.2	-178.1	-54.5	0	0	0	0	112.1	E213 R218	E213-S216 VanDerWaalsContact OE1-CA 3.32Å; E213-S216 WeakPolarHBondContact OE1-CA 3.32Å; S216-R218 VanDerWaalsContact C-N 3.25Å; S216-R218 PolarHBondContact O-N 3.17Å
217	C	92.4	Very high	93.6	Very high	6 Å²	6	48.1 Å²	48.1	4%	0.041	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	18	-176.7	-61.8	0	0	0	0	115.7	C185 R192 E193 E213 Q215	C185-C217 HydrophobicContact CB-CB 3.56Å; C185-C217 WeakPolarHBondContact CB-SG 3.43Å; C185-C217 WeakPolarHBondContact SG-CB 3.24Å; C185-C217 CovalentContact SG-SG 2.03Å; C185-C217 PolarHBondContact SG-SG 2.59Å; R192-C217 WeakPolarHBondContact CA-O 3.34Å; R192-C217 HydrophobicContact CG-CB 3.77Å; E193-C217 PolarHBondContact N-O 2.88Å; E213-C217 PolarHBondContact OE1-N 3.13Å; Q215-C217 PolarHBondContact O-N 3.46Å
218	R	95.4	Very high	93.3	Very high	114 Å²	114	43.9 Å²	43.9	43%	0.43	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	116	171	-53.9	-177.8	72.2	-160.8	3.5	109.8	E193 P214 Q215 S216	E193-R218 HydrophobicContact CG-CB 4.34Å; E193-R218 HydrophobicContact CG-CG 3.98Å; E193-R218 WeakPolarHBondContact O-CA 3.15Å; E193-R218 IonicContact OE1-CZ 3.13Å; E193-R218 IonicContact OE1-NE 2.71Å; E193-R218 PolarHBondContact OE1-NE 3.31Å; E193-R218 IonicContact OE1-NH2 2.7Å; E193-R218 PolarHBondContact OE1-NH2 3.43Å; P214-R218 WeakPolarHBondContact CD-O 3.49Å; Q215-R218 HydrophobicContact CB-CB 4.2Å; Q215-R218 HydrophobicContact CB-CG 4.34Å; Q215-R218 PolarHBondContact O-N 3.1Å; Q215-R218 VanDerWaalsContact O-O 3.06Å; Q215-R218 VanDerWaalsContact OE1-CD 3.3Å; S216-R218 VanDerWaalsContact C-N 3.25Å; S216-R218 PolarHBondContact O-N 3.17Å
219	Y	95.6	Very high	92.9	Very high	11 Å²	11	44.1 Å²	44.1	4%	0.043	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	151.8	-171.1	-60.1	-89.4	0	0	0	112.1	L149 R192 E193 T194 E195 D212 E213	L149-Y219 HydrophobicContact CB-CD2 4.13Å; L149-Y219 HydrophobicContact CD1-CD1 4.13Å; L149-Y219 HydrophobicContact CD1-CD2 4.11Å; L149-Y219 HydrophobicContact CD1-CE1 4.41Å; L149-Y219 HydrophobicContact CD1-CE2 4.42Å; L149-Y219 HydrophobicContact CD1-CG 3.99Å; L149-Y219 HydrophobicContact CD2-CD2 4.07Å; L149-Y219 HydrophobicContact CD2-CE2 3.69Å; L149-Y219 HydrophobicContact CG-CD2 4.34Å; L149-Y219 HydrophobicContact CG-CE2 4.44Å; R192-Y219 HydrophobicContact CB-CE2 4.44Å; R192-Y219 HydrophobicContact CG-CE2 4.16Å; E193-Y219 PolarHBondContact O-N 2.69Å; T194-Y219 CarbonylContact C-O 3.56Å; T194-Y219 VanDerWaalsContact CA-O 3.31Å; T194-Y219 WeakPolarHBondContact CA-O 3.22Å; E195-Y219 PolarHBondContact N-O 3.47Å; D212-Y219 CarbonylContact O-C 3.54Å; E213-Y219 HydrophobicContact CB-CD1 3.93Å; E213-Y219 HydrophobicContact CB-CE1 3.83Å; E213-Y219 VanDerWaalsContact CD-CZ 3.45Å; E213-Y219 HydrophobicContact CG-CD1 4.01Å; E213-Y219 HydrophobicContact CG-CE1 3.64Å; E213-Y219 PolarHBondContact OE1-OH 2.98Å; E213-Y219 WeakPolarHBondContact OE2-CE1 3.37Å; E213-Y219 PolarHBondContact OE2-OH 3.33Å
220	V	96.3	Very high	92.4	Very high	16 Å²	16	49 Å²	49	10%	0.097	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	117.4	168.2	-179.7	0	0	0	0	107.6	E195 R197 D212 P214	E195-V220 CarbonylContact O-C 3.52Å; E195-V220 VanDerWaalsContact O-CA 3.32Å; E195-V220 WeakPolarHBondContact O-CA 3.43Å; R197-V220 HydrophobicContact CG-CG1 4.41Å; D212-V220 PolarHBondContact N-O 2.64Å; D212-V220 PolarHBondContact O-N 2.95Å; P214-V220 HydrophobicContact CG-CG2 3.92Å
221	L	96.3	Very high	92	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	128.9	175.4	-92.8	62.2	0	0	0	109	F126 I132 T194 E195 V196 R197 V208 R210 V211	F126-L221 HydrophobicContact CB-CD2 4.36Å; F126-L221 HydrophobicContact CD2-CD2 4.48Å; I132-L221 HydrophobicContact CD1-CD2 4.34Å; I132-L221 HydrophobicContact CG2-CD2 3.86Å; T194-L221 HydrophobicContact CG2-CB 4.48Å; T194-L221 HydrophobicContact CG2-CD1 3.8Å; E195-L221 PolarHBondContact O-N 2.96Å; V196-L221 CarbonylContact C-O 3.57Å; V196-L221 WeakPolarHBondContact CA-O 3.14Å; V196-L221 HydrophobicContact CG1-CB 4.47Å; V196-L221 HydrophobicContact CG2-CB 4.26Å; R197-L221 PolarHBondContact N-O 3.32Å; V208-L221 HydrophobicContact CG1-CG 4.37Å; R210-L221 WeakPolarHBondContact O-CA 3.33Å; V211-L221 HydrophobicContact CB-CD1 4.48Å; V211-L221 HydrophobicContact CG1-CD1 3.83Å; V211-L221 HydrophobicContact CG2-CD1 4.4Å; V211-L221 HydrophobicContact CG2-CG 4.21Å
222	T	95.1	Very high	91.3	Very high	20 Å²	20	46.4 Å²	46.4	12%	0.123	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.1	170.8	-53.5	0	0	0	0	108.6	R197 V199 A209 R210	R197-T222 WeakPolarHBondContact O-CA 3.41Å; V199-T222 HydrophobicContact CB-CG2 4.45Å; V199-T222 HydrophobicContact CG2-CG2 3.65Å; A209-T222 PolarHBondContact N-O 3.37Å; R210-T222 PolarHBondContact N-O 3.49Å; R210-T222 PolarHBondContact O-N 2.89Å
223	V	94.9	Very high	90.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.2	177.2	178.8	0	0	0	0	108	M109 L115 F126 V196 R197 F198 V199 Y207 V208	M109-V223 HydrophobicContact CE-CG1 4.31Å; L115-V223 HydrophobicContact CD1-CG1 3.75Å; F126-V223 HydrophobicContact CD1-CG2 4.23Å; F126-V223 HydrophobicContact CE1-CG2 4.36Å; V196-V223 HydrophobicContact CG1-CG2 3.79Å; R197-V223 PolarHBondContact O-N 2.88Å; F198-V223 WeakPolarHBondContact CA-O 3.47Å; F198-V223 HydrophobicContact CD1-CB 4.01Å; F198-V223 HydrophobicContact CD1-CG1 3.99Å; F198-V223 HydrophobicContact CE1-CB 4.23Å; F198-V223 HydrophobicContact CE1-CG1 4.11Å; V199-V223 PolarHBondContact N-O 2.97Å; Y207-V223 WeakPolarHBondContact O-CA 3.43Å; V208-V223 HydrophobicContact CG2-CG2 4.35Å
224	H	93.9	Very high	89.8	Confident	38 Å²	38	44.5 Å²	44.5	18%	0.176	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	135.7	170.5	-73.8	-164	0	0	0	108.5	V199 E201 D206 Y207	V199-H224 WeakPolarHBondContact O-CA 3.44Å; E201-H224 HydrophobicContact CB-CB 4.04Å; E201-H224 IonicContact OE1-CE1 2.72Å; E201-H224 PolarHBondContact OE1-CE1 3.45Å; E201-H224 IonicContact OE1-ND1 2.59Å; E201-H224 PolarHBondContact OE1-ND1 3.21Å; E201-H224 WeakPolarHBondContact OE2-CB 3.21Å; E201-H224 IonicContact OE2-CG 3.03Å; E201-H224 IonicContact OE2-ND1 2.69Å; E201-H224 PolarHBondContact OE2-ND1 3.22Å; E201-H224 VanDerWaalsContact OE2-ND1 3.12Å; D206-H224 WeakPolarHBondContact CA-O 3.4Å; Y207-H224 HydrophobicContact CD1-CB 4.4Å; Y207-H224 HydrophobicContact CE1-CB 3.94Å; Y207-H224 HydrophobicContact CE2-CB 4.46Å; Y207-H224 AromaticContact CZ-ND1 3.88Å; Y207-H224 PolarHBondContact N-O 3.38Å; Y207-H224 VanDerWaalsContact N-O 3.11Å; Y207-H224 PolarHBondContact O-N 3.02Å; Y207-H224 PolarHBondContact OH-ND1 2.91Å
225	T	91.8	Very high	89.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	133.1	179.3	176.3	0	0	0	0	110.7	L106 F198 V199 C200 E201 D206 R227 T228	L106-T225 HydrophobicContact CD2-CG2 4.08Å; F198-T225 HydrophobicContact CB-CG2 4.31Å; F198-T225 HydrophobicContact CD1-CG2 4.25Å; V199-T225 PolarHBondContact O-N 3.42Å; C200-T225 WeakPolarHBondContact CA-O 3.48Å; E201-T225 PolarHBondContact N-O 3.16Å; D206-T225 WeakPolarHBondContact OD1-CB 3.47Å; D206-T225 PolarHBondContact OD1-OG1 2.96Å; T225-R227 PolarHBondContact O-N 2.62Å; T225-R227 WeakPolarHBondContact OG1-CB 3.47Å; T225-R227 WeakPolarHBondContact OG1-CG 3.41Å; T225-R227 PolarHBondContact OG1-N 3.46Å; T225-T228 HydrophobicContact CG2-CG2 3.95Å; T225-T228 PolarHBondContact O-OG1 3.46Å
226	S	90.7	Very high	88	Confident	50 Å²	50	44.2 Å²	44.2	35%	0.35	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-74	-11.3	173.3	42.1	0	0	0	0	113.1	E201 S204 T228 C229	E201-S226 WeakPolarHBondContact O-CA 3.38Å; E201-S226 WeakPolarHBondContact O-CB 3.34Å; S204-S226 WeakPolarHBondContact O-CB 3.32Å; S204-S226 PolarHBondContact O-OG 3.14Å; S226-T228 PolarHBondContact O-N 2.96Å; S226-C229 WeakPolarHBondContact O-CB 3.46Å; S226-C229 PolarHBondContact O-N 3.48Å
227	R	88.6	Confident	86.8	Confident	83 Å²	83	44.3 Å²	44.3	31%	0.313	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-68	-36.8	-177.2	-59.2	177.1	-167.9	-72.1	-7.5	112.9	D206 T225 C229	D206-R227 IonicContact OD1-NE 3.94Å; D206-R227 PolarHBondContact OD1-NE 2.92Å; D206-R227 IonicContact OD2-CZ 2.64Å; D206-R227 IonicContact OD2-NE 2.62Å; D206-R227 PolarHBondContact OD2-NE 2.93Å; D206-R227 IonicContact OD2-NH2 2.96Å; D206-R227 PolarHBondContact OD2-NH2 3.46Å; T225-R227 PolarHBondContact O-N 2.62Å; T225-R227 WeakPolarHBondContact OG1-CB 3.47Å; T225-R227 WeakPolarHBondContact OG1-CG 3.41Å; T225-R227 PolarHBondContact OG1-N 3.46Å; R227-C229 VanDerWaalsContact C-N 3.34Å
228	T	88.1	Confident	85.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-81.6	-12.6	-177.5	53.6	0	0	0	0	113.4	L106 T225 S226 Q230 H231 L234	L106-T228 HydrophobicContact CD1-CG2 4.27Å; L106-T228 HydrophobicContact CD2-CG2 3.73Å; L106-T228 HydrophobicContact CG-CG2 3.99Å; T225-T228 HydrophobicContact CG2-CG2 3.95Å; T225-T228 PolarHBondContact O-OG1 3.46Å; S226-T228 PolarHBondContact O-N 2.96Å; T228-Q230 PolarHBondContact O-N 2.93Å; T228-H231 WeakPolarHBondContact O-CB 3.44Å; T228-H231 PolarHBondContact O-N 3.29Å; T228-L234 HydrophobicContact CG2-CD1 3.83Å
229	C	86.9	Confident	83.2	Confident	9 Å²	9	49 Å²	49	6%	0.061	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-65	-18.1	-177.6	-63.1	0	0	0	0	114.7	C200 E201 D202 S226 R227 H231	C200-C229 VanDerWaalsContact CA-SG 3.5Å; C200-C229 HydrophobicContact CB-CB 4.06Å; C200-C229 WeakPolarHBondContact CB-SG 3.43Å; C200-C229 WeakPolarHBondContact SG-CA 3.08Å; C200-C229 WeakPolarHBondContact SG-CB 3.47Å; C200-C229 CovalentContact SG-SG 2.03Å; C200-C229 PolarHBondContact SG-SG 2.89Å; E201-C229 PolarHBondContact N-SG 3.38Å; E201-C229 VanDerWaalsContact N-SG 3.4Å; D202-C229 WeakPolarHBondContact OD1-CB 3.49Å; S226-C229 WeakPolarHBondContact O-CB 3.46Å; S226-C229 PolarHBondContact O-N 3.48Å; R227-C229 VanDerWaalsContact C-N 3.34Å; C229-H231 PolarHBondContact O-N 3.3Å
230	Q	83	Confident	81.3	Confident	128 Å²	128	52 Å²	52	60%	0.598	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-66.9	-24.7	171.6	-60	-176.6	18.7	0	0	112.4	Y97 L105 T228	Y97-Q230 WeakPolarHBondContact CE2-O 3.42Å; L105-Q230 HydrophobicContact CD1-CB 4.43Å; L105-Q230 HydrophobicContact CD2-CB 4.39Å; T228-Q230 PolarHBondContact O-N 2.93Å
231	H	83.9	Confident	79.5	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.065	33%	0.326	C	S	.	.	S	Bend	trans	-90.8	122.2	-172	-164.4	-78.9	0	0	0	112.1	Y97 I102 L105 T228 C229 F233 L234 R235	Y97-H231 AromaticContact CD1-CD2 3.84Å; Y97-H231 AromaticContact CD1-NE2 3.91Å; Y97-H231 AromaticContact CE1-CD2 3.34Å; Y97-H231 WeakPolarHBondContact CE1-CD2 3.34Å; Y97-H231 AromaticContact CE1-NE2 3.85Å; Y97-H231 AromaticContact CZ-CD2 3.79Å; I102-H231 HydrophobicContact CD1-CB 4.48Å; I102-H231 HydrophobicContact CG1-CB 3.99Å; L105-H231 HydrophobicContact CD1-CB 4.02Å; T228-H231 WeakPolarHBondContact O-CB 3.44Å; T228-H231 PolarHBondContact O-N 3.29Å; C229-H231 PolarHBondContact O-N 3.3Å; H231-F233 VanDerWaalsContact C-N 3.29Å; H231-F233 AromaticContact CE1-CD2 3.49Å; H231-F233 VanDerWaalsContact CE1-CD2 3.49Å; H231-F233 WeakPolarHBondContact CE1-CD2 3.49Å; H231-F233 AromaticContact CE1-CG 3.84Å; H231-F233 PolarHBondContact ND1-N 3.33Å; H231-F233 PolarHBondContact O-N 3.45Å; H231-F233 VanDerWaalsContact O-N 3.11Å; H231-L234 PolarHBondContact O-N 2.98Å; H231-R235 PolarHBondContact O-N 2.87Å
232	P	80	Confident	78.2	Confident	80 Å²	80	63.5 Å²	63.5	52%	0.519	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.8	-172.3	-29.1	36.1	0	0	0	116.2	Y97 L234	Y97-P232 VanDerWaalsContact CD2-CD 3.45Å; Y97-P232 HydrophobicContact CD2-CG 3.99Å; Y97-P232 HydrophobicContact CG-CG 4.21Å; P232-L234 VanDerWaalsContact C-N 3.35Å
233	F	76.9	Confident	77.3	Confident	97 Å²	97	65.7 Å²	65.7	43%	0.425	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-20.1	177.2	-58.4	-25	0	0	0	114.5	W158 H231	W158-F233 AromaticContact CE3-CD2 3.92Å; W158-F233 HydrophobicContact CE3-CD2 3.92Å; W158-F233 HydrophobicContact CZ3-CB 4.19Å; W158-F233 HydrophobicContact CZ3-CD2 4.08Å; H231-F233 VanDerWaalsContact C-N 3.29Å; H231-F233 AromaticContact CE1-CD2 3.49Å; H231-F233 VanDerWaalsContact CE1-CD2 3.49Å; H231-F233 WeakPolarHBondContact CE1-CD2 3.49Å; H231-F233 AromaticContact CE1-CG 3.84Å; H231-F233 PolarHBondContact ND1-N 3.33Å; H231-F233 PolarHBondContact O-N 3.45Å; H231-F233 VanDerWaalsContact O-N 3.11Å
234	L	80.5	Confident	76.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-28.6	-177.1	-65.6	-171.7	0	0	0	112.7	I102 W158 H175 C200 T228 H231 P232 P236	I102-L234 HydrophobicContact CB-CD1 4.36Å; I102-L234 HydrophobicContact CD1-CD1 3.59Å; I102-L234 HydrophobicContact CD1-CD2 4.47Å; I102-L234 HydrophobicContact CD1-CG 3.78Å; I102-L234 HydrophobicContact CG1-CD1 3.74Å; I102-L234 HydrophobicContact CG1-CG 4.36Å; I102-L234 HydrophobicContact CG2-CD1 3.67Å; W158-L234 HydrophobicContact CH2-CD2 3.98Å; W158-L234 HydrophobicContact CZ2-CD2 3.77Å; H175-L234 HydrophobicContact CB-CD1 4.04Å; C200-L234 WeakPolarHBondContact CB-O 3.44Å; T228-L234 HydrophobicContact CG2-CD1 3.83Å; H231-L234 PolarHBondContact O-N 2.98Å; P232-L234 VanDerWaalsContact C-N 3.35Å; L234-P236 WeakPolarHBondContact O-CD 3.46Å
235	R	79.3	Confident	76.5	Confident	140 Å²	140	66.6 Å²	66.6	53%	0.528	37%	0.368	S	S	.	.	S	Bend	trans	-56.2	121.7	169.7	-163.5	177.6	-173.5	175.1	3	108.5	H231	H231-R235 PolarHBondContact O-N 2.87Å
236	P	68	Low	76.4	Confident	56 Å²	56	68.4 Å²	68.4	36%	0.364	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-58.8	144.6	169.5	27.1	-32.7	0	0	0	107.8	C200 L234 S238	C200-P236 WeakPolarHBondContact SG-CD 3.08Å; L234-P236 WeakPolarHBondContact O-CD 3.46Å; P236-S238 PolarHBondContact O-N 3.01Å; P236-S238 VanDerWaalsContact O-N 3.12Å
237	P	64.6	Low	76.5	Confident	68 Å²	68	66.5 Å²	66.5	44%	0.442	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-54.1	127.7	164.1	25.9	-32.2	0	0	0	106.2	S239	P237-S239 PolarHBondContact O-N 3.31Å
238	S	58.2	Low	76.6	Confident	101 Å²	101	64 Å²	64	71%	0.706	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-46.3	120.4	168.8	49.8	0	0	0	0	106.2	P236 S240	P236-S238 PolarHBondContact O-N 3.01Å; P236-S238 VanDerWaalsContact O-N 3.12Å; S238-S240 VanDerWaalsContact C-N 3.27Å; S238-S240 WeakPolarHBondContact O-CA 3.46Å; S238-S240 PolarHBondContact O-N 3.34Å
239	S	54.6	Low	76.8	Confident	117 Å²	117	64.1 Å²	64.1	82%	0.818	36%	0.358	S	S	*	.			trans	-55.6	95.3	-170.7	43.1	0	0	0	0	108.4	P237 K241	P237-S239 PolarHBondContact O-N 3.31Å; S239-K241 PolarHBondContact O-N 3.25Å
240	S	54.9	Low	77	Confident	76 Å²	76	64 Å²	64	53%	0.531	36%	0.358	S	S	.	.			trans	-75.9	101.8	-164.2	55.1	0	0	0	0	105.1	S238 P242	S238-S240 VanDerWaalsContact C-N 3.27Å; S238-S240 WeakPolarHBondContact O-CA 3.46Å; S238-S240 PolarHBondContact O-N 3.34Å; S240-P242 WeakPolarHBondContact O-CD 3.47Å
241	K	60.1	Low	77.2	Confident	192 Å²	192	58 Å²	58	84%	0.835	33%	0.33	S	S	*	.			trans	-40.5	117.6	169.2	-70.3	-174.8	177.1	-176.8	0	106	S239 Q243	S239-K241 PolarHBondContact O-N 3.25Å; K241-Q243 PolarHBondContact O-N 3.04Å; K241-Q243 VanDerWaalsContact O-N 3.14Å
242	P	67.6	Low	77.4	Confident	65 Å²	65	59.6 Å²	59.6	42%	0.422	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-50.8	125.8	-166.7	-29.5	33.4	0	0	0	109.6	M41 S240 G244	M41-P242 HydrophobicContact CB-CG 4.47Å; M41-P242 WeakPolarHBondContact O-CB 3.46Å; M41-P242 WeakPolarHBondContact O-CG 3.34Å; S240-P242 WeakPolarHBondContact O-CD 3.47Å; P242-G244 PolarHBondContact O-N 3.43Å; P242-G244 VanDerWaalsContact O-N 3.16Å
243	Q	76.4	Confident	77.8	Confident	65 Å²	65	58.6 Å²	58.6	30%	0.304	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	125.6	-172.3	-69.6	-170.6	-29.3	0	0	109.2	K42 Y43 G44 P78 K241 I245	K42-Q243 PolarHBondContact O-N 3.22Å; Y43-Q243 WeakPolarHBondContact CA-O 3.48Å; Y43-Q243 HydrophobicContact CD1-CB 3.82Å; Y43-Q243 HydrophobicContact CE1-CB 4.1Å; G44-Q243 PolarHBondContact N-O 2.81Å; P78-Q243 HydrophobicContact CB-CB 4.38Å; P78-Q243 VanDerWaalsContact CB-OE1 3.22Å; P78-Q243 HydrophobicContact CG-CB 3.77Å; K241-Q243 PolarHBondContact O-N 3.04Å; K241-Q243 VanDerWaalsContact O-N 3.14Å; Q243-I245 PolarHBondContact O-N 3.02Å
244	G	82.4	Confident	78.2	Confident	30 Å²	30	61.2 Å²	61.2	31%	0.309	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	116.5	-176.6	0	0	0	0	0	111.5	G44 P242	G44-G244 CarbonylContact O-C 3.49Å; G44-G244 WeakPolarHBondContact O-CA 3.33Å; P242-G244 PolarHBondContact O-N 3.43Å; P242-G244 VanDerWaalsContact O-N 3.16Å
245	I	89.1	Confident	78.5	Confident	27 Å²	27	64.4 Å²	64.4	14%	0.138	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	104.1	161.9	-62.6	172.3	0	0	0	106.1	Y43 G44 Q46 C75 L77 Q243	Y43-I245 HydrophobicContact CD1-CD1 4.32Å; Y43-I245 HydrophobicContact CD1-CG1 4.33Å; Y43-I245 HydrophobicContact CG-CD1 4.14Å; G44-I245 PolarHBondContact O-N 3.44Å; Q46-I245 PolarHBondContact N-O 3.01Å; C75-I245 HydrophobicContact CB-CG2 4.25Å; L77-I245 HydrophobicContact CD2-CD1 3.99Å; L77-I245 HydrophobicContact CD2-CG1 4.21Å; L77-I245 HydrophobicContact CD2-CG2 4.07Å; Q243-I245 PolarHBondContact O-N 3.02Å
246	V	90.8	Very high	78.9	Confident	39 Å²	39	61.2 Å²	61.2	24%	0.236	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	118.9	-176.8	-178.4	0	0	0	0	109.1	L48 C75 R76 Q248	L48-V246 HydrophobicContact CD1-CG1 3.6Å; L48-V246 HydrophobicContact CG-CG1 3.99Å; C75-V246 CarbonylContact C-O 3.49Å; C75-V246 WeakPolarHBondContact CA-O 3.29Å; R76-V246 PolarHBondContact N-O 2.88Å; R76-V246 PolarHBondContact O-N 3.18Å; V246-Q248 HydrophobicContact CG1-CG 4.33Å
247	C	92.1	Very high	79.8	Confident	10 Å²	10	65 Å²	65	7%	0.068	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.5	178.7	-65.9	0	0	0	0	110.3	Q46 I47 L48 E74 C75	Q46-C247 PolarHBondContact O-N 3.41Å; I47-C247 WeakPolarHBondContact CA-O 3.28Å; I47-C247 HydrophobicContact CG1-CB 4.46Å; L48-C247 PolarHBondContact N-O 3.48Å; E74-C247 WeakPolarHBondContact O-CA 3.48Å; C75-C247 HydrophobicContact CB-CB 4.16Å; C75-C247 WeakPolarHBondContact CB-SG 3.38Å; C75-C247 WeakPolarHBondContact SG-CB 3.42Å; C75-C247 CovalentContact SG-SG 2.04Å; C75-C247 PolarHBondContact SG-SG 2.92Å
248	Q	91.8	Very high	80.9	Confident	30 Å²	30	66.2 Å²	66.2	14%	0.14	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.5	-179.1	-62.1	-170.3	-101.4	0	0	110.6	L48 D50 V52 Y73 E74 V246 A250	L48-Q248 HydrophobicContact CB-CG 4.32Å; L48-Q248 HydrophobicContact CD1-CG 4.09Å; D50-Q248 PolarHBondContact O-NE2 2.84Å; V52-Q248 HydrophobicContact CG1-CB 3.96Å; V52-Q248 HydrophobicContact CG1-CG 4.37Å; V52-Q248 HydrophobicContact CG2-CB 4.01Å; Y73-Q248 CarbonylContact C-O 3.56Å; Y73-Q248 WeakPolarHBondContact CA-O 3.27Å; E74-Q248 PolarHBondContact N-O 2.93Å; E74-Q248 PolarHBondContact O-N 3.42Å; V246-Q248 HydrophobicContact CG1-CG 4.33Å; Q248-A250 PolarHBondContact O-N 3.47Å
249	P	91.8	Very high	82.2	Confident	2 Å²	2	63 Å²	63	1%	0.013	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	121.3	177.5	-21.6	30.6	0	0	0	111.3	L48 P51 V52 Y73 L251	L48-P249 WeakPolarHBondContact O-CD 3.48Å; P51-P249 CarbonylContact C-O 3.57Å; P51-P249 WeakPolarHBondContact CA-O 3.42Å; P51-P249 HydrophobicContact CB-CB 4.22Å; P51-P249 WeakPolarHBondContact CB-O 3.46Å; V52-P249 PolarHBondContact N-O 2.71Å; Y73-P249 HydrophobicContact CD1-CG 4.32Å; Y73-P249 HydrophobicContact CE1-CB 4.28Å; Y73-P249 HydrophobicContact CE1-CG 3.81Å; P249-L251 PolarHBondContact O-N 2.83Å
250	A	90.3	Very high	83.8	Confident	6 Å²	6	60.1 Å²	60.1	5%	0.05	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	107.9	179.7	0	0	0	0	0	110.1	L54 M64 L72 E74 Q248	L54-A250 HydrophobicContact CB-CB 4.45Å; L54-A250 HydrophobicContact CD1-CB 4.34Å; M64-A250 HydrophobicContact CE-CB 3.6Å; L72-A250 HydrophobicContact CB-CB 4.19Å; L72-A250 PolarHBondContact O-N 3.34Å; E74-A250 HydrophobicContact CB-CB 4.33Å; Q248-A250 PolarHBondContact O-N 3.47Å
251	L	88.9	Confident	85.4	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	154.3	-178.8	-61.5	-172.6	0	0	0	111.9	P51 V52 L54 P249 Q255 W648	P51-L251 HydrophobicContact CB-CB 4.48Å; P51-L251 HydrophobicContact CB-CD1 3.42Å; P51-L251 VanDerWaalsContact CB-CD1 3.42Å; P51-L251 HydrophobicContact CB-CG 3.63Å; P51-L251 HydrophobicContact CG-CD1 3.78Å; V52-L251 PolarHBondContact O-N 3.44Å; L54-L251 WeakPolarHBondContact CB-O 3.41Å; L54-L251 PolarHBondContact N-O 3.34Å; P249-L251 PolarHBondContact O-N 2.83Å; L251-Q255 HydrophobicContact CB-CB 4.05Å; L251-Q255 HydrophobicContact CD1-CB 4.33Å; L251-W648 HydrophobicContact CD1-CD2 3.95Å; L251-W648 HydrophobicContact CD1-CG 3.89Å; L251-W648 HydrophobicContact CD2-CB 3.54Å; L251-W648 HydrophobicContact CD2-CG 3.68Å; L251-W648 HydrophobicContact CG-CG 4.47Å
252	S	87.7	Confident	86.7	Confident	49 Å²	49	56.8 Å²	56.8	34%	0.343	31%	0.309	S	S	.	.			trans	-67.5	156.4	165.3	68.1	0	0	0	0	110.7	Q254 Q255 Y256	S252-Q254 PolarHBondContact O-N 3.38Å; S252-Q254 VanDerWaalsContact O-N 3.14Å; S252-Q255 VanDerWaalsContact N-OE1 3.13Å; S252-Q255 PolarHBondContact O-N 2.96Å; S252-Q255 VanDerWaalsContact O-N 3.16Å; S252-Q255 WeakPolarHBondContact OG-CG 3.15Å; S252-Q255 PolarHBondContact OG-N 2.97Å; S252-Q255 PolarHBondContact OG-OE1 3.39Å; S252-Y256 WeakPolarHBondContact O-CB 3.49Å; S252-Y256 PolarHBondContact O-N 3.36Å
253	A	87	Confident	87.5	Confident	58 Å²	58	58.1 Å²	58.1	48%	0.479	31%	0.309	S	S	.	.	H	α-helix	trans	-56.8	-32.1	-179.2	0	0	0	0	0	113.5	I53 M257	I53-A253 HydrophobicContact CG2-CB 4.3Å; A253-M257 WeakPolarHBondContact O-CG 3.47Å; A253-M257 PolarHBondContact O-N 3.49Å
254	Q	86.6	Confident	88.1	Confident	153 Å²	153	59.3 Å²	59.3	72%	0.715	32%	0.321	S	S	*	.	H	α-helix	trans	-69.2	-53.2	175.3	-69.8	178.7	-37.3	0	0	111.3	S252 Y256 M257 D258	S252-Q254 PolarHBondContact O-N 3.38Å; S252-Q254 VanDerWaalsContact O-N 3.14Å; Q254-Y256 PolarHBondContact O-N 3.48Å; Q254-M257 WeakPolarHBondContact O-CA 3.45Å; Q254-M257 WeakPolarHBondContact O-CB 3.44Å; Q254-M257 PolarHBondContact O-N 2.9Å; Q254-D258 PolarHBondContact O-N 3.38Å
255	Q	86.4	Confident	88.4	Confident	66 Å²	66	61.2 Å²	61.2	31%	0.308	33%	0.329	S	S	.	.	H	α-helix	trans	-57.7	-34.3	177.1	-74.3	168.1	-49.6	0	0	112.9	L251 S252 D258 Y259 W648	L251-Q255 HydrophobicContact CB-CB 4.05Å; L251-Q255 HydrophobicContact CD1-CB 4.33Å; S252-Q255 VanDerWaalsContact N-OE1 3.13Å; S252-Q255 PolarHBondContact O-N 2.96Å; S252-Q255 VanDerWaalsContact O-N 3.16Å; S252-Q255 WeakPolarHBondContact OG-CG 3.15Å; S252-Q255 PolarHBondContact OG-N 2.97Å; S252-Q255 PolarHBondContact OG-OE1 3.39Å; Q255-D258 PolarHBondContact O-N 3.43Å; Q255-Y259 PolarHBondContact O-N 3.19Å; Q255-W648 PolarHBondContact O-NE1 3.49Å
256	Y	87.1	Confident	88.3	Confident	73 Å²	73	63.1 Å²	63.1	29%	0.286	34%	0.339	S	S	.	.	H	α-helix	trans	-67.9	-38.2	174.5	-174.3	-93.1	0	0	0	112.5	P51 I53 S252 Q254 D258 Y259 V260	P51-Y256 HydrophobicContact CB-CD2 4.45Å; P51-Y256 HydrophobicContact CG-CD2 4.21Å; P51-Y256 HydrophobicContact CG-CE2 4.32Å; P51-Y256 WeakPolarHBondContact O-CE2 3.41Å; I53-Y256 HydrophobicContact CD1-CD1 3.68Å; I53-Y256 HydrophobicContact CD1-CE1 3.98Å; I53-Y256 HydrophobicContact CD1-CG 4.09Å; I53-Y256 HydrophobicContact CG1-CD1 3.68Å; I53-Y256 HydrophobicContact CG1-CD2 3.88Å; I53-Y256 HydrophobicContact CG1-CE1 4.13Å; I53-Y256 HydrophobicContact CG1-CE2 4.32Å; I53-Y256 HydrophobicContact CG1-CG 3.54Å; S252-Y256 WeakPolarHBondContact O-CB 3.49Å; S252-Y256 PolarHBondContact O-N 3.36Å; Q254-Y256 PolarHBondContact O-N 3.48Å; Y256-D258 VanDerWaalsContact C-N 3.33Å; Y256-Y259 WeakPolarHBondContact O-CB 3.5Å; Y256-Y259 PolarHBondContact O-N 2.91Å; Y256-V260 HydrophobicContact CD1-CG2 4.12Å; Y256-V260 HydrophobicContact CE1-CG2 3.7Å; Y256-V260 WeakPolarHBondContact O-CG2 3.4Å; Y256-V260 PolarHBondContact O-N 3.42Å
257	M	86.9	Confident	88	Confident	136 Å²	136	64.6 Å²	64.6	67%	0.67	35%	0.349	S	S	*	.	H	α-helix	trans	-65.6	-36.9	172.5	-69.7	-179.8	73.1	0	0	111.9	A253 Q254 V260 K261	A253-M257 WeakPolarHBondContact O-CG 3.47Å; A253-M257 PolarHBondContact O-N 3.49Å; Q254-M257 WeakPolarHBondContact O-CA 3.45Å; Q254-M257 WeakPolarHBondContact O-CB 3.44Å; Q254-M257 PolarHBondContact O-N 2.9Å; M257-V260 PolarHBondContact O-N 3.37Å; M257-K261 WeakPolarHBondContact O-CB 3.37Å; M257-K261 PolarHBondContact O-N 2.93Å
258	D	87.6	Confident	88	Confident	94 Å²	94	70.4 Å²	70.4	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-41.1	173.7	-60.6	-40.2	0	0	0	111.4	Q254 Q255 Y256 K261 A262	Q254-D258 PolarHBondContact O-N 3.38Å; Q255-D258 PolarHBondContact O-N 3.43Å; Y256-D258 VanDerWaalsContact C-N 3.33Å; D258-K261 PolarHBondContact O-N 3.48Å; D258-A262 WeakPolarHBondContact O-CB 3.44Å; D258-A262 PolarHBondContact O-N 3.1Å
259	Y	86.4	Confident	87.8	Confident	34 Å²	34	75.9 Å²	75.9	13%	0.133	39%	0.392	C	S	.	.	H	α-helix	trans	-59.4	-51.4	172.8	168.3	-93	0	0	0	112	P51 Q255 Y256 K261 A262 Q263 W648	P51-Y259 VanDerWaalsContact CD-CZ 3.44Å; P51-Y259 HydrophobicContact CG-CD1 3.63Å; P51-Y259 HydrophobicContact CG-CD2 3.75Å; P51-Y259 HydrophobicContact CG-CE1 3.8Å; P51-Y259 HydrophobicContact CG-CE2 3.89Å; P51-Y259 HydrophobicContact CG-CG 3.61Å; Q255-Y259 PolarHBondContact O-N 3.19Å; Y256-Y259 WeakPolarHBondContact O-CB 3.5Å; Y256-Y259 PolarHBondContact O-N 2.91Å; Y259-K261 VanDerWaalsContact C-N 3.26Å; Y259-K261 PolarHBondContact O-N 3.27Å; Y259-A262 PolarHBondContact O-N 2.93Å; Y259-A262 VanDerWaalsContact O-N 3.15Å; Y259-Q263 WeakPolarHBondContact O-CB 3.49Å; Y259-Q263 PolarHBondContact O-N 3.37Å; Y259-W648 AromaticContact CD2-CH2 3.76Å; Y259-W648 HydrophobicContact CD2-CH2 3.76Å; Y259-W648 AromaticContact CD2-CZ3 3.81Å; Y259-W648 HydrophobicContact CD2-CZ3 3.81Å; Y259-W648 HydrophobicContact CG-CH2 4.2Å
260	V	88.2	Confident	87.7	Confident	55 Å²	55	81.7 Å²	81.7	33%	0.333	42%	0.417	S	S	.	.	H	α-helix	trans	-59.7	-40	179.1	171.8	0	0	0	0	110.8	Y256 M257 Q263 V264	Y256-V260 HydrophobicContact CD1-CG2 4.12Å; Y256-V260 HydrophobicContact CE1-CG2 3.7Å; Y256-V260 WeakPolarHBondContact O-CG2 3.4Å; Y256-V260 PolarHBondContact O-N 3.42Å; M257-V260 PolarHBondContact O-N 3.37Å; V260-Q263 PolarHBondContact O-N 3.33Å; V260-V264 VanDerWaalsContact O-CG2 3.31Å; V260-V264 WeakPolarHBondContact O-CG2 3.19Å; V260-V264 PolarHBondContact O-N 3.31Å
261	K	88.5	Confident	87.8	Confident	160 Å²	160	86.1 Å²	86.1	70%	0.696	44%	0.444	S	S	*	.	H	α-helix	trans	-63.5	-45.6	175.9	-173.6	-175	176.3	-169.8	0	112.1	M257 D258 Y259 V264 S265	M257-K261 WeakPolarHBondContact O-CB 3.37Å; M257-K261 PolarHBondContact O-N 2.93Å; D258-K261 PolarHBondContact O-N 3.48Å; Y259-K261 VanDerWaalsContact C-N 3.26Å; Y259-K261 PolarHBondContact O-N 3.27Å; K261-V264 PolarHBondContact O-N 2.99Å; K261-S265 PolarHBondContact O-N 2.98Å; K261-S265 VanDerWaalsContact O-N 3.14Å; K261-S265 PolarHBondContact O-OG 3.24Å
262	A	86.4	Confident	87.9	Confident	39 Å²	39	90.2 Å²	90.2	32%	0.322	46%	0.463	S	S	.	.	H	α-helix	trans	-62.5	-44.4	177.4	0	0	0	0	0	111.5	D258 Y259 V264 S265 D266	D258-A262 WeakPolarHBondContact O-CB 3.44Å; D258-A262 PolarHBondContact O-N 3.1Å; Y259-A262 PolarHBondContact O-N 2.93Å; Y259-A262 VanDerWaalsContact O-N 3.15Å; A262-V264 VanDerWaalsContact C-N 3.34Å; A262-V264 PolarHBondContact O-N 2.61Å; A262-S265 WeakPolarHBondContact CA-OG 3.37Å; A262-S265 PolarHBondContact O-N 3.28Å; A262-S265 VanDerWaalsContact O-N 3.17Å; A262-S265 PolarHBondContact O-OG 3.17Å; A262-D266 PolarHBondContact O-N 2.82Å
263	Q	85.9	Confident	88	Confident	92 Å²	92	92.3 Å²	92.3	43%	0.43	47%	0.467	S	S	.	.	H	α-helix	trans	-59.3	-43	176.8	-169.6	179.8	24.1	0	0	111.7	Y259 V260 D266 T267	Y259-Q263 WeakPolarHBondContact O-CB 3.49Å; Y259-Q263 PolarHBondContact O-N 3.37Å; V260-Q263 PolarHBondContact O-N 3.33Å; Q263-D266 PolarHBondContact O-N 3.33Å; Q263-T267 WeakPolarHBondContact O-CG2 3.4Å; Q263-T267 PolarHBondContact O-N 3.48Å; Q263-T267 PolarHBondContact O-OG1 3.44Å
264	V	89.4	Confident	88.1	Confident	91 Å²	91	94 Å²	94	55%	0.552	47%	0.467	S	S	*	.	H	α-helix	trans	-62.8	-41.1	175.7	169.7	0	0	0	0	111.9	V260 K261 A262 T267 K268	V260-V264 VanDerWaalsContact O-CG2 3.31Å; V260-V264 WeakPolarHBondContact O-CG2 3.19Å; V260-V264 PolarHBondContact O-N 3.31Å; K261-V264 PolarHBondContact O-N 2.99Å; A262-V264 VanDerWaalsContact C-N 3.34Å; A262-V264 PolarHBondContact O-N 2.61Å; V264-T267 WeakPolarHBondContact CA-OG1 3.06Å; V264-T267 PolarHBondContact O-OG1 3.37Å; V264-K268 WeakPolarHBondContact O-CB 3.18Å; V264-K268 PolarHBondContact O-N 3.32Å
265	S	87.2	Confident	88.3	Confident	69 Å²	69	89.1 Å²	89.1	48%	0.483	45%	0.45	S	S	.	.	H	α-helix	trans	-67.3	-38.6	174.2	43.7	0	0	0	0	113.3	K261 A262 K268 R269	K261-S265 PolarHBondContact O-N 2.98Å; K261-S265 VanDerWaalsContact O-N 3.14Å; K261-S265 PolarHBondContact O-OG 3.24Å; A262-S265 WeakPolarHBondContact CA-OG 3.37Å; A262-S265 PolarHBondContact O-N 3.28Å; A262-S265 VanDerWaalsContact O-N 3.17Å; A262-S265 PolarHBondContact O-OG 3.17Å; S265-K268 PolarHBondContact O-N 3.39Å; S265-R269 PolarHBondContact O-N 2.82Å
266	D	86.6	Confident	88.4	Confident	67 Å²	67	92 Å²	92	36%	0.358	46%	0.463	S	S	.	.	H	α-helix	trans	-70.3	-38.2	176.8	-88.5	-42.3	0	0	0	112.4	A262 Q263 K268 R269 K270	A262-D266 PolarHBondContact O-N 2.82Å; Q263-D266 PolarHBondContact O-N 3.33Å; D266-K268 VanDerWaalsContact C-N 3.33Å; D266-R269 PolarHBondContact O-N 3.49Å; D266-R269 IonicContact OD1-CZ 3.4Å; D266-R269 IonicContact OD1-NE 3.6Å; D266-R269 IonicContact OD1-NH2 3.59Å; D266-R269 PolarHBondContact OD1-NH2 2.91Å; D266-K270 WeakPolarHBondContact O-CB 3.45Å; D266-K270 VanDerWaalsContact O-CG 3.31Å; D266-K270 WeakPolarHBondContact O-CG 2.97Å; D266-K270 PolarHBondContact O-N 2.86Å
267	T	86.3	Confident	88.6	Confident	71 Å²	71	93.9 Å²	93.9	44%	0.436	48%	0.475	S	S	.	.	H	α-helix	trans	-64.9	-39.6	172.8	48.4	0	0	0	0	111.3	Q263 V264 K270 V271	Q263-T267 WeakPolarHBondContact O-CG2 3.4Å; Q263-T267 PolarHBondContact O-N 3.48Å; Q263-T267 PolarHBondContact O-OG1 3.44Å; V264-T267 WeakPolarHBondContact CA-OG1 3.06Å; V264-T267 PolarHBondContact O-OG1 3.37Å; T267-K270 PolarHBondContact O-N 2.79Å; T267-V271 WeakPolarHBondContact O-CG2 3.32Å; T267-V271 PolarHBondContact O-N 3.2Å
268	K	90.8	Very high	88.5	Confident	131 Å²	131	92.6 Å²	92.6	57%	0.57	47%	0.47	S	S	*	.	H	α-helix	trans	-59.4	-51.7	174.7	-179.5	178.4	166.8	179.7	0	110.9	V264 S265 D266 K270 V271 E272	V264-K268 WeakPolarHBondContact O-CB 3.18Å; V264-K268 PolarHBondContact O-N 3.32Å; S265-K268 PolarHBondContact O-N 3.39Å; D266-K268 VanDerWaalsContact C-N 3.33Å; K268-K270 VanDerWaalsContact C-N 3.3Å; K268-K270 PolarHBondContact O-N 3.05Å; K268-V271 PolarHBondContact O-N 3.23Å; K268-V271 VanDerWaalsContact O-N 3.11Å; K268-E272 WeakPolarHBondContact CE-OE1 3.45Å; K268-E272 IonicContact NZ-OE1 2.81Å; K268-E272 PolarHBondContact NZ-OE1 3.37Å; K268-E272 WeakPolarHBondContact O-CG 3.44Å; K268-E272 PolarHBondContact O-N 2.83Å
269	R	88.4	Confident	88.3	Confident	146 Å²	146	94.6 Å²	94.6	55%	0.551	47%	0.474	S	S	*	.	H	α-helix	trans	-58.4	-38.7	178	-177.7	173.8	62.7	108.9	-4.1	113	S265 D266 E272 Q273	S265-R269 PolarHBondContact O-N 2.82Å; D266-R269 PolarHBondContact O-N 3.49Å; D266-R269 IonicContact OD1-CZ 3.4Å; D266-R269 IonicContact OD1-NE 3.6Å; D266-R269 IonicContact OD1-NH2 3.59Å; D266-R269 PolarHBondContact OD1-NH2 2.91Å; R269-E272 PolarHBondContact O-N 2.79Å; R269-Q273 PolarHBondContact O-N 2.96Å
270	K	88.9	Confident	88.3	Confident	124 Å²	124	97.6 Å²	97.6	54%	0.539	49%	0.492	S	S	.	.	H	α-helix	trans	-67.2	-39.4	175.6	-75	174.5	-179.7	-178.3	0	112.7	D266 T267 K268 Q273 I274	D266-K270 WeakPolarHBondContact O-CB 3.45Å; D266-K270 VanDerWaalsContact O-CG 3.31Å; D266-K270 WeakPolarHBondContact O-CG 2.97Å; D266-K270 PolarHBondContact O-N 2.86Å; T267-K270 PolarHBondContact O-N 2.79Å; K268-K270 VanDerWaalsContact C-N 3.3Å; K268-K270 PolarHBondContact O-N 3.05Å; K270-Q273 PolarHBondContact O-N 2.82Å; K270-I274 WeakPolarHBondContact O-CB 3.46Å; K270-I274 WeakPolarHBondContact O-CD1 3.35Å; K270-I274 WeakPolarHBondContact O-CG1 3.4Å; K270-I274 PolarHBondContact O-N 3.38Å
271	V	91.7	Very high	88	Confident	99 Å²	99	100 Å²	100	60%	0.6	50%	0.503	S	S	*	.	H	α-helix	trans	-65.8	-40.9	175.5	170.1	0	0	0	0	110.7	T267 K268 I274 S275	T267-V271 WeakPolarHBondContact O-CG2 3.32Å; T267-V271 PolarHBondContact O-N 3.2Å; K268-V271 PolarHBondContact O-N 3.23Å; K268-V271 VanDerWaalsContact O-N 3.11Å; V271-I274 PolarHBondContact O-N 3.01Å; V271-S275 WeakPolarHBondContact O-CB 3.5Å; V271-S275 PolarHBondContact O-N 2.96Å
272	E	91.6	Very high	87.4	Confident	87 Å²	87	97.9 Å²	97.9	41%	0.407	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-51.5	173.4	-71.4	167.6	155.4	0	0	110.7	K268 R269 I274 S275 E276	K268-E272 WeakPolarHBondContact CE-OE1 3.45Å; K268-E272 IonicContact NZ-OE1 2.81Å; K268-E272 PolarHBondContact NZ-OE1 3.37Å; K268-E272 WeakPolarHBondContact O-CG 3.44Å; K268-E272 PolarHBondContact O-N 2.83Å; R269-E272 PolarHBondContact O-N 2.79Å; E272-I274 PolarHBondContact O-N 3.42Å; E272-S275 WeakPolarHBondContact O-CB 3.49Å; E272-S275 PolarHBondContact O-N 3.29Å; E272-S275 VanDerWaalsContact O-N 3.08Å; E272-S275 PolarHBondContact O-OG 3.37Å; E272-E276 PolarHBondContact O-N 2.73Å; E272-E276 VanDerWaalsContact O-N 3.07Å
273	Q	90.1	Very high	86.9	Confident	94 Å²	94	103.2 Å²	103.2	44%	0.439	52%	0.517	S	S	.	.	H	α-helix	trans	-59.3	-44.4	177	-174.6	-176.4	-19.9	0	0	113.1	R269 K270 S275 E276 E277	R269-Q273 PolarHBondContact O-N 2.96Å; K270-Q273 PolarHBondContact O-N 2.82Å; Q273-S275 VanDerWaalsContact C-N 3.26Å; Q273-S275 PolarHBondContact O-N 2.78Å; Q273-E276 PolarHBondContact O-N 2.9Å; Q273-E276 VanDerWaalsContact O-N 3.16Å; Q273-E277 PolarHBondContact NE2-OE1 2.86Å; Q273-E277 PolarHBondContact O-N 3.26Å
274	I	88.5	Confident	86.2	Confident	92 Å²	92	105.3 Å²	105.3	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-35.8	176.6	-69.4	163.6	0	0	0	110.7	K270 V271 E272 E276 E277 L278	K270-I274 WeakPolarHBondContact O-CB 3.46Å; K270-I274 WeakPolarHBondContact O-CD1 3.35Å; K270-I274 WeakPolarHBondContact O-CG1 3.4Å; K270-I274 PolarHBondContact O-N 3.38Å; V271-I274 PolarHBondContact O-N 3.01Å; E272-I274 PolarHBondContact O-N 3.42Å; I274-E276 VanDerWaalsContact C-N 3.31Å; I274-E276 PolarHBondContact O-N 3.16Å; I274-E277 PolarHBondContact O-N 2.89Å; I274-L278 HydrophobicContact CG2-CD1 3.92Å; I274-L278 HydrophobicContact CG2-CG 4.36Å; I274-L278 WeakPolarHBondContact O-CB 3.28Å; I274-L278 VanDerWaalsContact O-CG 3.27Å; I274-L278 WeakPolarHBondContact O-CG 3.14Å; I274-L278 PolarHBondContact O-N 2.96Å
275	S	90.7	Very high	85.2	Confident	51 Å²	51	106.7 Å²	106.7	36%	0.357	53%	0.532	S	S	.	.	H	α-helix	trans	-68.8	-28.5	176.4	80.6	0	0	0	0	113.3	V271 E272 Q273 K279	V271-S275 WeakPolarHBondContact O-CB 3.5Å; V271-S275 PolarHBondContact O-N 2.96Å; E272-S275 WeakPolarHBondContact O-CB 3.49Å; E272-S275 PolarHBondContact O-N 3.29Å; E272-S275 VanDerWaalsContact O-N 3.08Å; E272-S275 PolarHBondContact O-OG 3.37Å; Q273-S275 VanDerWaalsContact C-N 3.26Å; Q273-S275 PolarHBondContact O-N 2.78Å; S275-K279 VanDerWaalsContact O-CG 3.28Å; S275-K279 WeakPolarHBondContact O-CG 3.5Å; S275-K279 PolarHBondContact O-N 3.32Å
276	E	90.1	Very high	84.3	Confident	128 Å²	128	107 Å²	107	60%	0.598	54%	0.539	S	S	*	.	H	α-helix	trans	-77	-43.7	173.3	-69.3	173	171	0	0	111.4	E272 Q273 I274 L278 K279 N280	E272-E276 PolarHBondContact O-N 2.73Å; E272-E276 VanDerWaalsContact O-N 3.07Å; Q273-E276 PolarHBondContact O-N 2.9Å; Q273-E276 VanDerWaalsContact O-N 3.16Å; I274-E276 VanDerWaalsContact C-N 3.31Å; I274-E276 PolarHBondContact O-N 3.16Å; E276-L278 VanDerWaalsContact C-N 3.32Å; E276-L278 PolarHBondContact O-N 2.88Å; E276-K279 PolarHBondContact O-N 2.88Å; E276-N280 PolarHBondContact O-N 3.23Å
277	E	89.6	Confident	82.6	Confident	112 Å²	112	107.1 Å²	107.1	52%	0.523	56%	0.557	S	S	.	*	H	α-helix	trans	-60.9	-39.8	175.2	-73.5	176.2	-165	0	0	111.9	Q273 I274 L281	Q273-E277 PolarHBondContact NE2-OE1 2.86Å; Q273-E277 PolarHBondContact O-N 3.26Å; I274-E277 PolarHBondContact O-N 2.89Å; E277-L281 PolarHBondContact O-N 2.87Å; E277-L281 VanDerWaalsContact O-N 3.09Å
278	L	85.3	Confident	80.8	Confident	108 Å²	108	110.7 Å²	110.7	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-65.9	-41.1	175.2	-75.3	169.5	0	0	0	112.9	I274 E276 L281 D282	I274-L278 HydrophobicContact CG2-CD1 3.92Å; I274-L278 HydrophobicContact CG2-CG 4.36Å; I274-L278 WeakPolarHBondContact O-CB 3.28Å; I274-L278 VanDerWaalsContact O-CG 3.27Å; I274-L278 WeakPolarHBondContact O-CG 3.14Å; I274-L278 PolarHBondContact O-N 2.96Å; E276-L278 VanDerWaalsContact C-N 3.32Å; E276-L278 PolarHBondContact O-N 2.88Å; L278-L281 PolarHBondContact O-N 3.31Å; L278-D282 PolarHBondContact O-N 2.97Å
279	K	84.2	Confident	78.7	Confident	137 Å²	137	113.5 Å²	113.5	60%	0.596	59%	0.588	S	S	*	*	H	α-helix	trans	-62.6	-44.2	176.2	-76.8	170.5	-178.8	178	0	112.2	S275 E276 L281 D282 E283	S275-K279 VanDerWaalsContact O-CG 3.28Å; S275-K279 WeakPolarHBondContact O-CG 3.5Å; S275-K279 PolarHBondContact O-N 3.32Å; E276-K279 PolarHBondContact O-N 2.88Å; K279-L281 VanDerWaalsContact C-N 3.29Å; K279-L281 PolarHBondContact O-N 2.91Å; K279-D282 PolarHBondContact O-N 2.79Å; K279-E283 PolarHBondContact O-N 3Å
280	N	86.8	Confident	76.4	Confident	96 Å²	96	110.4 Å²	110.4	51%	0.513	60%	0.601	S	S	.	*	H	α-helix	trans	-61.5	-39.5	176.7	-172.7	-0.8	0	0	0	111.2	E276 D282 E283 M284	E276-N280 PolarHBondContact O-N 3.23Å; N280-D282 PolarHBondContact O-N 3Å; N280-E283 PolarHBondContact O-N 2.66Å; N280-M284 WeakPolarHBondContact O-CG 3.35Å; N280-M284 PolarHBondContact O-N 2.95Å
281	L	80.2	Confident	73.7	Confident	105 Å²	105	108 Å²	108	55%	0.55	61%	0.612	S	S	.	*	H	α-helix	trans	-64.6	-38.6	176.1	-145.5	79.5	0	0	0	112.7	E277 L278 K279 M284 L285	E277-L281 PolarHBondContact O-N 2.87Å; E277-L281 VanDerWaalsContact O-N 3.09Å; L278-L281 PolarHBondContact O-N 3.31Å; K279-L281 VanDerWaalsContact C-N 3.29Å; K279-L281 PolarHBondContact O-N 2.91Å; L281-M284 PolarHBondContact O-N 3.43Å; L281-L285 WeakPolarHBondContact O-CG 3.36Å; L281-L285 PolarHBondContact O-N 2.97Å; L281-L285 VanDerWaalsContact O-N 3.17Å
282	D	77.2	Confident	70.9	Confident	117 Å²	117	111.5 Å²	111.5	63%	0.626	63%	0.627	S	S	*	*	H	α-helix	trans	-69	-41.1	178.8	-153.4	36.8	0	0	0	111.5	L278 K279 N280 M284 L285 A286	L278-D282 PolarHBondContact O-N 2.97Å; K279-D282 PolarHBondContact O-N 2.79Å; N280-D282 PolarHBondContact O-N 3Å; D282-M284 PolarHBondContact O-N 3.16Å; D282-L285 PolarHBondContact O-N 3.12Å; D282-L285 VanDerWaalsContact O-N 3.14Å; D282-A286 PolarHBondContact O-N 2.92Å
283	E	76.3	Confident	68	Low	150 Å²	150	110.5 Å²	110.5	70%	0.701	64%	0.641	S	S	*	*	H	α-helix	trans	-62.7	-39.7	173.6	-169.1	176.2	174.8	0	0	112.2	K279 N280 L285 A286 G287	K279-E283 PolarHBondContact O-N 3Å; N280-E283 PolarHBondContact O-N 2.66Å; E283-L285 VanDerWaalsContact C-N 3.3Å; E283-L285 PolarHBondContact O-N 3.03Å; E283-A286 PolarHBondContact O-N 3.3Å; E283-G287 PolarHBondContact O-N 3.27Å; E283-G287 VanDerWaalsContact O-N 3.12Å
284	M	69.8	Low	65.2	Low	137 Å²	137	112.5 Å²	112.5	68%	0.675	66%	0.659	S	S	*	*	H	α-helix	trans	-64.8	-29.9	173.4	-75.3	-172.7	66.3	0	0	113.6	N280 L281 D282	N280-M284 WeakPolarHBondContact O-CG 3.35Å; N280-M284 PolarHBondContact O-N 2.95Å; L281-M284 PolarHBondContact O-N 3.43Å; D282-M284 PolarHBondContact O-N 3.16Å
285	L	69.6	Low	62.3	Low	119 Å²	119	115 Å²	115	62%	0.623	68%	0.678	S	S	*	*	H	α-helix	trans	-80.1	-41.9	177.1	-71.6	167.4	0	0	0	111.6	L281 D282 E283 G287 N288	L281-L285 WeakPolarHBondContact O-CG 3.36Å; L281-L285 PolarHBondContact O-N 2.97Å; L281-L285 VanDerWaalsContact O-N 3.17Å; D282-L285 PolarHBondContact O-N 3.12Å; D282-L285 VanDerWaalsContact O-N 3.14Å; E283-L285 VanDerWaalsContact C-N 3.3Å; E283-L285 PolarHBondContact O-N 3.03Å; L285-G287 PolarHBondContact O-N 3.13Å; L285-N288 PolarHBondContact O-N 2.91Å
286	A	67.8	Low	59.3	Low	75 Å²	75	121.2 Å²	121.2	62%	0.62	70%	0.702	S	S	*	*	H	α-helix	trans	-61	-29.4	174.7	0	0	0	0	0	112.9	D282 E283 N288	D282-A286 PolarHBondContact O-N 2.92Å; E283-A286 PolarHBondContact O-N 3.3Å; A286-N288 PolarHBondContact O-N 3.15Å; A286-N288 VanDerWaalsContact O-N 3.1Å
287	G	51.8	Low	56.4	Low	71 Å²	71	120.8 Å²	120.8	73%	0.732	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-6.4	179.1	0	0	0	0	0	116.6	E283 L285	E283-G287 PolarHBondContact O-N 3.27Å; E283-G287 VanDerWaalsContact O-N 3.12Å; L285-G287 PolarHBondContact O-N 3.13Å
288	N	47.9	Very low	53.3	Low	145 Å²	145	121.9 Å²	121.9	78%	0.775	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	-0.2	-174.9	-160.2	58.4	0	0	0	115.1	L285 A286 G290	L285-N288 PolarHBondContact O-N 2.91Å; A286-N288 PolarHBondContact O-N 3.15Å; A286-N288 VanDerWaalsContact O-N 3.1Å; N288-G290 PolarHBondContact O-N 3.48Å
289	E	45.7	Very low	50.6	Low	191 Å²	191	121 Å²	121	89%	0.893	73%	0.731	S	S	*	*			trans	-95.6	74.6	175.5	-68	-151.3	129.2	0	0	112.8
290	G	39.8	Very low	47.8	Very low	80 Å²	80	123.9 Å²	123.9	83%	0.825	75%	0.746	S	S	*	*			trans	-141.8	65	179.5	0	0	0	0	0	114	N288	N288-G290 PolarHBondContact O-N 3.48Å
291	G	34.1	Very low	45.1	Very low	74 Å²	74	127.9 Å²	127.9	76%	0.763	76%	0.762	S	S	*	*			trans	-161.9	56.7	-168.1	0	0	0	0	0	120
292	D	32.1	Very low	42.4	Very low	173 Å²	173	129.7 Å²	129.7	93%	0.925	78%	0.777	S	S	*	*			trans	67.3	149	156.1	-162.8	23	0	0	0	119.4
293	G	30.1	Very low	39.9	Very low	66 Å²	66	129.9 Å²	129.9	68%	0.68	78%	0.783	S	S	*	*			trans	138.9	41.2	169.8	0	0	0	0	0	119.4	V295	G293-V295 PolarHBondContact O-N 3.22Å
294	T	31.1	Very low	38.1	Very low	135 Å²	135	128.2 Å²	128.2	83%	0.828	79%	0.785	S	S	*	*			trans	-60.9	128.2	176.1	50.5	0	0	0	0	114.7
295	V	27.7	Very low	37.1	Very low	145 Å²	145	127 Å²	127	88%	0.879	79%	0.787	S	S	*	*			trans	-146.2	125.1	149.2	-174.5	0	0	0	0	111	G293	G293-V295 PolarHBondContact O-N 3.22Å
296	E	28	Very low	35.6	Very low	181 Å²	181	126.3 Å²	126.3	85%	0.846	79%	0.79	S	S	*	*			trans	-85.5	129.5	174.3	-82.7	179.1	113	0	0	113.8
297	V	29.4	Very low	33.7	Very low	120 Å²	120	130.4 Å²	130.4	73%	0.727	80%	0.801	S	S	*	*			trans	29.4	123.8	130.5	-160.3	0	0	0	0	120.6
298	T	25.3	Very low	32.5	Very low	134 Å²	134	130.5 Å²	130.5	82%	0.822	80%	0.802	S	S	*	*				165.4	113.7	121.5	33.6	0	0	0	0	109.2
299	A	28.2	Very low	31.6	Very low	90 Å²	90	131.3 Å²	131.3	74%	0.744	80%	0.801	S	S	*	*				95	113.6	65.5	0	0	0	0	0	113.3
300	E	25.9	Very low	30.9	Very low	197 Å²	197	129.5 Å²	129.5	92%	0.921	79%	0.793	S	S	*	*			trans	-170.8	132.8	133.7	-113.1	-178.8	160	0	0	112.4
301	E	28.7	Very low	30.3	Very low	181 Å²	181	132.4 Å²	132.4	85%	0.846	79%	0.79	S	S	*	*			trans	-78.2	146.6	163.5	-61.7	172.4	94.2	0	0	110.4
302	T	24.6	Very low	30.2	Very low	142 Å²	142	132.5 Å²	132.5	87%	0.871	78%	0.783	S	S	*	*			trans	-158	135.3	133.6	-17.4	0	0	0	0	113.2
303	T	23.6	Very low	30	Very low	121 Å²	121	129.9 Å²	129.9	74%	0.742	78%	0.778	S	S	*	*			trans	-113.2	179.7	168.6	56.4	0	0	0	0	109
304	P	39.2	Very low	29.9	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	79%	0.785	S	S	*	*			cis	-125.8	-123.3	-33.7	25.9	-1.3	0	0	0	112
305	P	48	Very low	29.7	Very low	110 Å²	110	132.2 Å²	132.2	71%	0.714	78%	0.783	S	S	*	*			trans	-113.2	-166.1	-133.3	38.6	-16.3	0	0	0	113.2
306	P	37.7	Very low	29.6	Very low	106 Å²	106	128.9 Å²	128.9	69%	0.688	78%	0.778	S	S	*	*				-162.1	159.6	89.9	41.7	-20.8	0	0	0	120.3
307	N	28.8	Very low	29.5	Very low	160 Å²	160	127.5 Å²	127.5	86%	0.856	78%	0.777	S	S	*	*			trans	62.3	140.1	134.7	-67.4	-13.4	0	0	0	126.2
308	G	26.3	Very low	29.4	Very low	73 Å²	73	126.2 Å²	126.2	75%	0.753	77%	0.773	S	S	*	*			trans	130.4	70.1	149.3	0	0	0	0	0	114.8
309	H	28.8	Very low	29.3	Very low	162 Å²	162	127.4 Å²	127.4	75%	0.75	77%	0.774	S	S	*	*				70.3	127.1	62.8	-128.8	-25.4	0	0	0	115.6
310	Q	31.4	Very low	29.2	Very low	154 Å²	154	126.4 Å²	126.4	72%	0.72	77%	0.766	S	S	*	*			trans	76.9	153.5	161.2	-57.8	175.5	3.9	0	0	117.6
311	D	28.3	Very low	29.3	Very low	141 Å²	141	122.9 Å²	122.9	75%	0.754	76%	0.758	S	S	*	*			cis	-172.5	164	-21.2	-95.7	-15.2	0	0	0	107.6
312	A	30.3	Very low	29.2	Very low	75 Å²	75	122.4 Å²	122.4	62%	0.62	76%	0.756	S	S	*	*			cis	-175.4	163.8	-25.8	0	0	0	0	0	109.3
313	S	28.2	Very low	29.2	Very low	119 Å²	119	122.8 Å²	122.8	83%	0.832	75%	0.752	S	S	*	*			trans	69.5	161.1	169.3	81.7	0	0	0	0	117.1
314	N	27.7	Very low	29.3	Very low	155 Å²	155	123.1 Å²	123.1	83%	0.829	76%	0.755	S	S	*	*			cis	-153.1	168.2	11.4	-156.6	3.4	0	0	0	113.4
315	A	27.4	Very low	29.2	Very low	94 Å²	94	123.4 Å²	123.4	78%	0.777	76%	0.756	S	S	*	*			trans	-60.2	166.6	-173.8	0	0	0	0	0	119
316	G	24.9	Very low	28.1	Very low	75 Å²	75	122.9 Å²	122.9	77%	0.773	76%	0.755	S	S	*	*			trans	160.3	58.6	150	0	0	0	0	0	124
317	N	26.5	Very low	27.5	Very low	153 Å²	153	126.2 Å²	126.2	82%	0.818	76%	0.762	S	S	*	*			trans	57.1	149.4	136.5	-148.8	60.9	0	0	0	125.1
318	S	27	Very low	27.5	Very low	93 Å²	93	126.2 Å²	126.2	65%	0.65	76%	0.756	S	S	*	*			trans	74.5	108.5	149.3	40.7	0	0	0	0	124.2
319	D	23.9	Very low	27.5	Very low	159 Å²	159	127.9 Å²	127.9	85%	0.85	75%	0.752	S	S	*	*				93.7	136.8	106.2	-151.6	30.8	0	0	0	123.7
320	A	26.9	Very low	27.6	Very low	68 Å²	68	127 Å²	127	56%	0.562	75%	0.753	S	S	*	*			trans	54	123.9	152	0	0	0	0	0	126.3
321	T	26.4	Very low	27.5	Very low	123 Å²	123	127.3 Å²	127.3	76%	0.755	76%	0.76	S	S	*	*			trans	79.4	125.8	131.2	50.4	0	0	0	0	125.1
322	E	26.4	Very low	27.5	Very low	171 Å²	171	125.4 Å²	125.4	80%	0.799	76%	0.764	S	S	*	*			trans	76.3	125.1	136.3	-68.7	179.6	168.4	0	0	123.7
323	D	25.1	Very low	27.7	Very low	150 Å²	150	129.7 Å²	129.7	80%	0.802	78%	0.776	S	S	*	*			trans	69.9	124.7	145.2	-65.8	-7.7	0	0	0	125.2
324	T	27	Very low	28.1	Very low	129 Å²	129	132 Å²	132	79%	0.791	77%	0.771	S	S	*	*			trans	-52.5	165.2	161.4	12.6	0	0	0	0	113.9
325	P	35.9	Very low	28.3	Very low	121 Å²	121	135.6 Å²	135.6	79%	0.786	77%	0.774	S	S	*	*			cis	-153.3	161.7	46.9	41.6	-20.7	0	0	0	120
326	S	24.8	Very low	28.4	Very low	100 Å²	100	140.8 Å²	140.8	70%	0.699	78%	0.782	S	S	*	*			trans	170.2	122	147.3	50.7	0	0	0	0	109.2
327	E	26.5	Very low	28.4	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	78%	0.782	S	S	*	*				59.6	129.9	98.5	-62.4	176.9	-177.7	0	0	114
328	E	27.2	Very low	28.5	Very low	160 Å²	160	140.1 Å²	140.1	75%	0.748	78%	0.783	S	S	*	*			cis	-159.3	148.3	-1.2	-111.3	-176.6	169.8	0	0	110.3
329	T	27	Very low	28.4	Very low	109 Å²	109	141.9 Å²	141.9	67%	0.669	79%	0.79	S	S	*	*			trans	65.5	162.3	143.3	62.5	0	0	0	0	124.5
330	D	30.6	Very low	28.5	Very low	143 Å²	143	144.1 Å²	144.1	77%	0.765	79%	0.792	S	S	*	*			trans	75	127	174.6	-45.2	-21.8	0	0	0	114.4
331	D	28.7	Very low	28.9	Very low	161 Å²	161	147 Å²	147	86%	0.861	81%	0.805	S	S	*	*			cis	-126.2	135.2	18	-64.5	-64.8	0	0	0	113.8
332	A	29.8	Very low	28.7	Very low	101 Å²	101	144.6 Å²	144.6	84%	0.835	81%	0.805	S	S	*	*			trans	-142.7	41.1	171.5	0	0	0	0	0	112.9
333	D	34.9	Very low	28.6	Very low	165 Å²	165	146.2 Å²	146.2	88%	0.882	81%	0.809	S	S	*	*			trans	-119.9	91.3	-179.8	-86.8	-39.5	0	0	0	111.8
334	F	35.6	Very low	28.6	Very low	167 Å²	167	147.3 Å²	147.3	73%	0.732	81%	0.814	S	S	*	*	S	Bend	trans	-149.1	-22.7	167.3	-166.7	-123.8	0	0	0	116.3
335	W	31.2	Very low	28.4	Very low	230 Å²	230	149.6 Å²	149.6	87%	0.871	81%	0.813	S	S	*	*	S	Bend	trans	-130.4	43.4	-172.7	-74.9	123.3	0	0	0	116.5
336	E	29.4	Very low	27.9	Very low	203 Å²	203	152.1 Å²	152.1	95%	0.949	81%	0.814	S	S	*	*			trans	-136.8	103.9	163.8	-156.1	170.1	-137.5	0	0	111.2
337	G	26.5	Very low	27.7	Very low	76 Å²	76	152.5 Å²	152.5	78%	0.784	81%	0.812	S	S	*	*			trans	-175	-6.8	-172.6	0	0	0	0	0	121.1
338	V	27.8	Very low	27.5	Very low	138 Å²	138	149.1 Å²	149.1	84%	0.836	81%	0.814	S	S	*	*			trans	-138.4	86.9	176.4	-167.4	0	0	0	0	112.8
339	T	25.8	Very low	27.2	Very low	130 Å²	130	145.7 Å²	145.7	80%	0.798	81%	0.808	S	S	*	*			trans	176.3	93.9	131.6	30.4	0	0	0	0	112.2
340	K	26.2	Very low	27.2	Very low	207 Å²	207	148 Å²	148	90%	0.9	81%	0.811	S	S	*	*			trans	-166.9	150.4	132	-104.6	149.2	-169.9	168.8	0	112.6
341	P	34.2	Very low	27	Very low	128 Å²	128	148.1 Å²	148.1	83%	0.831	81%	0.807	S	S	*	*			trans	-103.5	158.2	-162	38.8	-34.7	0	0	0	114.8
342	G	23	Very low	26.8	Very low	73 Å²	73	146 Å²	146	75%	0.753	80%	0.796	S	S	*	*			trans	-152.7	68	-175.4	0	0	0	0	0	117.4
343	K	23.8	Very low	26.7	Very low	204 Å²	204	148 Å²	148	89%	0.887	79%	0.786	S	S	*	*			trans	36	132.5	149.9	-66.7	172.8	178.6	166.6	0	120.9
344	L	24.4	Very low	26.2	Very low	173 Å²	173	147 Å²	147	91%	0.906	78%	0.776	S	S	*	*				-158.9	166.9	113.7	-106.6	159.7	0	0	0	113
345	K	23.5	Very low	25.8	Very low	178 Å²	178	145.6 Å²	145.6	77%	0.774	78%	0.78	S	S	*	*			trans	-99.5	159.5	-156.4	-60.5	167.1	173.7	174.5	0	114.6
346	H	24.6	Very low	25.5	Very low	173 Å²	173	141.2 Å²	141.2	80%	0.801	78%	0.779	S	S	*	*				-166.3	104.2	125.3	-110.6	-83.3	0	0	0	110.3
347	T	21	Very low	25.3	Very low	108 Å²	108	139.4 Å²	139.4	66%	0.663	78%	0.776	S	S	*	*				87.6	114.8	95.2	53.7	0	0	0	0	118.2
348	A	22.3	Very low	25.2	Very low	104 Å²	104	139.7 Å²	139.7	86%	0.86	78%	0.778	S	S	*	*			trans	59.3	147.5	140.4	0	0	0	0	0	121
349	S	22.3	Very low	25.1	Very low	89 Å²	89	140.2 Å²	140.2	62%	0.622	78%	0.777	S	S	*	*			cis	-172.1	165.5	-14.2	-170.1	0	0	0	0	110.1
350	H	26.5	Very low	25.1	Very low	157 Å²	157	145.1 Å²	145.1	73%	0.727	78%	0.782	S	S	*	*			trans	68.2	149.7	164.2	-64.4	-61.8	0	0	0	117.7
351	Q	26.3	Very low	25.1	Very low	145 Å²	145	142.7 Å²	142.7	68%	0.678	78%	0.779	S	S	*	*			cis	-161.7	155.5	0.6	-125.1	170.2	-49	0	0	112.4
352	D	25.1	Very low	24.8	Very low	118 Å²	118	141.1 Å²	141.1	63%	0.631	77%	0.771	S	S	*	*			trans	40.6	152.7	139.1	-61.3	-13.3	0	0	0	122
353	K	26.7	Very low	25	Very low	143 Å²	143	145.5 Å²	145.5	62%	0.622	78%	0.776	S	S	*	*			cis	-173.8	163.5	-6.3	-112.7	166.8	152.9	-112.6	0	110.5
354	E	24.9	Very low	25.1	Very low	144 Å²	144	139.8 Å²	139.8	67%	0.673	77%	0.767	S	S	*	*			trans	46.1	115.4	146.3	-68	158.3	158.2	0	0	120.2
355	V	26.8	Very low	25.2	Very low	136 Å²	136	138.7 Å²	138.7	82%	0.824	76%	0.762	S	S	*	*				67.2	120.6	77	176.1	0	0	0	0	115.8
356	V	24.5	Very low	25.4	Very low	138 Å²	138	137.6 Å²	137.6	84%	0.836	77%	0.765	S	S	*	*			trans	-175.8	148.3	137.6	140.8	0	0	0	0	112.1
357	N	25	Very low	25.5	Very low	165 Å²	165	138.3 Å²	138.3	88%	0.882	77%	0.769	S	S	*	*			trans	-93.8	164.6	178.2	-63.7	-39.9	0	0	0	113.4
358	G	24.6	Very low	25.9	Very low	82 Å²	82	137.6 Å²	137.6	85%	0.845	77%	0.774	S	S	*	*			trans	166.3	120.8	155.2	0	0	0	0	0	117
359	D	25.4	Very low	26.2	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	78%	0.777	S	S	*	*			trans	-70.6	152.7	173.9	-65.8	-66.7	0	0	0	114.3
360	Y	26	Very low	26.4	Very low	233 Å²	233	145.6 Å²	145.6	91%	0.914	78%	0.784	S	S	*	*				174.1	172.7	107.9	-103.8	-80.3	0	0	0	112.5
361	N	26.4	Very low	26.5	Very low	155 Å²	155	145.7 Å²	145.7	83%	0.829	79%	0.785	S	S	*	*			trans	-109.4	148.5	-150	-136.7	-8.6	0	0	0	115.7
362	S	27.9	Very low	26.4	Very low	95 Å²	95	148.9 Å²	148.9	66%	0.664	79%	0.79	S	S	*	*			trans	74.5	113.7	146.2	-155.9	0	0	0	0	122.5
363	L	26.5	Very low	26.5	Very low	165 Å²	165	150.9 Å²	150.9	86%	0.864	79%	0.794	S	S	*	*				172.6	148.8	103	-95.4	174.1	0	0	0	115
364	A	26.8	Very low	26.4	Very low	84 Å²	84	151.5 Å²	151.5	69%	0.694	80%	0.804	S	S	*	*			trans	76.1	98.1	155.1	0	0	0	0	0	121.3
365	D	26.2	Very low	26.4	Very low	151 Å²	151	153.8 Å²	153.8	81%	0.807	81%	0.812	S	S	*	*			trans	30.3	122.1	134.3	-49.2	-20.4	0	0	0	121
366	N	27.2	Very low	26.6	Very low	155 Å²	155	154.5 Å²	154.5	83%	0.829	80%	0.804	S	S	*	*				-163.4	156.4	114.1	-97.9	-65	0	0	0	111.8
367	E	27.6	Very low	27	Very low	187 Å²	187	154.9 Å²	154.9	87%	0.874	80%	0.8	S	S	*	*			trans	-46	129	-171.8	-58.5	160.3	137.9	0	0	117.4
368	A	28.1	Very low	27.4	Very low	94 Å²	94	150.5 Å²	150.5	78%	0.777	78%	0.775	S	S	*	*			trans	-168.4	123.6	137.9	0	0	0	0	0	110.2	E370	A368-E370 PolarHBondContact O-N 3.45Å
369	E	29.6	Very low	28	Very low	199 Å²	199	153.1 Å²	153.1	93%	0.93	78%	0.775	S	S	*	*			trans	-82	104.8	173.9	-66.7	176.9	149.6	0	0	110.4
370	E	26.3	Very low	28.6	Very low	162 Å²	162	150.1 Å²	150.1	76%	0.757	76%	0.759	S	S	*	*			trans	-112.8	90.9	161.3	-77.6	-167.7	173	0	0	109.8	A368 R372	A368-E370 PolarHBondContact O-N 3.45Å; E370-R372 PolarHBondContact O-N 3.28Å
371	E	28.9	Very low	29.4	Very low	159 Å²	159	143.7 Å²	143.7	74%	0.743	75%	0.746	S	S	*	*			trans	-66.2	94	167.1	-71.6	-162.6	144	0	0	110.2	F373	E371-F373 HydrophobicContact CB-CE2 4.22Å; E371-F373 WeakPolarHBondContact O-CD2 3.41Å; E371-F373 PolarHBondContact O-N 2.81Å
372	R	24.6	Very low	30.1	Very low	212 Å²	212	139 Å²	139	80%	0.8	73%	0.729	S	S	*	*			trans	-67.4	100	167.6	-70.5	-175.7	178.1	-177	-0.3	109.8	E370 N374	E370-R372 PolarHBondContact O-N 3.28Å; R372-N374 PolarHBondContact O-N 3.1Å; R372-N374 VanDerWaalsContact O-N 3.12Å
373	F	25.7	Very low	30.7	Very low	160 Å²	160	136.7 Å²	136.7	70%	0.702	71%	0.709	S	S	*	*			trans	-64.5	111.6	167.8	-74.6	-82.4	0	0	0	110.5	E371 F375	E371-F373 HydrophobicContact CB-CE2 4.22Å; E371-F373 WeakPolarHBondContact O-CD2 3.41Å; E371-F373 PolarHBondContact O-N 2.81Å; F373-F375 PolarHBondContact O-N 3.14Å; F373-F375 VanDerWaalsContact O-N 3.16Å
374	N	25.8	Very low	31.6	Very low	155 Å²	155	133.4 Å²	133.4	83%	0.829	69%	0.692	S	S	*	*			trans	-69.9	104.6	169.3	-76.8	-34.3	0	0	0	109.5	R372 K376	R372-N374 PolarHBondContact O-N 3.1Å; R372-N374 VanDerWaalsContact O-N 3.12Å; N374-K376 VanDerWaalsContact C-N 3.35Å; N374-K376 PolarHBondContact O-N 2.86Å
375	F	24.8	Very low	32.5	Very low	193 Å²	193	135.9 Å²	135.9	85%	0.846	69%	0.69	S	S	*	*			trans	-71.4	91.6	165.6	-70.6	-81.6	0	0	0	109.9	F373	F373-F375 PolarHBondContact O-N 3.14Å; F373-F375 VanDerWaalsContact O-N 3.16Å
376	K	30.1	Very low	33.5	Very low	150 Å²	150	135 Å²	135	65%	0.652	68%	0.679	S	S	*	*			trans	-96.2	99.2	164.8	-156.3	-172.2	-177	-149	0	108	N374 I378 D383	N374-K376 VanDerWaalsContact C-N 3.35Å; N374-K376 PolarHBondContact O-N 2.86Å; K376-I378 PolarHBondContact O-N 2.94Å; K376-D383 IonicContact NZ-OD2 2.68Å; K376-D383 PolarHBondContact NZ-OD2 2.04Å
377	I	33.8	Very low	34.3	Very low	146 Å²	146	132.9 Å²	132.9	75%	0.749	66%	0.663	S	S	*	*			trans	-65.2	117	172.2	-58.6	174.6	0	0	0	107.1	T379	I377-T379 HydrophobicContact CG2-CG2 4.16Å
378	I	34.1	Very low	35.3	Very low	73 Å²	73	127.6 Å²	127.6	37%	0.374	64%	0.644	S	S	.	*			trans	-91.5	108.9	177.7	-64.7	172.3	0	0	0	107.8	K376 D380 D383 F387	K376-I378 PolarHBondContact O-N 2.94Å; I378-D380 WeakPolarHBondContact CG2-O 3.45Å; I378-D383 HydrophobicContact CG1-CB 4.43Å; I378-D383 HydrophobicContact CG2-CB 3.68Å; I378-F387 HydrophobicContact CD1-CB 4.42Å
379	T	35.9	Very low	36.1	Very low	137 Å²	137	129.7 Å²	129.7	84%	0.84	64%	0.637	S	S	*	*			trans	-101.8	4.9	-179.9	34.9	0	0	0	0	114.1	I377	I377-T379 HydrophobicContact CG2-CG2 4.16Å
380	D	38.1	Very low	36.8	Very low	87 Å²	87	126.9 Å²	126.9	47%	0.465	62%	0.624	S	S	.	*	S	Bend	trans	-134.1	129.5	-175.6	-172	-35.6	0	0	0	111.1	I378 A382 D383	I378-D380 WeakPolarHBondContact CG2-O 3.45Å; D380-A382 PolarHBondContact O-N 3.16Å; D380-A382 VanDerWaalsContact O-N 3.08Å; D380-A382 WeakPolarHBondContact OD1-CB 3.46Å; D380-A382 PolarHBondContact OD1-N 2.86Å; D380-D383 PolarHBondContact O-N 3.25Å; D380-D383 VanDerWaalsContact O-N 3.13Å
381	P	42.8	Very low	37.7	Very low	99 Å²	99	123 Å²	123	64%	0.643	61%	0.608	S	S	*	*	H	α-helix	trans	-56	-21.6	177.9	22.1	-34.2	0	0	0	115	L384 M385	P381-L384 PolarHBondContact O-N 2.99Å; P381-M385 PolarHBondContact O-N 2.84Å
382	A	40.8	Very low	38.4	Very low	56 Å²	56	123.2 Å²	123.2	46%	0.463	61%	0.606	S	S	.	*	H	α-helix	trans	-68.2	-35.1	176.3	0	0	0	0	0	113.5	D380 K386	D380-A382 PolarHBondContact O-N 3.16Å; D380-A382 VanDerWaalsContact O-N 3.08Å; D380-A382 WeakPolarHBondContact OD1-CB 3.46Å; D380-A382 PolarHBondContact OD1-N 2.86Å; A382-K386 PolarHBondContact O-N 3.04Å
383	D	40.3	Very low	39.4	Very low	47 Å²	47	117 Å²	117	25%	0.251	59%	0.586	S	S	.	*	H	α-helix	trans	-78.8	-26.5	176.6	-103.5	13.6	0	0	0	111.1	K376 I378 D380 K386 F387	K376-D383 IonicContact NZ-OD2 2.68Å; K376-D383 PolarHBondContact NZ-OD2 2.04Å; I378-D383 HydrophobicContact CG1-CB 4.43Å; I378-D383 HydrophobicContact CG2-CB 3.68Å; D380-D383 PolarHBondContact O-N 3.25Å; D380-D383 VanDerWaalsContact O-N 3.13Å; D383-K386 PolarHBondContact O-N 3.15Å; D383-K386 IonicContact OD1-NZ 3.59Å; D383-F387 WeakPolarHBondContact O-CB 3.44Å; D383-F387 PolarHBondContact O-N 2.83Å
384	L	46.5	Very low	40.2	Very low	96 Å²	96	112.5 Å²	112.5	50%	0.503	58%	0.575	S	S	.	*	H	α-helix	trans	-63.4	-44	170.1	-177.3	65	0	0	0	111.6	P381 K386 F387 V388	P381-L384 PolarHBondContact O-N 2.99Å; L384-K386 PolarHBondContact O-N 2.95Å; L384-F387 WeakPolarHBondContact O-CB 3.48Å; L384-F387 PolarHBondContact O-N 3.04Å; L384-F387 VanDerWaalsContact O-N 3.15Å; L384-V388 WeakPolarHBondContact O-CG2 3.45Å; L384-V388 PolarHBondContact O-N 3.13Å
385	M	45.3	Very low	41.1	Very low	135 Å²	135	109.9 Å²	109.9	67%	0.665	56%	0.561	S	S	*	*	H	α-helix	trans	-62.1	-40.2	176.4	-72	-66.7	-76.9	0	0	112.3	P381 V388 Q389	P381-M385 PolarHBondContact O-N 2.84Å; M385-V388 PolarHBondContact O-N 3.46Å; M385-Q389 WeakPolarHBondContact O-CB 3.26Å; M385-Q389 PolarHBondContact O-N 2.95Å
386	K	46.7	Very low	42.2	Very low	132 Å²	132	107.4 Å²	107.4	57%	0.574	55%	0.546	S	S	*	.	H	α-helix	trans	-63.6	-39.5	172.4	-76.5	178.1	-173.4	157.7	0	112.6	A382 D383 L384 Q389 H390	A382-K386 PolarHBondContact O-N 3.04Å; D383-K386 PolarHBondContact O-N 3.15Å; D383-K386 IonicContact OD1-NZ 3.59Å; L384-K386 PolarHBondContact O-N 2.95Å; K386-Q389 PolarHBondContact O-N 3.21Å; K386-H390 WeakPolarHBondContact O-CB 3.5Å; K386-H390 PolarHBondContact O-N 3.44Å
387	F	45.3	Very low	42.8	Very low	111 Å²	111	106 Å²	106	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-64.5	-44.6	177.8	-178.4	-109.3	0	0	0	111.8	I378 D383 L384 Q389 H390 L391	I378-F387 HydrophobicContact CD1-CB 4.42Å; D383-F387 WeakPolarHBondContact O-CB 3.44Å; D383-F387 PolarHBondContact O-N 2.83Å; L384-F387 WeakPolarHBondContact O-CB 3.48Å; L384-F387 PolarHBondContact O-N 3.04Å; L384-F387 VanDerWaalsContact O-N 3.15Å; F387-Q389 VanDerWaalsContact C-N 3.33Å; F387-Q389 PolarHBondContact O-N 3.15Å; F387-H390 PolarHBondContact O-N 2.93Å; F387-L391 HydrophobicContact CD1-CD1 3.88Å; F387-L391 HydrophobicContact CE1-CD1 3.5Å; F387-L391 VanDerWaalsContact CE1-CD1 3.5Å; F387-L391 HydrophobicContact CE1-CG 4.43Å; F387-L391 HydrophobicContact CZ-CD1 3.88Å; F387-L391 HydrophobicContact CZ-CG 4.42Å; F387-L391 PolarHBondContact O-N 3.48Å
388	V	47.5	Very low	43.3	Very low	77 Å²	77	105.6 Å²	105.6	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-61.8	-40.4	173.3	172.5	0	0	0	0	111.5	L384 M385 L391 K392	L384-V388 WeakPolarHBondContact O-CG2 3.45Å; L384-V388 PolarHBondContact O-N 3.13Å; M385-V388 PolarHBondContact O-N 3.46Å; V388-L391 PolarHBondContact O-N 3.26Å; V388-K392 WeakPolarHBondContact O-CB 3.45Å; V388-K392 PolarHBondContact O-N 2.92Å
389	Q	46.2	Very low	43.8	Very low	138 Å²	138	104.9 Å²	104.9	65%	0.645	54%	0.538	S	S	*	.	H	α-helix	trans	-64.5	-40.1	176.5	-154.7	168.6	22.2	0	0	111.7	M385 K386 F387 K392 E393	M385-Q389 WeakPolarHBondContact O-CB 3.26Å; M385-Q389 PolarHBondContact O-N 2.95Å; K386-Q389 PolarHBondContact O-N 3.21Å; F387-Q389 VanDerWaalsContact C-N 3.33Å; F387-Q389 PolarHBondContact O-N 3.15Å; Q389-K392 PolarHBondContact O-N 2.98Å; Q389-E393 WeakPolarHBondContact O-CB 3.31Å; Q389-E393 PolarHBondContact O-N 2.92Å
390	H	44.5	Very low	44.2	Very low	140 Å²	140	103.4 Å²	103.4	65%	0.648	52%	0.521	S	S	*	.	H	α-helix	trans	-67.9	-38.1	176	-163.6	-102.3	0	0	0	112.7	K386 F387 E393 S394	K386-H390 WeakPolarHBondContact O-CB 3.5Å; K386-H390 PolarHBondContact O-N 3.44Å; F387-H390 PolarHBondContact O-N 2.93Å; H390-E393 PolarHBondContact O-N 3.31Å; H390-S394 WeakPolarHBondContact O-CB 3.41Å; H390-S394 PolarHBondContact O-N 3.38Å
391	L	43.9	Very low	44.3	Very low	79 Å²	79	104.9 Å²	104.9	41%	0.414	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-43.5	171.6	-81	166.6	0	0	0	112	F387 V388 E393 S394 N395	F387-L391 HydrophobicContact CD1-CD1 3.88Å; F387-L391 HydrophobicContact CE1-CD1 3.5Å; F387-L391 VanDerWaalsContact CE1-CD1 3.5Å; F387-L391 HydrophobicContact CE1-CG 4.43Å; F387-L391 HydrophobicContact CZ-CD1 3.88Å; F387-L391 HydrophobicContact CZ-CG 4.42Å; F387-L391 PolarHBondContact O-N 3.48Å; V388-L391 PolarHBondContact O-N 3.26Å; L391-E393 PolarHBondContact O-N 2.93Å; L391-S394 PolarHBondContact O-N 3.49Å; L391-N395 WeakPolarHBondContact O-CB 3.48Å; L391-N395 PolarHBondContact O-N 3.49Å
392	K	44.3	Very low	44.4	Very low	165 Å²	165	106.6 Å²	106.6	72%	0.717	53%	0.528	S	S	*	.	H	α-helix	trans	-64.8	-38.5	177.9	-163.9	169.3	-174.9	172.2	0	112.1	V388 Q389 R396	V388-K392 WeakPolarHBondContact O-CB 3.45Å; V388-K392 PolarHBondContact O-N 2.92Å; Q389-K392 PolarHBondContact O-N 2.98Å; K392-R396 WeakPolarHBondContact O-CB 3.33Å; K392-R396 PolarHBondContact O-N 3.37Å
393	E	45.3	Very low	44.4	Very low	81 Å²	81	107.2 Å²	107.2	38%	0.379	53%	0.534	S	S	.	.	H	α-helix	trans	-68.2	-40.2	174	-169.8	107.2	-111	0	0	112.4	Q389 H390 L391 R396 K397	Q389-E393 WeakPolarHBondContact O-CB 3.31Å; Q389-E393 PolarHBondContact O-N 2.92Å; H390-E393 PolarHBondContact O-N 3.31Å; L391-E393 PolarHBondContact O-N 2.93Å; E393-R396 PolarHBondContact O-N 3.07Å; E393-R396 IonicContact OE1-CZ 2.79Å; E393-R396 IonicContact OE1-NE 3.55Å; E393-R396 IonicContact OE1-NH2 3.47Å; E393-R396 PolarHBondContact OE1-NH2 3.33Å; E393-K397 PolarHBondContact O-N 3.01Å; E393-K397 VanDerWaalsContact O-N 3.15Å
394	S	42.8	Very low	44.1	Very low	65 Å²	65	113.4 Å²	113.4	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-64.3	-45.4	176	-168.4	0	0	0	0	111.7	H390 L391 R396 K397 K398	H390-S394 WeakPolarHBondContact O-CB 3.41Å; H390-S394 PolarHBondContact O-N 3.38Å; L391-S394 PolarHBondContact O-N 3.49Å; S394-R396 PolarHBondContact O-N 3.46Å; S394-K397 PolarHBondContact O-N 3.15Å; S394-K398 PolarHBondContact O-N 3.44Å
395	N	43.9	Very low	43.7	Very low	100 Å²	100	113.1 Å²	113.1	54%	0.535	57%	0.567	S	S	.	*	H	α-helix	trans	-65.7	-35.9	176.8	-74.8	-10.9	0	0	0	112.5	L391 K398 A399	L391-N395 WeakPolarHBondContact O-CB 3.48Å; L391-N395 PolarHBondContact O-N 3.49Å; N395-K398 PolarHBondContact O-N 2.98Å; N395-A399 PolarHBondContact O-N 3.18Å
396	R	47.8	Very low	43.3	Very low	141 Å²	141	117.6 Å²	117.6	53%	0.532	58%	0.577	S	S	.	*	H	α-helix	trans	-60.3	-48.5	173.1	-178.9	167.9	67.7	140.7	-4.4	112	K392 E393 S394 K398 A399 E400	K392-R396 WeakPolarHBondContact O-CB 3.33Å; K392-R396 PolarHBondContact O-N 3.37Å; E393-R396 PolarHBondContact O-N 3.07Å; E393-R396 IonicContact OE1-CZ 2.79Å; E393-R396 IonicContact OE1-NE 3.55Å; E393-R396 IonicContact OE1-NH2 3.47Å; E393-R396 PolarHBondContact OE1-NH2 3.33Å; S394-R396 PolarHBondContact O-N 3.46Å; R396-K398 PolarHBondContact O-N 3.33Å; R396-A399 PolarHBondContact O-N 2.97Å; R396-E400 WeakPolarHBondContact CG-OE1 3.34Å; R396-E400 WeakPolarHBondContact O-CG 3.38Å; R396-E400 PolarHBondContact O-N 3.24Å
397	K	43.5	Very low	42.6	Very low	120 Å²	120	120.2 Å²	120.2	52%	0.522	59%	0.591	S	S	.	*	H	α-helix	trans	-62.7	-31.5	175.9	-70.3	175.1	-179.9	175.7	0	112.7	E393 S394 N401	E393-K397 PolarHBondContact O-N 3.01Å; E393-K397 VanDerWaalsContact O-N 3.15Å; S394-K397 PolarHBondContact O-N 3.15Å; K397-N401 WeakPolarHBondContact O-CB 3.31Å; K397-N401 VanDerWaalsContact O-CG 3.26Å; K397-N401 PolarHBondContact O-N 3.48Å; K397-N401 VanDerWaalsContact O-N 3.13Å
398	K	44.5	Very low	41.9	Very low	138 Å²	138	123.6 Å²	123.6	60%	0.6	61%	0.609	S	S	*	*	H	α-helix	trans	-71.9	-35	176.4	-150.2	175.3	-173.7	-177.3	0	112.4	S394 N395 R396 Q402	S394-K398 PolarHBondContact O-N 3.44Å; N395-K398 PolarHBondContact O-N 2.98Å; R396-K398 PolarHBondContact O-N 3.33Å; K398-Q402 PolarHBondContact O-N 2.83Å
399	A	44.8	Very low	40.9	Very low	59 Å²	59	129.5 Å²	129.5	49%	0.488	63%	0.628	S	S	.	*	H	α-helix	trans	-71.6	-42	173.7	0	0	0	0	0	112.4	N395 R396 N401 Q402 A403	N395-A399 PolarHBondContact O-N 3.18Å; R396-A399 PolarHBondContact O-N 2.97Å; A399-N401 PolarHBondContact O-N 3.17Å; A399-Q402 PolarHBondContact O-N 3.44Å; A399-Q402 VanDerWaalsContact O-N 3.13Å; A399-A403 PolarHBondContact O-N 3.13Å
400	E	43.3	Very low	40	Very low	105 Å²	105	128.5 Å²	128.5	49%	0.491	64%	0.636	S	S	.	*	H	α-helix	trans	-59.1	-45.8	174.8	-72.6	165.4	178	0	0	111	R396 Q402 A403	R396-E400 WeakPolarHBondContact CG-OE1 3.34Å; R396-E400 WeakPolarHBondContact O-CG 3.38Å; R396-E400 PolarHBondContact O-N 3.24Å; E400-Q402 VanDerWaalsContact C-N 3.26Å; E400-Q402 PolarHBondContact O-N 3.39Å; E400-A403 PolarHBondContact O-N 3.3Å
401	N	40.3	Very low	39.1	Very low	119 Å²	119	128.9 Å²	128.9	64%	0.636	65%	0.648	S	S	*	*	H	α-helix	trans	-67.8	-18	176.1	-71.4	-3.8	0	0	0	114.6	K397 A399	K397-N401 WeakPolarHBondContact O-CB 3.31Å; K397-N401 VanDerWaalsContact O-CG 3.26Å; K397-N401 PolarHBondContact O-N 3.48Å; K397-N401 VanDerWaalsContact O-N 3.13Å; A399-N401 PolarHBondContact O-N 3.17Å
402	Q	45	Very low	38.3	Very low	134 Å²	134	128.9 Å²	128.9	63%	0.626	67%	0.668	S	S	*	*	H	α-helix	trans	-86.5	-25.8	174.2	-81.4	-177.7	-27.1	0	0	112.6	K398 A399 E400 S405	K398-Q402 PolarHBondContact O-N 2.83Å; A399-Q402 PolarHBondContact O-N 3.44Å; A399-Q402 VanDerWaalsContact O-N 3.13Å; E400-Q402 VanDerWaalsContact C-N 3.26Å; E400-Q402 PolarHBondContact O-N 3.39Å; Q402-S405 PolarHBondContact O-N 2.63Å; Q402-S405 PolarHBondContact O-OG 3.12Å
403	A	40.4	Very low	37.3	Very low	70 Å²	70	128.9 Å²	128.9	58%	0.579	68%	0.676	S	S	*	*	H	α-helix	trans	-69.4	-39.8	177.2	0	0	0	0	0	113.1	A399 E400 S405	A399-A403 PolarHBondContact O-N 3.13Å; E400-A403 PolarHBondContact O-N 3.3Å; A403-S405 PolarHBondContact O-N 2.67Å; A403-S405 VanDerWaalsContact O-N 3.15Å
404	E	35.2	Very low	36.3	Very low	176 Å²	176	135 Å²	135	82%	0.822	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-11.2	178.1	-77.4	-170.8	138.8	0	0	114
405	S	37.7	Very low	35.4	Very low	91 Å²	91	139.8 Å²	139.8	64%	0.636	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	5.6	-175.5	71.6	0	0	0	0	115.2	Q402 A403	Q402-S405 PolarHBondContact O-N 2.63Å; Q402-S405 PolarHBondContact O-OG 3.12Å; A403-S405 PolarHBondContact O-N 2.67Å; A403-S405 VanDerWaalsContact O-N 3.15Å
406	R	35.9	Very low	35	Very low	229 Å²	229	140.5 Å²	140.5	86%	0.864	72%	0.721	S	S	*	*	S	Bend	trans	-123.6	4.1	-175.4	-93.6	-176.1	172	-179.7	-1	117.1
407	E	32	Very low	33.9	Very low	187 Å²	187	137.5 Å²	137.5	87%	0.874	73%	0.733	S	S	*	*	S	Bend	trans	-99.2	51.8	170.4	-71.5	-156.8	136.4	0	0	113.5
408	E	30.6	Very low	33	Very low	182 Å²	182	141 Å²	141	85%	0.85	75%	0.748	S	S	*	*			trans	-156.6	70.9	165.1	-129.5	-176.6	-137.9	0	0	115.2
409	K	26.6	Very low	32.1	Very low	200 Å²	200	141.9 Å²	141.9	87%	0.87	76%	0.759	S	S	*	*			trans	-177.7	140.5	134	-105.1	161.4	-175.3	167.3	0	118.2
410	S	28.6	Very low	31.1	Very low	118 Å²	118	149.6 Å²	149.6	83%	0.825	78%	0.775	S	S	*	*			trans	66.4	103.9	151.8	52.5	0	0	0	0	121.1
411	T	24.8	Very low	30.2	Very low	147 Å²	147	147.8 Å²	147.8	90%	0.902	79%	0.785	S	S	*	*			trans	-79.1	156.9	162.3	49	0	0	0	0	115.2
412	G	26.3	Very low	29.6	Very low	80 Å²	80	150.4 Å²	150.4	83%	0.825	79%	0.793	S	S	*	*			trans	124.5	141	161	0	0	0	0	0	113.4
413	D	24.7	Very low	28.8	Very low	164 Å²	164	153 Å²	153	88%	0.877	81%	0.805	S	S	*	*			cis	-153.4	-178	2.7	-163.1	0.8	0	0	0	110.7
414	R	23.9	Very low	28.1	Very low	209 Å²	209	159.9 Å²	159.9	79%	0.789	82%	0.816	S	S	*	*			trans	-99.5	138.2	-163.4	-74.3	173.5	159.5	168.8	-7.4	118
415	Q	24.2	Very low	27.7	Very low	167 Å²	167	157.4 Å²	157.4	78%	0.78	81%	0.809	S	S	*	*			trans	59	169.6	135.5	-72.8	-177.1	-67.5	0	0	121.1
416	P	35.9	Very low	27.4	Very low	115 Å²	115	162 Å²	162	75%	0.747	82%	0.82	S	S	*	*			cis	-139.9	155.4	-41.8	37.4	-20.8	0	0	0	116.1
417	G	23.6	Very low	27.4	Very low	77 Å²	77	158.2 Å²	158.2	79%	0.794	82%	0.817	S	S	*	*				106.3	146.5	129.7	0	0	0	0	0	122.7
418	K	23.8	Very low	27.6	Very low	194 Å²	194	158.4 Å²	158.4	84%	0.843	82%	0.818	S	S	*	*			trans	115.1	107.7	135	-160.6	173.7	-176.2	-176.2	0	119.9
419	L	25.6	Very low	27.9	Very low	156 Å²	156	156.8 Å²	156.8	82%	0.817	82%	0.815	S	S	*	*			trans	32.1	122.6	141.3	-61	164	0	0	0	120.4
420	R	23.7	Very low	28.6	Very low	222 Å²	222	154.3 Å²	154.3	84%	0.838	81%	0.811	S	S	*	*				150.3	132.4	100.4	-169.4	173	-179.4	-160.8	-6.5	109.6
421	G	26	Very low	29.1	Very low	66 Å²	66	154.9 Å²	154.9	68%	0.68	80%	0.803	S	S	*	*			trans	-94.5	173.8	177.4	0	0	0	0	0	113.3
422	E	26.2	Very low	29.8	Very low	175 Å²	175	156.1 Å²	156.1	82%	0.818	80%	0.799	S	S	*	*			trans	-161.9	135.2	155.2	-106.6	152	-148	0	0	107
423	E	28.6	Very low	30.3	Very low	188 Å²	188	159.8 Å²	159.8	88%	0.879	80%	0.795	S	S	*	*			trans	-88.7	153.2	176.3	-62.2	163.2	149.9	0	0	109.7
424	R	25.9	Very low	30.9	Very low	215 Å²	215	158.5 Å²	158.5	81%	0.811	78%	0.781	S	S	*	*				172.1	130.1	129.5	-96.4	-168.8	141.3	134.6	5	115.3
425	D	28	Very low	31.5	Very low	124 Å²	124	156 Å²	156	66%	0.663	78%	0.779	S	S	*	*				53.7	104.5	129.6	-43.1	-13.2	0	0	0	119.9
426	E	30.8	Very low	32.1	Very low	187 Å²	187	154.5 Å²	154.5	87%	0.874	78%	0.776	S	S	*	*			trans	-127.1	6.9	162.9	-72.8	-167	158.5	0	0	114.2
427	D	36.6	Very low	32.5	Very low	149 Å²	149	157 Å²	157	80%	0.797	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-87.8	-3.7	-171.5	-65.9	-37	0	0	0	115.8	N429	D427-N429 VanDerWaalsContact C-N 3.28Å; D427-N429 PolarHBondContact O-N 3Å
428	E	35.5	Very low	33.4	Very low	192 Å²	192	159.7 Å²	159.7	90%	0.897	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-78.3	-2.5	-175.8	-96	-173.9	163.5	0	0	114.9
429	N	37	Very low	33.9	Very low	147 Å²	147	155 Å²	155	79%	0.786	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-113.2	10.7	-164.9	-138	81.8	0	0	0	115.2	D427	D427-N429 VanDerWaalsContact C-N 3.28Å; D427-N429 PolarHBondContact O-N 3Å
430	L	41.2	Very low	34.7	Very low	149 Å²	149	154.7 Å²	154.7	78%	0.78	76%	0.762	S	S	*	*	S	Bend	trans	-114.4	-10.9	-179.6	-127	94	0	0	0	114.7
431	L	39.1	Very low	35.4	Very low	129 Å²	129	152.6 Å²	152.6	68%	0.675	77%	0.766	S	S	*	*	S	Bend	trans	-87.4	-22.9	-175.1	-84.6	157.2	0	0	0	113.9
432	E	38.4	Very low	36.1	Very low	173 Å²	173	154.7 Å²	154.7	81%	0.808	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-14	-177.2	-124.9	178.1	-177.8	0	0	113.5
433	E	37.3	Very low	37.1	Very low	158 Å²	158	152 Å²	152	74%	0.738	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-20.9	179.5	-164.8	162.6	-152.9	0	0	112.4
434	F	37.2	Very low	38.1	Very low	136 Å²	136	147 Å²	147	60%	0.596	75%	0.75	S	S	*	*	H	α-helix	trans	-89.3	-25.5	-177.5	-166.2	-107.4	0	0	0	113.8	M438	F434-M438 HydrophobicContact CD1-CE 4.35Å; F434-M438 HydrophobicContact CE1-CE 3.4Å; F434-M438 VanDerWaalsContact CE1-CE 3.4Å; F434-M438 HydrophobicContact CE2-CE 4.34Å; F434-M438 HydrophobicContact CZ-CE 3.4Å; F434-M438 VanDerWaalsContact CZ-CE 3.4Å
435	E	36.3	Very low	39.5	Very low	156 Å²	156	140.2 Å²	140.2	73%	0.729	74%	0.736	S	S	*	*	H	α-helix	trans	-75	-23.7	-178.4	-70.1	-168.6	154.2	0	0	113.6
436	D	37.4	Very low	40.8	Very low	136 Å²	136	142.9 Å²	142.9	73%	0.727	74%	0.744	S	S	*	*	H	α-helix	trans	-79.4	-31.6	177.9	-94.3	-7.6	0	0	0	112.7	S439	D436-S439 PolarHBondContact O-OG 2.98Å; D436-S439 VanDerWaalsContact O-OG 3.04Å
437	E	44.2	Very low	42.1	Very low	169 Å²	169	140 Å²	140	79%	0.79	73%	0.729	S	S	*	*	H	α-helix	trans	-81.3	-19.6	-174.6	-84	-166.8	146.9	0	0	115.2	S439	E437-S439 VanDerWaalsContact C-N 3.27Å; E437-S439 PolarHBondContact O-N 2.81Å
438	M	43.5	Very low	43.3	Very low	133 Å²	133	134.4 Å²	134.4	66%	0.655	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	12.8	-175.9	-154.7	171.7	-69.4	0	0	114.4	F434	F434-M438 HydrophobicContact CD1-CE 4.35Å; F434-M438 HydrophobicContact CE1-CE 3.4Å; F434-M438 VanDerWaalsContact CE1-CE 3.4Å; F434-M438 HydrophobicContact CE2-CE 4.34Å; F434-M438 HydrophobicContact CZ-CE 3.4Å; F434-M438 VanDerWaalsContact CZ-CE 3.4Å
439	S	33.3	Very low	44.5	Very low	94 Å²	94	131.8 Å²	131.8	66%	0.657	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-3	-169.5	59.2	0	0	0	0	116.1	D436 E437	D436-S439 PolarHBondContact O-OG 2.98Å; D436-S439 VanDerWaalsContact O-OG 3.04Å; E437-S439 VanDerWaalsContact C-N 3.27Å; E437-S439 PolarHBondContact O-N 2.81Å
440	D	42.4	Very low	46	Very low	151 Å²	151	131.3 Å²	131.3	81%	0.807	68%	0.679	S	S	*	*	S	Bend	trans	-116.3	13.3	-161.8	-110	-0.6	0	0	0	116.8
441	L	39.6	Very low	47.4	Very low	177 Å²	177	128.4 Å²	128.4	93%	0.927	66%	0.664	S	S	*	*			trans	-126.5	98.6	177.8	-68.9	176.3	0	0	0	113.6
442	S	40.1	Very low	48.9	Very low	111 Å²	111	124.5 Å²	124.5	78%	0.776	64%	0.641	S	S	*	*			trans	-115.6	137.5	164.1	55.8	0	0	0	0	110.8
443	V	46.5	Very low	50.7	Low	117 Å²	117	123.5 Å²	123.5	71%	0.709	64%	0.636	S	S	*	*			trans	-99.4	129.9	179.1	-178.3	0	0	0	0	109.1	S445	V443-S445 PolarHBondContact O-N 3.47Å
444	P	49.9	Very low	52.5	Low	84 Å²	84	122.2 Å²	122.2	55%	0.545	63%	0.63	S	S	.	*			trans	-64.6	134.3	179.4	-22.1	33.4	0	0	0	112.9	E446 K447	P444-E446 PolarHBondContact O-N 3.12Å; P444-E446 VanDerWaalsContact O-N 3.08Å; P444-K447 PolarHBondContact O-N 2.88Å
445	S	54.8	Low	54	Low	73 Å²	73	119.8 Å²	119.8	51%	0.51	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-59.5	-21.2	-179.4	53.6	0	0	0	0	114.7	V443 K447 I448	V443-S445 PolarHBondContact O-N 3.47Å; S445-K447 PolarHBondContact O-N 3.25Å; S445-K447 VanDerWaalsContact O-N 3.08Å; S445-I448 PolarHBondContact O-N 3.26Å; S445-I448 VanDerWaalsContact O-N 3.15Å
446	E	56	Low	55.8	Low	180 Å²	180	115.4 Å²	115.4	84%	0.841	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-63.4	-13.3	180	-62.5	180	157.7	0	0	114.4	P444	P444-E446 PolarHBondContact O-N 3.12Å; P444-E446 VanDerWaalsContact O-N 3.08Å
447	K	57.6	Low	57.8	Low	127 Å²	127	115.4 Å²	115.4	55%	0.552	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-99.6	-9	176.4	-71.8	-167.8	171.6	-166.2	0	115.2	P444 S445 E450 I451	P444-K447 PolarHBondContact O-N 2.88Å; S445-K447 PolarHBondContact O-N 3.25Å; S445-K447 VanDerWaalsContact O-N 3.08Å; K447-E450 PolarHBondContact O-N 3.07Å; K447-I451 WeakPolarHBondContact O-CG1 3.48Å; K447-I451 PolarHBondContact O-N 2.75Å
448	I	61.9	Low	59.5	Low	31 Å²	31	111.6 Å²	111.6	16%	0.159	58%	0.577	C	S	.	*	H	α-helix	trans	-69.3	-38.2	-172.3	-64.8	178.7	0	0	0	111.4	S445 K452 L496	S445-I448 PolarHBondContact O-N 3.26Å; S445-I448 VanDerWaalsContact O-N 3.15Å; I448-K452 PolarHBondContact O-N 2.82Å; I448-K452 VanDerWaalsContact O-N 3.08Å; I448-L496 HydrophobicContact CG2-CB 4.49Å; I448-L496 HydrophobicContact CG2-CD1 4.28Å; I448-L496 HydrophobicContact CG2-CD2 3.74Å; I448-L496 HydrophobicContact CG2-CG 4.37Å
449	E	61.6	Low	61.1	Low	137 Å²	137	108.3 Å²	108.3	64%	0.64	56%	0.559	S	S	*	*	H	α-helix	trans	-65.4	-36.6	176	-71.8	-88.6	116	0	0	112.7	K452 E453	E449-K452 WeakPolarHBondContact O-CB 3.05Å; E449-K452 PolarHBondContact O-N 3.47Å; E449-E453 PolarHBondContact O-N 3.13Å
450	E	69	Low	63.1	Low	137 Å²	137	106.8 Å²	106.8	64%	0.64	54%	0.544	S	S	*	.	H	α-helix	trans	-67.8	-42	179.2	-169	170.7	-149.5	0	0	111.1	K447 K452 E453 E454	K447-E450 PolarHBondContact O-N 3.07Å; E450-K452 VanDerWaalsContact C-N 3.3Å; E450-K452 PolarHBondContact O-N 3.37Å; E450-E453 PolarHBondContact O-N 3.08Å; E450-E454 PolarHBondContact O-N 3.42Å
451	I	68.6	Low	64.9	Low	88 Å²	88	104.4 Å²	104.4	45%	0.451	53%	0.531	S	S	.	.	H	α-helix	trans	-64	-36	174.3	-64.9	166	0	0	0	111.1	K447 E454 M455	K447-I451 WeakPolarHBondContact O-CG1 3.48Å; K447-I451 PolarHBondContact O-N 2.75Å; I451-E454 PolarHBondContact O-N 2.98Å; I451-M455 HydrophobicContact CG2-CG 4.33Å; I451-M455 HydrophobicContact CG2-SD 4.06Å; I451-M455 WeakPolarHBondContact O-CB 3.26Å; I451-M455 WeakPolarHBondContact O-CG 3.04Å; I451-M455 PolarHBondContact O-N 3.44Å
452	K	71.6	Confident	66.7	Low	47 Å²	47	100.6 Å²	100.6	20%	0.204	51%	0.511	C	S	.	.	H	α-helix	trans	-62.4	-49.8	177.7	-171.5	-178.1	-168.7	167.5	0	112	I448 E449 E450 E454 Q456 L492 D493 L496	I448-K452 PolarHBondContact O-N 2.82Å; I448-K452 VanDerWaalsContact O-N 3.08Å; E449-K452 WeakPolarHBondContact O-CB 3.05Å; E449-K452 PolarHBondContact O-N 3.47Å; E450-K452 VanDerWaalsContact C-N 3.3Å; E450-K452 PolarHBondContact O-N 3.37Å; K452-E454 VanDerWaalsContact C-N 3.34Å; K452-E454 PolarHBondContact O-N 3.42Å; K452-Q456 VanDerWaalsContact O-CB 3.31Å; K452-Q456 WeakPolarHBondContact O-CB 3.4Å; K452-Q456 PolarHBondContact O-N 3.39Å; K452-L492 HydrophobicContact CG-CD2 3.94Å; K452-L492 HydrophobicContact CG-CG 4.42Å; K452-D493 VanDerWaalsContact CE-OD1 3.22Å; K452-D493 WeakPolarHBondContact CE-OD1 3.42Å; K452-D493 IonicContact NZ-OD1 2.68Å; K452-D493 PolarHBondContact NZ-OD1 2.92Å; K452-L496 HydrophobicContact CB-CD1 3.83Å; K452-L496 HydrophobicContact CD-CD1 3.55Å; K452-L496 HydrophobicContact CG-CD1 3.65Å
453	E	75.5	Confident	68.6	Low	151 Å²	151	95.9 Å²	95.9	71%	0.706	48%	0.477	S	S	*	.	H	α-helix	trans	-64	-38.5	179.3	-70.2	-164.6	154	0	0	112	E449 E450 K457	E449-E453 PolarHBondContact O-N 3.13Å; E450-E453 PolarHBondContact O-N 3.08Å; E453-K457 PolarHBondContact O-N 3.17Å
454	E	75.7	Confident	70.1	Confident	131 Å²	131	94.2 Å²	94.2	61%	0.612	46%	0.464	S	S	*	.	H	α-helix	trans	-68.9	-44.8	178.8	-168.2	161.7	-138.2	0	0	112.2	E450 I451 K452 Q456 K457 E458	E450-E454 PolarHBondContact O-N 3.42Å; I451-E454 PolarHBondContact O-N 2.98Å; K452-E454 VanDerWaalsContact C-N 3.34Å; K452-E454 PolarHBondContact O-N 3.42Å; E454-Q456 PolarHBondContact O-N 2.99Å; E454-K457 PolarHBondContact O-N 3.33Å; E454-E458 PolarHBondContact O-N 2.71Å
455	M	69.8	Low	71.7	Confident	85 Å²	85	96.2 Å²	96.2	42%	0.419	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-41	175.4	-73.7	-173.4	69.8	0	0	112.8	I451 K457 E458 F459 L492	I451-M455 HydrophobicContact CG2-CG 4.33Å; I451-M455 HydrophobicContact CG2-SD 4.06Å; I451-M455 WeakPolarHBondContact O-CB 3.26Å; I451-M455 WeakPolarHBondContact O-CG 3.04Å; I451-M455 PolarHBondContact O-N 3.44Å; M455-K457 VanDerWaalsContact C-N 3.26Å; M455-K457 PolarHBondContact O-N 2.97Å; M455-E458 PolarHBondContact O-N 2.81Å; M455-F459 HydrophobicContact CB-CE2 4.31Å; M455-F459 HydrophobicContact CE-CE2 4.1Å; M455-F459 HydrophobicContact CE-CZ 4.2Å; M455-F459 WeakPolarHBondContact O-CD2 3.35Å; M455-F459 PolarHBondContact O-N 2.55Å; M455-F459 VanDerWaalsContact O-N 3.09Å; M455-L492 HydrophobicContact CB-CD1 4.48Å; M455-L492 HydrophobicContact CB-CD2 4.44Å; M455-L492 HydrophobicContact CE-CD1 4.09Å; M455-L492 HydrophobicContact SD-CD1 4.07Å
456	Q	73.4	Confident	72.8	Confident	64 Å²	64	94.5 Å²	94.5	30%	0.299	46%	0.456	S	S	.	.	H	α-helix	trans	-63.7	-34.1	-179.3	-166.7	166.8	-4.4	0	0	111.9	K452 E454 D460 E489 L492	K452-Q456 VanDerWaalsContact O-CB 3.31Å; K452-Q456 WeakPolarHBondContact O-CB 3.4Å; K452-Q456 PolarHBondContact O-N 3.39Å; E454-Q456 PolarHBondContact O-N 2.99Å; Q456-D460 PolarHBondContact O-N 2.91Å; Q456-E489 PolarHBondContact NE2-OE1 3.09Å; Q456-L492 HydrophobicContact CB-CD2 4.39Å
457	K	79.8	Confident	73.8	Confident	136 Å²	136	88.6 Å²	88.6	59%	0.591	43%	0.428	S	S	*	.	H	α-helix	trans	-68.7	-40.1	174.7	-179	-175.1	165	-134.5	0	113.3	E453 E454 M455 D460 N461	E453-K457 PolarHBondContact O-N 3.17Å; E454-K457 PolarHBondContact O-N 3.33Å; M455-K457 VanDerWaalsContact C-N 3.26Å; M455-K457 PolarHBondContact O-N 2.97Å; K457-D460 PolarHBondContact O-N 2.7Å; K457-N461 PolarHBondContact O-N 3.13Å
458	E	78.4	Confident	74.8	Confident	90 Å²	90	89.3 Å²	89.3	42%	0.421	43%	0.434	S	S	.	.	H	α-helix	trans	-68.6	-36.5	176.1	-67.1	-53.2	133.1	0	0	111.9	E454 M455 D460 N461 I462	E454-E458 PolarHBondContact O-N 2.71Å; M455-E458 PolarHBondContact O-N 2.81Å; E458-D460 PolarHBondContact O-N 3.37Å; E458-N461 WeakPolarHBondContact O-CB 3.41Å; E458-N461 PolarHBondContact O-N 2.03Å; E458-I462 WeakPolarHBondContact O-CG1 3.42Å; E458-I462 PolarHBondContact O-N 2.99Å; E458-I462 VanDerWaalsContact O-N 3.08Å
459	F	77	Confident	75.6	Confident	63 Å²	63	94 Å²	94	28%	0.276	46%	0.455	S	S	.	.	H	α-helix	trans	-61.3	-41.2	172	-72.1	-54.1	0	0	0	112.8	M455 N461 I462 I463 L488	M455-F459 HydrophobicContact CB-CE2 4.31Å; M455-F459 HydrophobicContact CE-CE2 4.1Å; M455-F459 HydrophobicContact CE-CZ 4.2Å; M455-F459 WeakPolarHBondContact O-CD2 3.35Å; M455-F459 PolarHBondContact O-N 2.55Å; M455-F459 VanDerWaalsContact O-N 3.09Å; F459-N461 VanDerWaalsContact C-N 3.3Å; F459-N461 PolarHBondContact O-N 3.45Å; F459-I462 PolarHBondContact O-N 3.49Å; F459-I463 WeakPolarHBondContact O-CD1 3.39Å; F459-I463 WeakPolarHBondContact O-CG1 3.21Å; F459-I463 PolarHBondContact O-N 3.18Å; F459-I463 VanDerWaalsContact O-N 3.1Å; F459-L488 HydrophobicContact CB-CD1 4.25Å; F459-L488 HydrophobicContact CD1-CD1 4.17Å; F459-L488 HydrophobicContact CD1-CD2 4.2Å; F459-L488 HydrophobicContact CE1-CD2 4.2Å; F459-L488 HydrophobicContact CG-CD1 4.33Å
460	D	75.8	Confident	76.2	Confident	62 Å²	62	90.4 Å²	90.4	33%	0.332	44%	0.44	S	S	.	.	H	α-helix	trans	-61.9	-38.1	176.6	-104.3	-25.6	0	0	0	112.6	Q456 K457 E458 I463 D464 R481	Q456-D460 PolarHBondContact O-N 2.91Å; K457-D460 PolarHBondContact O-N 2.7Å; E458-D460 PolarHBondContact O-N 3.37Å; D460-I463 PolarHBondContact O-N 3.39Å; D460-D464 PolarHBondContact O-N 3.18Å; D460-D464 VanDerWaalsContact O-N 3.16Å; D460-R481 PolarHBondContact O-NH1 3.4Å; D460-R481 IonicContact OD1-CZ 3.72Å; D460-R481 IonicContact OD1-NH1 2.71Å; D460-R481 IonicContact OD1-NH2 3.53Å; D460-R481 PolarHBondContact OD1-NH2 3.44Å
461	N	80.3	Confident	76.4	Confident	101 Å²	101	87.9 Å²	87.9	54%	0.54	43%	0.428	S	S	.	.	H	α-helix	trans	-66.7	-44.6	179.5	-152.1	21.9	0	0	0	111.4	K457 E458 F459 I463 D464 E465	K457-N461 PolarHBondContact O-N 3.13Å; E458-N461 WeakPolarHBondContact O-CB 3.41Å; E458-N461 PolarHBondContact O-N 2.03Å; F459-N461 VanDerWaalsContact C-N 3.3Å; F459-N461 PolarHBondContact O-N 3.45Å; N461-I463 VanDerWaalsContact C-N 3.33Å; N461-I463 PolarHBondContact O-N 3.14Å; N461-D464 PolarHBondContact O-N 3.4Å; N461-E465 PolarHBondContact O-N 3.38Å; N461-E465 VanDerWaalsContact O-N 3.08Å
462	I	77.8	Confident	76.7	Confident	98 Å²	98	89.1 Å²	89.1	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-63.6	-37.5	176	-66.7	163.8	0	0	0	111.5	E458 F459 E465 A466	E458-I462 WeakPolarHBondContact O-CG1 3.42Å; E458-I462 PolarHBondContact O-N 2.99Å; E458-I462 VanDerWaalsContact O-N 3.08Å; F459-I462 PolarHBondContact O-N 3.49Å; I462-E465 PolarHBondContact O-N 3.41Å; I462-A466 WeakPolarHBondContact O-CB 3.47Å; I462-A466 PolarHBondContact O-N 3.4Å
463	I	80	Confident	77	Confident	11 Å²	11	94 Å²	94	6%	0.056	46%	0.464	C	S	.	.	H	α-helix	trans	-68	-37.6	178.3	-68.9	165.9	0	0	0	111.4	F459 D460 N461 Q467 F479 R481 A484 T485 L488	F459-I463 WeakPolarHBondContact O-CD1 3.39Å; F459-I463 WeakPolarHBondContact O-CG1 3.21Å; F459-I463 PolarHBondContact O-N 3.18Å; F459-I463 VanDerWaalsContact O-N 3.1Å; D460-I463 PolarHBondContact O-N 3.39Å; N461-I463 VanDerWaalsContact C-N 3.33Å; N461-I463 PolarHBondContact O-N 3.14Å; I463-Q467 WeakPolarHBondContact O-CB 3.44Å; I463-Q467 PolarHBondContact O-N 3.09Å; I463-F479 HydrophobicContact CG2-CE1 3.78Å; I463-F479 HydrophobicContact CG2-CZ 3.94Å; I463-R481 HydrophobicContact CG2-CB 4.39Å; I463-R481 HydrophobicContact CG2-CG 3.81Å; I463-A484 HydrophobicContact CD1-CB 4.39Å; I463-T485 HydrophobicContact CD1-CG2 3.63Å; I463-L488 HydrophobicContact CD1-CD1 3.79Å; I463-L488 HydrophobicContact CG1-CD1 4.38Å
464	D	78.6	Confident	76.3	Confident	83 Å²	83	89.7 Å²	89.7	44%	0.444	46%	0.46	S	S	.	.	H	α-helix	trans	-69.9	-38.6	176.3	-78.3	-16.2	0	0	0	112.1	D460 N461 Q467 Q468 R481	D460-D464 PolarHBondContact O-N 3.18Å; D460-D464 VanDerWaalsContact O-N 3.16Å; N461-D464 PolarHBondContact O-N 3.4Å; D464-Q467 PolarHBondContact O-N 2.88Å; D464-Q468 WeakPolarHBondContact O-CB 3.34Å; D464-Q468 PolarHBondContact O-N 3.11Å; D464-R481 VanDerWaalsContact CG-NH1 3.32Å; D464-R481 IonicContact OD1-CZ 3.74Å; D464-R481 IonicContact OD1-NE 3.35Å; D464-R481 IonicContact OD1-NH1 2.66Å; D464-R481 PolarHBondContact OD1-NH1 2.84Å; D464-R481 IonicContact OD2-NH1 3.18Å
465	E	82.2	Confident	75.6	Confident	125 Å²	125	87.9 Å²	87.9	58%	0.584	45%	0.454	S	S	*	.	H	α-helix	trans	-61.4	-50.6	173	-174.6	169.5	-155.4	0	0	111.5	N461 I462 Q467 Q468 E469	N461-E465 PolarHBondContact O-N 3.38Å; N461-E465 VanDerWaalsContact O-N 3.08Å; I462-E465 PolarHBondContact O-N 3.41Å; E465-Q467 VanDerWaalsContact C-N 3.33Å; E465-Q467 PolarHBondContact O-N 3.32Å; E465-Q468 WeakPolarHBondContact O-CB 3.33Å; E465-Q468 PolarHBondContact O-N 3.32Å; E465-E469 PolarHBondContact O-N 3.22Å
466	A	77.9	Confident	74.7	Confident	37 Å²	37	91.3 Å²	91.3	31%	0.306	47%	0.466	S	S	.	.	H	α-helix	trans	-61.4	-37.4	178.3	0	0	0	0	0	113	I462 L470	I462-A466 WeakPolarHBondContact O-CB 3.47Å; I462-A466 PolarHBondContact O-N 3.4Å; A466-L470 WeakPolarHBondContact O-CG 3.47Å; A466-L470 PolarHBondContact O-N 3.05Å
467	Q	78.3	Confident	74	Confident	56 Å²	56	92 Å²	92	26%	0.262	49%	0.49	S	S	.	.	H	α-helix	trans	-68.7	-37	174.1	-176.9	168.7	-29.5	0	0	111.6	I463 D464 E465 L470 E471 F479	I463-Q467 WeakPolarHBondContact O-CB 3.44Å; I463-Q467 PolarHBondContact O-N 3.09Å; D464-Q467 PolarHBondContact O-N 2.88Å; E465-Q467 VanDerWaalsContact C-N 3.33Å; E465-Q467 PolarHBondContact O-N 3.32Å; Q467-L470 PolarHBondContact O-N 3.37Å; Q467-E471 PolarHBondContact NE2-OE1 2.8Å; Q467-E471 VanDerWaalsContact NE2-OE1 3.14Å; Q467-E471 WeakPolarHBondContact O-CG 3.42Å; Q467-E471 PolarHBondContact O-N 2.83Å; Q467-F479 HydrophobicContact CB-CD1 4.08Å; Q467-F479 HydrophobicContact CB-CE1 4.23Å; Q467-F479 HydrophobicContact CG-CD1 4.29Å
468	Q	78	Confident	73.1	Confident	143 Å²	143	93.5 Å²	93.5	67%	0.668	50%	0.499	S	S	*	.	H	α-helix	trans	-65.2	-41.4	177.5	-173.6	168.8	-16.9	0	0	111.9	D464 E465 E471 T472	D464-Q468 WeakPolarHBondContact O-CB 3.34Å; D464-Q468 PolarHBondContact O-N 3.11Å; E465-Q468 WeakPolarHBondContact O-CB 3.33Å; E465-Q468 PolarHBondContact O-N 3.32Å; Q468-E471 PolarHBondContact O-N 2.85Å; Q468-T472 WeakPolarHBondContact O-CG2 3.14Å; Q468-T472 PolarHBondContact O-N 2.89Å; Q468-T472 VanDerWaalsContact O-N 3.14Å
469	E	79.1	Confident	72.9	Confident	129 Å²	129	92.9 Å²	92.9	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-60.2	-50.8	174	-67.5	-162.2	141.3	0	0	111.7	E465 E471 T472 E473	E465-E469 PolarHBondContact O-N 3.22Å; E469-E471 VanDerWaalsContact C-N 3.25Å; E469-E471 PolarHBondContact O-N 2.88Å; E469-T472 WeakPolarHBondContact O-CA 3.29Å; E469-T472 PolarHBondContact O-N 3.39Å; E469-T472 PolarHBondContact O-OG1 2.84Å; E469-E473 PolarHBondContact O-N 2.91Å; E469-E473 VanDerWaalsContact O-N 3.14Å
470	L	73.3	Confident	72.7	Confident	61 Å²	61	94 Å²	94	32%	0.319	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-32	178.6	-71.1	168.7	0	0	0	113.3	A466 Q467 L475 F479	A466-L470 WeakPolarHBondContact O-CG 3.47Å; A466-L470 PolarHBondContact O-N 3.05Å; Q467-L470 PolarHBondContact O-N 3.37Å; L470-L475 PolarHBondContact O-N 2.85Å; L470-F479 HydrophobicContact CD1-CB 4.09Å; L470-F479 HydrophobicContact CD1-CD2 4.15Å; L470-F479 HydrophobicContact CD1-CG 4.22Å
471	E	73.6	Confident	72.9	Confident	85 Å²	85	94.5 Å²	94.5	40%	0.397	50%	0.501	S	S	.	.	H	α-helix	trans	-72	-30.2	172.9	-74.4	-162.4	-154.4	0	0	113	Q467 Q468 E469 G474 K476	Q467-E471 PolarHBondContact NE2-OE1 2.8Å; Q467-E471 VanDerWaalsContact NE2-OE1 3.14Å; Q467-E471 WeakPolarHBondContact O-CG 3.42Å; Q467-E471 PolarHBondContact O-N 2.83Å; Q468-E471 PolarHBondContact O-N 2.85Å; E469-E471 VanDerWaalsContact C-N 3.25Å; E469-E471 PolarHBondContact O-N 2.88Å; E471-G474 PolarHBondContact O-N 2.74Å; E471-K476 IonicContact OE1-NZ 2.68Å; E471-K476 IonicContact OE2-NZ 3.66Å; E471-K476 PolarHBondContact OE2-NZ 2.84Å
472	T	74.8	Confident	72.7	Confident	114 Å²	114	93.9 Å²	93.9	70%	0.699	50%	0.502	S	S	*	.	H	α-helix	trans	-73.7	-29.9	174.2	63	0	0	0	0	113.6	Q468 E469 G474	Q468-T472 WeakPolarHBondContact O-CG2 3.14Å; Q468-T472 PolarHBondContact O-N 2.89Å; Q468-T472 VanDerWaalsContact O-N 3.14Å; E469-T472 WeakPolarHBondContact O-CA 3.29Å; E469-T472 PolarHBondContact O-N 3.39Å; E469-T472 PolarHBondContact O-OG1 2.84Å; T472-G474 PolarHBondContact O-N 3.04Å
473	E	76.9	Confident	72.7	Confident	150 Å²	150	95.9 Å²	95.9	70%	0.701	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.9	174.1	-62.4	-157.6	141.5	0	0	113.7	E469	E469-E473 PolarHBondContact O-N 2.91Å; E469-E473 VanDerWaalsContact O-N 3.14Å
474	G	61.3	Low	72.5	Confident	60 Å²	60	96.6 Å²	96.6	62%	0.619	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	6.9	176.4	0	0	0	0	0	115	E471 T472 K476	E471-G474 PolarHBondContact O-N 2.74Å; T472-G474 PolarHBondContact O-N 3.04Å; G474-K476 PolarHBondContact O-N 2.86Å
475	L	60.4	Low	72.3	Confident	93 Å²	93	94 Å²	94	49%	0.487	50%	0.503	S	S	.	.			trans	-82.7	50.8	176.5	-67.3	174.1	0	0	0	111.8	L470 G477	L470-L475 PolarHBondContact O-N 2.85Å; L475-G477 PolarHBondContact O-N 3.09Å
476	K	51.1	Low	72	Confident	157 Å²	157	94 Å²	94	68%	0.683	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	94.7	-173.2	-164.1	178.8	-173.3	91.2	0	112	E471 G474	E471-K476 IonicContact OE1-NZ 2.68Å; E471-K476 IonicContact OE2-NZ 3.66Å; E471-K476 PolarHBondContact OE2-NZ 2.84Å; G474-K476 PolarHBondContact O-N 2.86Å
477	G	60.1	Low	72	Confident	77 Å²	77	94.6 Å²	94.6	79%	0.794	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.3	7.5	165	0	0	0	0	0	117.4	L475	L475-G477 PolarHBondContact O-N 3.09Å
478	E	60.8	Low	71.9	Confident	169 Å²	169	94.8 Å²	94.8	79%	0.79	51%	0.511	S	S	*	.			trans	-94.9	-10.3	-179.1	-164.6	159.2	-170.3	0	0	114.1
479	F	72.7	Confident	71.6	Confident	76 Å²	76	91.7 Å²	91.7	33%	0.333	50%	0.497	S	S	.	.			trans	-98.7	117.4	-179.9	-173	-104.6	0	0	0	112.3	I463 Q467 L470 R481 A484	I463-F479 HydrophobicContact CG2-CE1 3.78Å; I463-F479 HydrophobicContact CG2-CZ 3.94Å; Q467-F479 HydrophobicContact CB-CD1 4.08Å; Q467-F479 HydrophobicContact CB-CE1 4.23Å; Q467-F479 HydrophobicContact CG-CD1 4.29Å; L470-F479 HydrophobicContact CD1-CB 4.09Å; L470-F479 HydrophobicContact CD1-CD2 4.15Å; L470-F479 HydrophobicContact CD1-CG 4.22Å; F479-R481 HydrophobicContact CD1-CB 4.32Å; F479-R481 HydrophobicContact CE1-CB 4.02Å; F479-A484 HydrophobicContact CZ-CB 4.06Å
480	D	74.5	Confident	71.6	Confident	88 Å²	88	88.9 Å²	88.9	47%	0.471	49%	0.488	S	S	.	.			trans	-95.9	91.3	173.2	-168.3	-25.6	0	0	0	110.8	T482 Q483 A484	D480-T482 PolarHBondContact O-N 3.02Å; D480-T482 VanDerWaalsContact O-N 3.1Å; D480-T482 WeakPolarHBondContact OD1-CB 3.37Å; D480-T482 PolarHBondContact OD1-N 2.8Å; D480-T482 PolarHBondContact OD1-OG1 3.27Å; D480-Q483 HydrophobicContact CB-CB 4.18Å; D480-Q483 PolarHBondContact O-N 3.45Å; D480-Q483 VanDerWaalsContact O-N 3.09Å; D480-Q483 PolarHBondContact OD1-N 3.11Å; D480-A484 PolarHBondContact O-N 3.28Å
481	R	79.2	Confident	71.7	Confident	71 Å²	71	89.6 Å²	89.6	27%	0.268	50%	0.495	S	S	.	.	H	α-helix	trans	-51.9	-30.7	176.5	171.5	166.8	164.2	84.9	25.1	113	D460 I463 D464 F479 T485	D460-R481 PolarHBondContact O-NH1 3.4Å; D460-R481 IonicContact OD1-CZ 3.72Å; D460-R481 IonicContact OD1-NH1 2.71Å; D460-R481 IonicContact OD1-NH2 3.53Å; D460-R481 PolarHBondContact OD1-NH2 3.44Å; I463-R481 HydrophobicContact CG2-CB 4.39Å; I463-R481 HydrophobicContact CG2-CG 3.81Å; D464-R481 VanDerWaalsContact CG-NH1 3.32Å; D464-R481 IonicContact OD1-CZ 3.74Å; D464-R481 IonicContact OD1-NE 3.35Å; D464-R481 IonicContact OD1-NH1 2.66Å; D464-R481 PolarHBondContact OD1-NH1 2.84Å; D464-R481 IonicContact OD2-NH1 3.18Å; F479-R481 HydrophobicContact CD1-CB 4.32Å; F479-R481 HydrophobicContact CE1-CB 4.02Å; R481-T485 PolarHBondContact O-N 3.04Å; R481-T485 PolarHBondContact O-OG1 2.77Å; R481-T485 VanDerWaalsContact O-OG1 3.1Å
482	T	76.4	Confident	71.8	Confident	89 Å²	89	86 Å²	86	55%	0.546	48%	0.479	S	S	.	.	H	α-helix	trans	-78.1	-27.8	-178	69.1	0	0	0	0	113.4	D480 T485 Q486	D480-T482 PolarHBondContact O-N 3.02Å; D480-T482 VanDerWaalsContact O-N 3.1Å; D480-T482 WeakPolarHBondContact OD1-CB 3.37Å; D480-T482 PolarHBondContact OD1-N 2.8Å; D480-T482 PolarHBondContact OD1-OG1 3.27Å; T482-T485 PolarHBondContact O-OG1 3.36Å; T482-Q486 WeakPolarHBondContact O-CG 3.41Å; T482-Q486 PolarHBondContact O-N 2.98Å
483	Q	78.5	Confident	71.5	Confident	140 Å²	140	83.7 Å²	83.7	65%	0.654	46%	0.462	S	S	*	.	H	α-helix	trans	-76.2	-36.4	172.6	-171.7	177.3	-3.5	0	0	111.3	D480 A487	D480-Q483 HydrophobicContact CB-CB 4.18Å; D480-Q483 PolarHBondContact O-N 3.45Å; D480-Q483 VanDerWaalsContact O-N 3.09Å; D480-Q483 PolarHBondContact OD1-N 3.11Å; Q483-A487 WeakPolarHBondContact O-CB 3.35Å; Q483-A487 PolarHBondContact O-N 3.22Å; Q483-A487 VanDerWaalsContact O-N 3.13Å
484	A	73.8	Confident	71.2	Confident	26 Å²	26	82.9 Å²	82.9	22%	0.215	46%	0.456	C	S	.	.	H	α-helix	trans	-65.2	-48.6	178.3	0	0	0	0	0	112.3	I463 F479 D480 Q486 A487 L488	I463-A484 HydrophobicContact CD1-CB 4.39Å; F479-A484 HydrophobicContact CZ-CB 4.06Å; D480-A484 PolarHBondContact O-N 3.28Å; A484-Q486 PolarHBondContact O-N 3.35Å; A484-A487 PolarHBondContact O-N 3.36Å; A484-L488 PolarHBondContact O-N 3.22Å
485	T	75.6	Confident	71.3	Confident	28 Å²	28	85.1 Å²	85.1	17%	0.172	45%	0.454	C	S	.	.	H	α-helix	trans	-60.7	-46.5	177.4	45.1	0	0	0	0	112.1	I463 R481 T482 A487 L488 E489	I463-T485 HydrophobicContact CD1-CG2 3.63Å; R481-T485 PolarHBondContact O-N 3.04Å; R481-T485 PolarHBondContact O-OG1 2.77Å; R481-T485 VanDerWaalsContact O-OG1 3.1Å; T482-T485 PolarHBondContact O-OG1 3.36Å; T485-A487 VanDerWaalsContact C-N 3.31Å; T485-A487 PolarHBondContact O-N 3.12Å; T485-L488 PolarHBondContact O-N 2.99Å; T485-L488 VanDerWaalsContact O-N 3.14Å; T485-E489 WeakPolarHBondContact O-CG 3.27Å; T485-E489 PolarHBondContact O-N 3.35Å
486	Q	75.4	Confident	71.6	Confident	124 Å²	124	81.8 Å²	81.8	58%	0.579	44%	0.436	S	S	*	.	H	α-helix	trans	-62	-35	177.8	-73.6	-178.2	0.8	0	0	113.6	T482 A484 L488 T490	T482-Q486 WeakPolarHBondContact O-CG 3.41Å; T482-Q486 PolarHBondContact O-N 2.98Å; A484-Q486 PolarHBondContact O-N 3.35Å; Q486-L488 VanDerWaalsContact C-N 3.34Å; Q486-T490 WeakPolarHBondContact O-CB 3.45Å; Q486-T490 VanDerWaalsContact O-CG2 3.27Å; Q486-T490 WeakPolarHBondContact O-CG2 3.22Å; Q486-T490 PolarHBondContact O-N 3.31Å; Q486-T490 VanDerWaalsContact O-N 3.1Å; Q486-T490 PolarHBondContact O-OG1 3.25Å
487	A	77.3	Confident	72.2	Confident	51 Å²	51	79.1 Å²	79.1	42%	0.421	43%	0.429	S	S	.	.	H	α-helix	trans	-67	-36.7	176.4	0	0	0	0	0	112.1	Q483 A484 T485 T490 T491	Q483-A487 WeakPolarHBondContact O-CB 3.35Å; Q483-A487 PolarHBondContact O-N 3.22Å; Q483-A487 VanDerWaalsContact O-N 3.13Å; A484-A487 PolarHBondContact O-N 3.36Å; T485-A487 VanDerWaalsContact C-N 3.31Å; T485-A487 PolarHBondContact O-N 3.12Å; A487-T490 PolarHBondContact O-OG1 2.81Å; A487-T491 WeakPolarHBondContact O-CB 3.49Å; A487-T491 PolarHBondContact O-N 2.91Å; A487-T491 PolarHBondContact O-OG1 3.11Å
488	L	76.6	Confident	72.2	Confident	59 Å²	59	82.2 Å²	82.2	31%	0.309	42%	0.423	S	S	.	.	H	α-helix	trans	-76.1	-45.8	178.7	-68.7	164.7	0	0	0	111.7	F459 I463 A484 T485 Q486 T490 T491 L492	F459-L488 HydrophobicContact CB-CD1 4.25Å; F459-L488 HydrophobicContact CD1-CD1 4.17Å; F459-L488 HydrophobicContact CD1-CD2 4.2Å; F459-L488 HydrophobicContact CE1-CD2 4.2Å; F459-L488 HydrophobicContact CG-CD1 4.33Å; I463-L488 HydrophobicContact CD1-CD1 3.79Å; I463-L488 HydrophobicContact CG1-CD1 4.38Å; A484-L488 PolarHBondContact O-N 3.22Å; T485-L488 PolarHBondContact O-N 2.99Å; T485-L488 VanDerWaalsContact O-N 3.14Å; Q486-L488 VanDerWaalsContact C-N 3.34Å; L488-T490 PolarHBondContact O-N 3Å; L488-T491 WeakPolarHBondContact O-CB 3.37Å; L488-T491 PolarHBondContact O-N 2.97Å; L488-L492 PolarHBondContact O-N 3.26Å
489	E	73.3	Confident	71.8	Confident	79 Å²	79	79.4 Å²	79.4	37%	0.369	41%	0.413	S	S	.	.	H	α-helix	trans	-54.6	-50.7	173.8	-72.3	177.9	165.8	0	0	111.5	Q456 T485 T491 L492 D493	Q456-E489 PolarHBondContact NE2-OE1 3.09Å; T485-E489 WeakPolarHBondContact O-CG 3.27Å; T485-E489 PolarHBondContact O-N 3.35Å; E489-T491 PolarHBondContact O-N 3.38Å; E489-T491 VanDerWaalsContact O-N 3.12Å; E489-L492 PolarHBondContact O-N 3.1Å; E489-D493 PolarHBondContact O-N 2.04Å
490	T	77.8	Confident	70.8	Confident	69 Å²	69	81.4 Å²	81.4	42%	0.423	42%	0.423	S	S	.	.	H	α-helix	trans	-70.1	-7.5	178.6	60.8	0	0	0	0	114.4	Q486 A487 L488 K494	Q486-T490 WeakPolarHBondContact O-CB 3.45Å; Q486-T490 VanDerWaalsContact O-CG2 3.27Å; Q486-T490 WeakPolarHBondContact O-CG2 3.22Å; Q486-T490 PolarHBondContact O-N 3.31Å; Q486-T490 VanDerWaalsContact O-N 3.1Å; Q486-T490 PolarHBondContact O-OG1 3.25Å; A487-T490 PolarHBondContact O-OG1 2.81Å; L488-T490 PolarHBondContact O-N 3Å; T490-K494 WeakPolarHBondContact O-CG 3.4Å; T490-K494 PolarHBondContact O-NZ 3.47Å
491	T	76.1	Confident	69.5	Low	76 Å²	76	84.1 Å²	84.1	47%	0.466	43%	0.433	S	S	.	.	H	α-helix	trans	-94.5	-38.8	172.2	-59	0	0	0	0	110.5	A487 L488 E489 L495	A487-T491 WeakPolarHBondContact O-CB 3.49Å; A487-T491 PolarHBondContact O-N 2.91Å; A487-T491 PolarHBondContact O-OG1 3.11Å; L488-T491 WeakPolarHBondContact O-CB 3.37Å; L488-T491 PolarHBondContact O-N 2.97Å; E489-T491 PolarHBondContact O-N 3.38Å; E489-T491 VanDerWaalsContact O-N 3.12Å; T491-L495 PolarHBondContact O-N 3.02Å
492	L	74.9	Confident	67.8	Low	11 Å²	11	89.8 Å²	89.8	6%	0.058	46%	0.459	C	S	.	.	H	α-helix	trans	-63.1	-48.3	173.4	-172.7	61.3	0	0	0	111.3	K452 M455 Q456 L488 E489 K494 L495 L496	K452-L492 HydrophobicContact CG-CD2 3.94Å; K452-L492 HydrophobicContact CG-CG 4.42Å; M455-L492 HydrophobicContact CB-CD1 4.48Å; M455-L492 HydrophobicContact CB-CD2 4.44Å; M455-L492 HydrophobicContact CE-CD1 4.09Å; M455-L492 HydrophobicContact SD-CD1 4.07Å; Q456-L492 HydrophobicContact CB-CD2 4.39Å; L488-L492 PolarHBondContact O-N 3.26Å; E489-L492 PolarHBondContact O-N 3.1Å; L492-K494 VanDerWaalsContact C-N 3.33Å; L492-K494 PolarHBondContact O-N 2.96Å; L492-L495 WeakPolarHBondContact O-CB 3.44Å; L492-L495 PolarHBondContact O-N 3.13Å; L492-L496 HydrophobicContact CG-CD1 4.47Å; L492-L496 WeakPolarHBondContact O-CG 3.45Å; L492-L496 PolarHBondContact O-N 2.93Å; L492-L496 VanDerWaalsContact O-N 3.08Å
493	D	68.9	Low	66	Low	65 Å²	65	92.5 Å²	92.5	35%	0.348	47%	0.47	S	S	.	.	H	α-helix	trans	-54.4	-46.9	177.1	-76.3	-28.4	0	0	0	112.1	K452 E489 L495 L496 D497	K452-D493 VanDerWaalsContact CE-OD1 3.22Å; K452-D493 WeakPolarHBondContact CE-OD1 3.42Å; K452-D493 IonicContact NZ-OD1 2.68Å; K452-D493 PolarHBondContact NZ-OD1 2.92Å; E489-D493 PolarHBondContact O-N 2.04Å; D493-L495 VanDerWaalsContact C-N 3.26Å; D493-L495 PolarHBondContact O-N 2.82Å; D493-L496 PolarHBondContact O-N 2.89Å; D493-D497 PolarHBondContact O-N 2.72Å
494	K	71.5	Confident	64	Low	133 Å²	133	91.9 Å²	91.9	58%	0.578	48%	0.476	S	S	*	.	H	α-helix	trans	-65.1	-27.8	178.6	-68.7	-174.5	-165.5	96.8	0	113.8	T490 L492 H498	T490-K494 WeakPolarHBondContact O-CG 3.4Å; T490-K494 PolarHBondContact O-NZ 3.47Å; L492-K494 VanDerWaalsContact C-N 3.33Å; L492-K494 PolarHBondContact O-N 2.96Å; K494-H498 PolarHBondContact O-N 2.77Å
495	L	62.7	Low	62	Low	107 Å²	107	100.2 Å²	100.2	56%	0.56	51%	0.51	S	S	*	.	H	α-helix	trans	-74.7	-36.6	177.3	-110.5	152	0	0	0	110.9	T491 L492 D493 L499	T491-L495 PolarHBondContact O-N 3.02Å; L492-L495 WeakPolarHBondContact O-CB 3.44Å; L492-L495 PolarHBondContact O-N 3.13Å; D493-L495 VanDerWaalsContact C-N 3.26Å; D493-L495 PolarHBondContact O-N 2.82Å; L495-L499 WeakPolarHBondContact O-CG 3.15Å; L495-L499 PolarHBondContact O-N 3.09Å
496	L	67.4	Low	59.8	Low	23 Å²	23	105.7 Å²	105.7	12%	0.12	54%	0.539	C	S	.	.	H	α-helix	trans	-74.4	-42.8	176.7	-60.4	-177.3	0	0	0	112.1	I448 K452 L492 D493 H498 L499 E500	I448-L496 HydrophobicContact CG2-CB 4.49Å; I448-L496 HydrophobicContact CG2-CD1 4.28Å; I448-L496 HydrophobicContact CG2-CD2 3.74Å; I448-L496 HydrophobicContact CG2-CG 4.37Å; K452-L496 HydrophobicContact CB-CD1 3.83Å; K452-L496 HydrophobicContact CD-CD1 3.55Å; K452-L496 HydrophobicContact CG-CD1 3.65Å; L492-L496 HydrophobicContact CG-CD1 4.47Å; L492-L496 WeakPolarHBondContact O-CG 3.45Å; L492-L496 PolarHBondContact O-N 2.93Å; L492-L496 VanDerWaalsContact O-N 3.08Å; D493-L496 PolarHBondContact O-N 2.89Å; L496-H498 PolarHBondContact O-N 3.04Å; L496-L499 HydrophobicContact CD2-CD1 4.27Å; L496-L499 PolarHBondContact O-N 2.89Å; L496-E500 PolarHBondContact O-N 3.03Å; L496-E500 VanDerWaalsContact O-N 3.15Å
497	D	62.1	Low	57.5	Low	100 Å²	100	105.7 Å²	105.7	54%	0.535	55%	0.548	S	S	.	.	H	α-helix	trans	-52.2	-40.6	172.5	-72.8	-21	0	0	0	111.3	D493 L499 E500 E501	D493-D497 PolarHBondContact O-N 2.72Å; D497-L499 VanDerWaalsContact C-N 3.3Å; D497-L499 PolarHBondContact O-N 2.68Å; D497-E500 PolarHBondContact O-N 2.94Å; D497-E501 PolarHBondContact O-N 2.85Å; D497-E501 VanDerWaalsContact O-N 3.15Å
498	H	60.8	Low	55.1	Low	142 Å²	142	110.3 Å²	110.3	66%	0.657	56%	0.56	S	S	*	*	H	α-helix	trans	-78.1	-12.3	-178.1	-143.5	48.2	0	0	0	114.3	K494 L496 E501	K494-H498 PolarHBondContact O-N 2.77Å; L496-H498 PolarHBondContact O-N 3.04Å; H498-E501 IonicContact ND1-OE2 3.89Å
499	L	53.5	Low	52.8	Low	111 Å²	111	115 Å²	115	58%	0.581	58%	0.581	S	S	*	*	H	α-helix	trans	-88.3	-32	171.5	-71.1	166.2	0	0	0	111.5	L495 L496 D497	L495-L499 WeakPolarHBondContact O-CG 3.15Å; L495-L499 PolarHBondContact O-N 3.09Å; L496-L499 HydrophobicContact CD2-CD1 4.27Å; L496-L499 PolarHBondContact O-N 2.89Å; D497-L499 VanDerWaalsContact C-N 3.3Å; D497-L499 PolarHBondContact O-N 2.68Å
500	E	51.8	Low	50.6	Low	118 Å²	118	120 Å²	120	55%	0.551	60%	0.604	S	S	*	*	H	α-helix	trans	-77.5	-32.2	175.1	-67.5	-161.6	149.1	0	0	113.8	L496 D497 K502	L496-E500 PolarHBondContact O-N 3.03Å; L496-E500 VanDerWaalsContact O-N 3.15Å; D497-E500 PolarHBondContact O-N 2.94Å; E500-K502 PolarHBondContact O-N 2.91Å
501	E	46.6	Very low	47.9	Very low	145 Å²	145	125.9 Å²	125.9	68%	0.678	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-63.5	-9.2	-177.9	-84.9	-169.9	143.7	0	0	114.8	D497 H498	D497-E501 PolarHBondContact O-N 2.85Å; D497-E501 VanDerWaalsContact O-N 3.15Å; H498-E501 IonicContact ND1-OE2 3.89Å
502	K	43	Very low	45.4	Very low	189 Å²	189	127.8 Å²	127.8	82%	0.822	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-84.1	-10.6	-173.3	-144.8	175.9	-177.6	-176.1	0	115.2	E500	E500-K502 PolarHBondContact O-N 2.91Å
503	D	38.1	Very low	43.1	Very low	146 Å²	146	135.9 Å²	135.9	78%	0.781	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-91.1	-0.5	-175.9	-91.1	-22.9	0	0	0	115
504	V	37.3	Very low	40.8	Very low	127 Å²	127	143.9 Å²	143.9	77%	0.77	70%	0.698	S	S	*	*			trans	-136.9	65.1	-171.8	-162.2	0	0	0	0	114.1
505	E	30.9	Very low	38.4	Very low	201 Å²	201	144.1 Å²	144.1	94%	0.939	71%	0.71	S	S	*	*	S	Bend	trans	-145.3	145.3	146.8	-124.8	175.3	-160	0	0	113.4
506	D	30.3	Very low	36.5	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	72%	0.721	S	S	*	*			trans	-98.9	145.2	-135.6	-143.7	-14.6	0	0	0	116.1	Q508	D506-Q508 PolarHBondContact O-N 2.86Å
507	T	27.2	Very low	34.4	Very low	124 Å²	124	150.2 Å²	150.2	76%	0.761	75%	0.753	S	S	*	*			trans	-61.6	124.9	166.2	-64.1	0	0	0	0	111.1
508	Q	27.4	Very low	33	Very low	148 Å²	148	150 Å²	150	69%	0.692	76%	0.757	S	S	*	*			trans	-162.9	122.9	152.6	-117.7	170.8	89.2	0	0	117.2	D506	D506-Q508 PolarHBondContact O-N 2.86Å
509	Q	26.9	Very low	31.3	Very low	157 Å²	157	147.8 Å²	147.8	73%	0.734	76%	0.757	S	S	*	*			trans	73	140.6	162.3	-45	174.1	36.6	0	0	114.2
510	Q	26.8	Very low	29.8	Very low	185 Å²	185	154.5 Å²	154.5	86%	0.864	78%	0.775	S	S	*	*			cis	-153.6	153.1	17.4	-158.6	168.6	-5.2	0	0	112.4
511	K	22.4	Very low	28.4	Very low	191 Å²	191	152.4 Å²	152.4	83%	0.83	79%	0.785	S	S	*	*			trans	-91.6	143.1	-174.9	172.9	-173.9	-172.2	172.4	0	112.2
512	V	23.9	Very low	27.3	Very low	116 Å²	116	151.2 Å²	151.2	70%	0.703	79%	0.793	S	S	*	*			trans	174.9	126.8	135.1	144.7	0	0	0	0	117.3
513	Q	25.4	Very low	26.6	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	79%	0.793	S	S	*	*			trans	69.1	120.5	149.1	-71.5	173.3	-83.5	0	0	126.2
514	R	20.5	Very low	25.9	Very low	233 Å²	233	146.9 Å²	146.9	88%	0.879	80%	0.795	S	S	*	*			trans	-65.3	155.6	158.8	-65.2	169.5	162.9	168.4	-7	114.7
515	T	21.7	Very low	25.3	Very low	137 Å²	137	149.2 Å²	149.2	84%	0.84	80%	0.802	S	S	*	*				158	145	123.6	42.1	0	0	0	0	109.5
516	S	23.7	Very low	25	Very low	112 Å²	112	143.9 Å²	143.9	78%	0.783	79%	0.792	S	S	*	*			cis	-169.2	150.7	0.8	47	0	0	0	0	112
517	D	21.6	Very low	25	Very low	147 Å²	147	142.1 Å²	142.1	79%	0.786	79%	0.789	S	S	*	*			trans	-36.3	168.3	155.6	-135.8	5.5	0	0	0	115
518	P	33.3	Very low	24.8	Very low	96 Å²	96	144.8 Å²	144.8	62%	0.623	79%	0.793	S	S	*	*			cis	-151	177.2	7.7	45.4	-25	0	0	0	120.7
519	S	24.1	Very low	25.2	Very low	95 Å²	95	146.6 Å²	146.6	66%	0.664	80%	0.801	S	S	*	*				101.6	119.8	128.4	70.8	0	0	0	0	124.8
520	R	23.6	Very low	25.3	Very low	251 Å²	251	144.3 Å²	144.3	95%	0.947	80%	0.8	S	S	*	*				76.6	124.3	129.7	-82.7	-179.3	166.9	170.7	-3	121.7
521	G	21.9	Very low	25.1	Very low	75 Å²	75	142.9 Å²	142.9	77%	0.773	80%	0.798	S	S	*	*			trans	168.5	50.7	142.5	0	0	0	0	0	120.9
522	S	24.3	Very low	25.9	Very low	120 Å²	120	143.3 Å²	143.3	84%	0.839	80%	0.803	S	S	*	*			trans	-68	148.7	161.5	-42	0	0	0	0	110.5
523	P	27.9	Very low	26	Very low	128 Å²	128	142.4 Å²	142.4	83%	0.831	81%	0.807	S	S	*	*				-144.4	159.4	92.9	38.3	-23.6	0	0	0	115.7
524	S	23.1	Very low	26.2	Very low	115 Å²	115	138.5 Å²	138.5	80%	0.804	81%	0.806	S	S	*	*			trans	-68	144	177.2	-39.4	0	0	0	0	114
525	L	24.6	Very low	26.9	Very low	177 Å²	177	133.2 Å²	133.2	93%	0.927	80%	0.796	S	S	*	*			trans	-148.2	120.3	149.8	-89	176.3	0	0	0	109.7
526	A	23.6	Very low	27.8	Very low	89 Å²	89	133.7 Å²	133.7	74%	0.736	79%	0.793	S	S	*	*			trans	-79.7	175.2	154.7	0	0	0	0	0	108.9
527	P	32	Very low	28.7	Very low	107 Å²	107	134.6 Å²	134.6	70%	0.695	79%	0.785	S	S	*	*			cis	-133.5	176	0.6	39.6	-22.7	0	0	0	114.3
528	Q	22.1	Very low	30.1	Very low	180 Å²	180	129.2 Å²	129.2	84%	0.841	76%	0.757	S	S	*	*				164.7	138.7	129	-91.3	166.3	14.3	0	0	112.1
529	Q	35.1	Very low	30.8	Very low	186 Å²	186	131.3 Å²	131.3	87%	0.869	76%	0.756	S	S	*	*			trans	-71.9	143.8	156.6	-69.1	172.6	-88.7	0	0	109.2
530	P	28.8	Very low	32.2	Very low	109 Å²	109	127.3 Å²	127.3	71%	0.708	73%	0.727	S	S	*	*				-125.9	121.3	129.3	9	11.8	0	0	0	108.6
531	D	23.3	Very low	33.7	Very low	154 Å²	154	119.3 Å²	119.3	82%	0.824	70%	0.699	S	S	*	*				87.7	130.5	78.9	-83.4	-32.1	0	0	0	113
532	Q	39.6	Very low	35.3	Very low	200 Å²	200	115.9 Å²	115.9	94%	0.935	66%	0.664	S	S	*	*			trans	-70.3	136.8	-175.7	-61.4	164.6	-37.6	0	0	111.4
533	A	26.5	Very low	36.7	Very low	97 Å²	97	110.3 Å²	110.3	80%	0.802	63%	0.625	S	S	*	*			trans	-148.5	123.8	164.4	0	0	0	0	0	112.3
534	A	29.3	Very low	37.6	Very low	100 Å²	100	106.6 Å²	106.6	83%	0.826	60%	0.595	S	S	*	*			trans	58.3	77.7	161.9	0	0	0	0	0	118.6
535	D	35.8	Very low	38.9	Very low	122 Å²	122	104.7 Å²	104.7	65%	0.652	57%	0.571	S	S	*	*			trans	-96.7	112.7	153.5	177.8	36.5	0	0	0	108.3	H537	D535-H537 PolarHBondContact O-CE1 2.98Å; D535-H537 PolarHBondContact O-N 2.91Å; D535-H537 PolarHBondContact O-ND1 3.37Å
536	D	39.3	Very low	39.8	Very low	148 Å²	148	102.2 Å²	102.2	79%	0.791	55%	0.553	S	S	*	*			trans	-67.9	120	-173.3	-90.6	-35.5	0	0	0	111.9	V538	D536-V538 PolarHBondContact O-N 2.89Å; D536-V538 VanDerWaalsContact O-N 3.1Å
537	H	42.9	Very low	40.6	Very low	130 Å²	130	104.3 Å²	104.3	60%	0.602	56%	0.556	S	S	*	*			trans	-83.5	89.9	-147.2	-58.8	-51.8	0	0	0	116.9	D535 K539	D535-H537 PolarHBondContact O-CE1 2.98Å; D535-H537 PolarHBondContact O-N 2.91Å; D535-H537 PolarHBondContact O-ND1 3.37Å; H537-K539 PolarHBondContact O-N 3.14Å
538	V	50.4	Low	41	Very low	35 Å²	35	101.9 Å²	101.9	21%	0.212	55%	0.551	C	S	.	*			trans	-91.1	94.9	159.3	-160.7	0	0	0	0	110.6	D536 I540 A585	D536-V538 PolarHBondContact O-N 2.89Å; D536-V538 VanDerWaalsContact O-N 3.1Å; V538-I540 HydrophobicContact CG1-CD1 4.2Å; V538-I540 HydrophobicContact CG1-CG1 3.9Å; V538-I540 PolarHBondContact O-N 3.39Å; V538-I540 VanDerWaalsContact O-N 3.08Å; V538-A585 HydrophobicContact CG2-CB 3.38Å
539	K	49.3	Very low	41.9	Very low	139 Å²	139	99.9 Å²	99.9	60%	0.604	56%	0.557	S	S	*	*			trans	-83.6	80.3	179	-65.7	-159.3	176.2	-159.8	0	112.4	H537 K541	H537-K539 PolarHBondContact O-N 3.14Å; K539-K541 PolarHBondContact O-N 3.16Å
540	I	53.9	Low	42.1	Very low	11 Å²	11	95 Å²	95	6%	0.056	54%	0.544	C	S	.	.			trans	-73.6	116.2	174.8	-62.1	171.9	0	0	0	109.2	V538 I542 W567 K571 V574	V538-I540 HydrophobicContact CG1-CD1 4.2Å; V538-I540 HydrophobicContact CG1-CG1 3.9Å; V538-I540 PolarHBondContact O-N 3.39Å; V538-I540 VanDerWaalsContact O-N 3.08Å; I540-I542 HydrophobicContact CG2-CG1 4.14Å; I540-W567 WeakPolarHBondContact O-CZ2 3.04Å; I540-K571 HydrophobicContact CD1-CB 4.41Å; I540-K571 HydrophobicContact CD1-CG 3.85Å; I540-V574 HydrophobicContact CD1-CB 3.96Å; I540-V574 HydrophobicContact CD1-CG1 3.7Å; I540-V574 HydrophobicContact CG1-CG1 4.42Å
541	K	53.5	Low	42.9	Very low	83 Å²	83	96 Å²	96	36%	0.361	55%	0.55	S	S	.	*			trans	-114.4	122.8	174	-175.9	179	-177.6	178.4	0	109.9	K539 E559 E590 V591	K539-K541 PolarHBondContact O-N 3.16Å; K541-E559 VanDerWaalsContact CE-CD 3.41Å; K541-E559 VanDerWaalsContact CE-OE1 3.27Å; K541-E559 WeakPolarHBondContact CE-OE1 3.44Å; K541-E559 WeakPolarHBondContact CE-OE2 3.48Å; K541-E559 IonicContact NZ-OE1 3.97Å; K541-E559 PolarHBondContact NZ-OE1 3.22Å; K541-E559 IonicContact NZ-OE2 3.37Å; K541-E559 PolarHBondContact NZ-OE2 3.32Å; K541-E590 HydrophobicContact CB-CG 4.36Å; K541-V591 PolarHBondContact O-N 3.08Å
542	I	56.7	Low	43.9	Very low	4 Å²	4	95.1 Å²	95.1	2%	0.021	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.3	-179.8	-54.6	178.2	0	0	0	108.5	I540 W567 I570 I593 W606	I540-I542 HydrophobicContact CG2-CG1 4.14Å; I542-W567 HydrophobicContact CD1-CG 4.43Å; I542-I570 HydrophobicContact CD1-CB 3.79Å; I542-I570 HydrophobicContact CD1-CD1 4.28Å; I542-I570 HydrophobicContact CD1-CG2 3.56Å; I542-I593 HydrophobicContact CG2-CD1 4.21Å; I542-W606 HydrophobicContact CG2-CZ3 4.41Å
543	T	52.4	Low	44.3	Very low	3 Å²	3	89.5 Å²	89.5	2%	0.018	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	130.4	-178	5.8	0	0	0	0	111.3	V557 E559	T543-V557 HydrophobicContact CG2-CG1 3.86Å; T543-E559 HydrophobicContact CG2-CB 4.23Å; T543-E559 HydrophobicContact CG2-CG 3.75Å
544	K	46.7	Very low	44.8	Very low	50 Å²	50	93.2 Å²	93.2	22%	0.217	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.6	177.9	-170	169.1	-172.4	165.2	0	110	Q558 W606	K544-Q558 PolarHBondContact N-O 2.84Å; K544-Q558 PolarHBondContact O-N 2.79Å; K544-W606 HydrophobicContact CB-CH2 3.68Å; K544-W606 HydrophobicContact CB-CZ3 3.65Å; K544-W606 HydrophobicContact CD-CD2 4.07Å; K544-W606 HydrophobicContact CD-CE3 3.82Å; K544-W606 HydrophobicContact CD-CH2 3.76Å; K544-W606 HydrophobicContact CD-CZ2 4Å; K544-W606 HydrophobicContact CD-CZ3 3.68Å; K544-W606 HydrophobicContact CG-CH2 4.38Å; K544-W606 HydrophobicContact CG-CZ3 4.22Å
545	Y	51	Low	45.5	Very low	74 Å²	74	92.4 Å²	92.4	29%	0.29	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	118.8	-179.5	-65.1	-101	0	0	0	109.1	V555 V557 L594	Y545-V555 HydrophobicContact CD1-CG1 3.98Å; Y545-V557 HydrophobicContact CD1-CG2 3.83Å; Y545-V557 HydrophobicContact CE1-CG1 4.28Å; Y545-V557 HydrophobicContact CE1-CG2 3.64Å; Y545-L594 HydrophobicContact CD2-CD2 3.35Å; Y545-L594 HydrophobicContact CD2-CG 4.42Å; Y545-L594 HydrophobicContact CE2-CD2 4.05Å; Y545-L594 HydrophobicContact CG-CD2 3.73Å
546	K	44.2	Very low	46	Very low	126 Å²	126	94.9 Å²	94.9	55%	0.548	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.3	172.1	-90.9	177.3	175.2	164.5	0	109.4	G548 K556	K546-G548 PolarHBondContact O-N 3.38Å; K546-K556 PolarHBondContact N-O 3.15Å
547	T	41.1	Very low	46.4	Very low	132 Å²	132	91.3 Å²	91.3	81%	0.81	51%	0.514	S	S	*	.			trans	-74.2	91.8	164.8	-55.9	0	0	0	0	108.7
548	G	38.9	Very low	46.8	Very low	56 Å²	56	90.9 Å²	90.9	58%	0.577	51%	0.513	S	S	*	.			trans	-92.8	130	175.2	0	0	0	0	0	111.6	K546 S550	K546-G548 PolarHBondContact O-N 3.38Å; G548-S550 PolarHBondContact O-N 3.03Å
549	S	41.4	Very low	46.8	Very low	138 Å²	138	94.5 Å²	94.5	97%	0.965	53%	0.527	S	S	*	.			trans	-70.9	86.5	174.7	-51.3	0	0	0	0	111.1
550	S	39.5	Very low	47.1	Very low	85 Å²	85	89 Å²	89	59%	0.594	50%	0.504	S	S	*	.			trans	-124.9	144.3	173.2	-157.1	0	0	0	0	108.9	G548 D552	G548-S550 PolarHBondContact O-N 3.03Å; S550-D552 VanDerWaalsContact C-N 3.26Å; S550-D552 PolarHBondContact O-N 2.79Å
551	P	46.1	Very low	47.1	Very low	130 Å²	130	90.9 Å²	90.9	84%	0.844	53%	0.526	S	S	*	.	S	Bend	trans	-71.5	-14.9	-167.4	27.1	-35.2	0	0	0	115.1
552	D	43.3	Very low	47.1	Very low	135 Å²	135	93.9 Å²	93.9	72%	0.722	54%	0.541	S	S	*	.	S	Bend	trans	-104.2	120.4	165.4	-67.5	-57.6	0	0	0	108.6	S550 E554	S550-D552 VanDerWaalsContact C-N 3.26Å; S550-D552 PolarHBondContact O-N 2.79Å; D552-E554 PolarHBondContact O-N 2.79Å
553	G	47.3	Very low	46.6	Very low	82 Å²	82	97.3 Å²	97.3	85%	0.845	58%	0.577	S	S	*	*			trans	-75.3	46.5	-164.7	0	0	0	0	0	116.8
554	E	37.8	Very low	47.1	Very low	174 Å²	174	99.4 Å²	99.4	81%	0.813	59%	0.589	S	S	*	*			trans	-85	115.5	172.8	-70.8	-167.2	150	0	0	111.9	D552 K556	D552-E554 PolarHBondContact O-N 2.79Å; E554-K556 PolarHBondContact O-N 3.47Å
555	V	44.5	Very low	48	Very low	83 Å²	83	102 Å²	102	50%	0.503	61%	0.611	S	S	.	*			trans	-73.4	112.2	174.7	-179	0	0	0	0	109.7	Y545 V557	Y545-V555 HydrophobicContact CD1-CG1 3.98Å; V555-V557 PolarHBondContact O-N 2.64Å
556	K	45.3	Very low	48.3	Very low	175 Å²	175	101.8 Å²	101.8	76%	0.761	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.4	109.1	171.9	-81.5	-173.5	175.1	178.8	0	110.5	K546 E554	K546-K556 PolarHBondContact N-O 3.15Å; E554-K556 PolarHBondContact O-N 3.47Å
557	V	49.4	Very low	49.4	Very low	72 Å²	72	96.5 Å²	96.5	44%	0.436	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.6	131.3	168.9	-171.7	0	0	0	0	108.8	T543 Y545 V555 E559	T543-V557 HydrophobicContact CG2-CG1 3.86Å; Y545-V557 HydrophobicContact CD1-CG2 3.83Å; Y545-V557 HydrophobicContact CE1-CG1 4.28Å; Y545-V557 HydrophobicContact CE1-CG2 3.64Å; V555-V557 PolarHBondContact O-N 2.64Å; V557-E559 HydrophobicContact CG1-CG 4.38Å
558	Q	49.3	Very low	50.6	Low	121 Å²	121	93.5 Å²	93.5	57%	0.565	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120	111.8	168.9	-169.3	169.7	-4	0	0	107.8	K544	K544-Q558 PolarHBondContact N-O 2.84Å; K544-Q558 PolarHBondContact O-N 2.79Å
559	E	51.9	Low	52	Low	112 Å²	112	95.4 Å²	95.4	52%	0.523	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.6	139.6	176.1	-47.3	-153.1	145.6	0	0	109.5	K541 T543 V557	K541-E559 VanDerWaalsContact CE-CD 3.41Å; K541-E559 VanDerWaalsContact CE-OE1 3.27Å; K541-E559 WeakPolarHBondContact CE-OE1 3.44Å; K541-E559 WeakPolarHBondContact CE-OE2 3.48Å; K541-E559 IonicContact NZ-OE1 3.97Å; K541-E559 PolarHBondContact NZ-OE1 3.22Å; K541-E559 IonicContact NZ-OE2 3.37Å; K541-E559 PolarHBondContact NZ-OE2 3.32Å; T543-E559 HydrophobicContact CG2-CB 4.23Å; T543-E559 HydrophobicContact CG2-CG 3.75Å; V557-E559 HydrophobicContact CG1-CG 4.38Å
560	M	55.4	Low	53.2	Low	23 Å²	23	89.3 Å²	89.3	11%	0.113	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-77.1	135.5	174.5	-158.8	169.7	-153.3	0	0	108.9	D564 Q566 W567 W606	M560-D564 HydrophobicContact CE-CB 3.92Å; M560-D564 VanDerWaalsContact CE-OD2 3.24Å; M560-D564 WeakPolarHBondContact CE-OD2 3.34Å; M560-D564 HydrophobicContact CG-CB 4.17Å; M560-Q566 HydrophobicContact CE-CB 4.07Å; M560-W567 HydrophobicContact CE-CB 4.3Å; M560-W567 HydrophobicContact CG-CB 4.29Å; M560-W567 HydrophobicContact SD-CB 3.77Å; M560-W567 HydrophobicContact SD-CG 4.26Å; M560-W606 HydrophobicContact CB-CH2 3.83Å; M560-W606 HydrophobicContact CB-CZ2 4.37Å; M560-W606 HydrophobicContact CB-CZ3 4.47Å; M560-W606 HydrophobicContact CE-CD2 3.63Å; M560-W606 VanDerWaalsContact CE-CE2 3.48Å; M560-W606 HydrophobicContact CE-CE3 3.94Å; M560-W606 HydrophobicContact CE-CG 4.16Å; M560-W606 HydrophobicContact CE-CH2 4.01Å; M560-W606 HydrophobicContact CE-CZ2 3.7Å; M560-W606 HydrophobicContact CE-CZ3 4.1Å; M560-W606 HydrophobicContact CG-CH2 3.85Å; M560-W606 HydrophobicContact CG-CZ2 3.99Å; M560-W606 HydrophobicContact CG-CZ3 4.47Å; M560-W606 HydrophobicContact SD-CD2 4.38Å; M560-W606 HydrophobicContact SD-CE3 4.1Å; M560-W606 HydrophobicContact SD-CH2 3.7Å; M560-W606 HydrophobicContact SD-CZ2 3.99Å; M560-W606 HydrophobicContact SD-CZ3 3.73Å
561	G	53.3	Low	54.7	Low	50 Å²	50	87.8 Å²	87.8	52%	0.515	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-76.8	149	172.7	0	0	0	0	0	111.3	G563 D564	G561-G563 PolarHBondContact O-N 3.29Å; G561-D564 PolarHBondContact O-N 2.85Å
562	E	54.4	Low	55.9	Low	147 Å²	147	85.7 Å²	85.7	69%	0.687	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-0.8	-177.8	-167.1	159.3	-153.4	0	0	114.7	W567 Q568	E562-W567 HydrophobicContact CG-CE3 4.41Å; E562-W567 HydrophobicContact CG-CH2 3.64Å; E562-W567 HydrophobicContact CG-CZ2 4.28Å; E562-W567 HydrophobicContact CG-CZ3 3.72Å; E562-Q568 PolarHBondContact O-NE2 3.03Å
563	G	46.2	Very low	57.3	Low	75 Å²	75	79.7 Å²	79.7	77%	0.773	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	11.9	-178.3	0	0	0	0	0	115.7	G561	G561-G563 PolarHBondContact O-N 3.29Å
564	D	62	Low	58.4	Low	48 Å²	48	75.9 Å²	75.9	26%	0.257	41%	0.409	S	S	.	.			trans	-86.3	130	175.5	-170	-45.5	0	0	0	110.6	M560 G561 Q566 W567 Q568	M560-D564 HydrophobicContact CE-CB 3.92Å; M560-D564 VanDerWaalsContact CE-OD2 3.24Å; M560-D564 WeakPolarHBondContact CE-OD2 3.34Å; M560-D564 HydrophobicContact CG-CB 4.17Å; G561-D564 PolarHBondContact O-N 2.85Å; D564-Q566 PolarHBondContact O-N 3.22Å; D564-Q566 WeakPolarHBondContact OD1-CB 3.28Å; D564-Q566 PolarHBondContact OD1-N 3.24Å; D564-W567 HydrophobicContact CB-CB 4.11Å; D564-W567 VanDerWaalsContact O-CB 3.3Å; D564-W567 WeakPolarHBondContact O-CB 3.43Å; D564-W567 PolarHBondContact O-N 3.33Å; D564-Q568 PolarHBondContact O-N 3.48Å
565	P	65.2	Low	60.1	Low	105 Å²	105	72.2 Å²	72.2	68%	0.682	39%	0.39	S	S	*	.	H	α-helix	trans	-60.5	-31.2	178.8	24.5	-34.4	0	0	0	113.4	W567 Q568 H569	P565-W567 VanDerWaalsContact C-N 3.3Å; P565-W567 PolarHBondContact O-N 3.03Å; P565-Q568 PolarHBondContact O-N 3.14Å; P565-H569 PolarHBondContact O-N 3.43Å; P565-H569 VanDerWaalsContact O-N 3.15Å
566	Q	58.3	Low	61.5	Low	68 Å²	68	71.7 Å²	71.7	32%	0.318	38%	0.382	S	S	.	.	H	α-helix	trans	-71.5	-26.9	176.1	-62.1	-165.6	-35.1	0	0	111.9	M560 D564 I570 W606	M560-Q566 HydrophobicContact CE-CB 4.07Å; D564-Q566 PolarHBondContact O-N 3.22Å; D564-Q566 WeakPolarHBondContact OD1-CB 3.28Å; D564-Q566 PolarHBondContact OD1-N 3.24Å; Q566-I570 WeakPolarHBondContact O-CG1 3.31Å; Q566-I570 PolarHBondContact O-N 3.04Å; Q566-I570 VanDerWaalsContact O-N 3.17Å; Q566-W606 VanDerWaalsContact OE1-CD1 3.23Å
567	W	67.5	Low	62.6	Low	16 Å²	16	64.7 Å²	64.7	6%	0.061	35%	0.352	C	S	.	.	H	α-helix	trans	-66.3	-44.1	173.1	-176	87.1	0	0	0	111.6	I540 I542 M560 E562 D564 P565 I570 K571	I540-W567 WeakPolarHBondContact O-CZ2 3.04Å; I542-W567 HydrophobicContact CD1-CG 4.43Å; M560-W567 HydrophobicContact CE-CB 4.3Å; M560-W567 HydrophobicContact CG-CB 4.29Å; M560-W567 HydrophobicContact SD-CB 3.77Å; M560-W567 HydrophobicContact SD-CG 4.26Å; E562-W567 HydrophobicContact CG-CE3 4.41Å; E562-W567 HydrophobicContact CG-CH2 3.64Å; E562-W567 HydrophobicContact CG-CZ2 4.28Å; E562-W567 HydrophobicContact CG-CZ3 3.72Å; D564-W567 HydrophobicContact CB-CB 4.11Å; D564-W567 VanDerWaalsContact O-CB 3.3Å; D564-W567 WeakPolarHBondContact O-CB 3.43Å; D564-W567 PolarHBondContact O-N 3.33Å; P565-W567 VanDerWaalsContact C-N 3.3Å; P565-W567 PolarHBondContact O-N 3.03Å; W567-I570 PolarHBondContact O-N 2.83Å; W567-K571 HydrophobicContact CE3-CD 4.2Å; W567-K571 HydrophobicContact CH2-CD 3.74Å; W567-K571 HydrophobicContact CZ2-CD 4.48Å; W567-K571 HydrophobicContact CZ3-CD 3.58Å; W567-K571 VanDerWaalsContact O-CB 3.25Å; W567-K571 WeakPolarHBondContact O-CB 3.32Å; W567-K571 PolarHBondContact O-N 2.93Å
568	Q	65.6	Low	63.5	Low	69 Å²	69	61.5 Å²	61.5	32%	0.322	33%	0.333	S	S	.	.	H	α-helix	trans	-63.6	-45	176.8	-59.3	-68.1	-4.3	0	0	110.8	E562 D564 P565 I570 K571 D572	E562-Q568 PolarHBondContact O-NE2 3.03Å; D564-Q568 PolarHBondContact O-N 3.48Å; P565-Q568 PolarHBondContact O-N 3.14Å; Q568-I570 PolarHBondContact O-N 2.86Å; Q568-K571 WeakPolarHBondContact O-CB 3.19Å; Q568-K571 PolarHBondContact O-N 3.48Å; Q568-K571 VanDerWaalsContact O-N 3.12Å; Q568-D572 WeakPolarHBondContact O-CB 3.34Å; Q568-D572 VanDerWaalsContact O-CG 3.28Å; Q568-D572 PolarHBondContact O-N 3.3Å
569	H	68	Low	64.5	Low	95 Å²	95	61.6 Å²	61.6	44%	0.44	33%	0.333	S	S	.	.	H	α-helix	trans	-56.8	-46.2	177.1	-171.7	81.4	0	0	0	112.7	P565 V573 R616	P565-H569 PolarHBondContact O-N 3.43Å; P565-H569 VanDerWaalsContact O-N 3.15Å; H569-V573 WeakPolarHBondContact O-CB 3.49Å; H569-V573 WeakPolarHBondContact O-CG2 3.47Å; H569-V573 PolarHBondContact O-N 2.96Å; H569-V573 VanDerWaalsContact O-N 3.08Å; H569-R616 PolarHBondContact NE2-NH2 3.35Å; H569-R616 VanDerWaalsContact NE2-NH2 3.17Å
570	I	66.6	Low	65.2	Low	11 Å²	11	61.5 Å²	61.5	6%	0.056	33%	0.331	C	S	.	.	H	α-helix	trans	-68.1	-37.6	178.2	-62	166.4	0	0	0	111.1	I542 Q566 W567 Q568 V574 I593 L607 F615	I542-I570 HydrophobicContact CD1-CB 3.79Å; I542-I570 HydrophobicContact CD1-CD1 4.28Å; I542-I570 HydrophobicContact CD1-CG2 3.56Å; Q566-I570 WeakPolarHBondContact O-CG1 3.31Å; Q566-I570 PolarHBondContact O-N 3.04Å; Q566-I570 VanDerWaalsContact O-N 3.17Å; W567-I570 PolarHBondContact O-N 2.83Å; Q568-I570 PolarHBondContact O-N 2.86Å; I570-V574 HydrophobicContact CG2-CG2 4.44Å; I570-V574 WeakPolarHBondContact O-CB 3.39Å; I570-V574 VanDerWaalsContact O-CG2 3.28Å; I570-V574 WeakPolarHBondContact O-CG2 3.37Å; I570-V574 PolarHBondContact O-N 3.1Å; I570-I593 HydrophobicContact CG2-CD1 4.37Å; I570-L607 HydrophobicContact CD1-CD1 4.03Å; I570-F615 HydrophobicContact CG2-CE1 4.1Å
571	K	71	Confident	65.7	Low	52 Å²	52	62.4 Å²	62.4	23%	0.226	34%	0.342	C	S	.	.	H	α-helix	trans	-61.6	-48	176.1	178.3	-163.3	177.3	-176.6	0	111.7	I540 W567 Q568 V574 K575	I540-K571 HydrophobicContact CD1-CB 4.41Å; I540-K571 HydrophobicContact CD1-CG 3.85Å; W567-K571 HydrophobicContact CE3-CD 4.2Å; W567-K571 HydrophobicContact CH2-CD 3.74Å; W567-K571 HydrophobicContact CZ2-CD 4.48Å; W567-K571 HydrophobicContact CZ3-CD 3.58Å; W567-K571 VanDerWaalsContact O-CB 3.25Å; W567-K571 WeakPolarHBondContact O-CB 3.32Å; W567-K571 PolarHBondContact O-N 2.93Å; Q568-K571 WeakPolarHBondContact O-CB 3.19Å; Q568-K571 PolarHBondContact O-N 3.48Å; Q568-K571 VanDerWaalsContact O-N 3.12Å; K571-V574 PolarHBondContact O-N 3.18Å; K571-K575 WeakPolarHBondContact O-CB 3.23Å; K571-K575 PolarHBondContact O-N 3.44Å
572	D	72.4	Confident	65.9	Low	87 Å²	87	63 Å²	63	47%	0.465	35%	0.349	S	S	.	.	H	α-helix	trans	-66.7	-41.1	-178.3	-66.7	-27.7	0	0	0	111.1	Q568 K575 E576	Q568-D572 WeakPolarHBondContact O-CB 3.34Å; Q568-D572 VanDerWaalsContact O-CG 3.28Å; Q568-D572 PolarHBondContact O-N 3.3Å; D572-K575 PolarHBondContact O-N 3.47Å; D572-E576 WeakPolarHBondContact O-CB 3.41Å; D572-E576 PolarHBondContact O-N 2.82Å
573	V	71.6	Confident	66.2	Low	9 Å²	9	60.4 Å²	60.4	6%	0.055	34%	0.339	C	S	.	.	H	α-helix	trans	-58.5	-48.5	171.4	167.3	0	0	0	0	111.6	H569 K575 E576 Q577 R616	H569-V573 WeakPolarHBondContact O-CB 3.49Å; H569-V573 WeakPolarHBondContact O-CG2 3.47Å; H569-V573 PolarHBondContact O-N 2.96Å; H569-V573 VanDerWaalsContact O-N 3.08Å; V573-K575 VanDerWaalsContact C-N 3.32Å; V573-K575 PolarHBondContact O-N 2.83Å; V573-E576 PolarHBondContact O-N 3.42Å; V573-Q577 VanDerWaalsContact O-CG 3.3Å; V573-Q577 WeakPolarHBondContact O-CG 3.43Å; V573-Q577 PolarHBondContact O-N 2.81Å; V573-Q577 VanDerWaalsContact O-N 3.13Å; V573-R616 HydrophobicContact CG1-CG 3.48Å; V573-R616 VanDerWaalsContact CG1-CG 3.48Å; V573-R616 VanDerWaalsContact CG2-NH2 3.26Å
574	V	71.3	Confident	66.5	Low	2 Å²	2	65.8 Å²	65.8	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-64.6	-38.5	178.8	169.4	0	0	0	0	111.1	I540 I570 K571 L578 F615 L619	I540-V574 HydrophobicContact CD1-CB 3.96Å; I540-V574 HydrophobicContact CD1-CG1 3.7Å; I540-V574 HydrophobicContact CG1-CG1 4.42Å; I570-V574 HydrophobicContact CG2-CG2 4.44Å; I570-V574 WeakPolarHBondContact O-CB 3.39Å; I570-V574 VanDerWaalsContact O-CG2 3.28Å; I570-V574 WeakPolarHBondContact O-CG2 3.37Å; I570-V574 PolarHBondContact O-N 3.1Å; K571-V574 PolarHBondContact O-N 3.18Å; V574-L578 HydrophobicContact CG1-CD1 3.85Å; V574-L578 WeakPolarHBondContact O-CD1 3.09Å; V574-L578 VanDerWaalsContact O-CG 3.24Å; V574-L578 WeakPolarHBondContact O-CG 3.49Å; V574-L578 PolarHBondContact O-N 2.76Å; V574-L578 VanDerWaalsContact O-N 3.1Å; V574-F615 HydrophobicContact CG2-CE1 3.92Å; V574-F615 HydrophobicContact CG2-CZ 4.1Å; V574-L619 HydrophobicContact CG2-CD1 4.41Å; V574-L619 HydrophobicContact CG2-CD2 4.15Å
575	K	73.1	Confident	66.1	Low	96 Å²	96	65.4 Å²	65.4	42%	0.417	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-50.4	176.2	-177.4	179.3	172.9	-177.4	0	111.7	K571 D572 V573 Q577 L578 E579	K571-K575 WeakPolarHBondContact O-CB 3.23Å; K571-K575 PolarHBondContact O-N 3.44Å; D572-K575 PolarHBondContact O-N 3.47Å; V573-K575 VanDerWaalsContact C-N 3.32Å; V573-K575 PolarHBondContact O-N 2.83Å; K575-Q577 VanDerWaalsContact C-N 3.31Å; K575-Q577 PolarHBondContact O-N 2.84Å; K575-L578 PolarHBondContact O-N 2.9Å; K575-E579 WeakPolarHBondContact CE-OE1 3.15Å; K575-E579 WeakPolarHBondContact CG-OE1 3.13Å; K575-E579 WeakPolarHBondContact O-CG 3.42Å; K575-E579 PolarHBondContact O-N 2.9Å
576	E	73.6	Confident	65.3	Low	72 Å²	72	69.6 Å²	69.6	34%	0.336	36%	0.355	S	S	.	.	H	α-helix	trans	-55.8	-43.8	178	-171.8	-153.1	-174.7	0	0	111.8	D572 V573 E579 K580	D572-E576 WeakPolarHBondContact O-CB 3.41Å; D572-E576 PolarHBondContact O-N 2.82Å; V573-E576 PolarHBondContact O-N 3.42Å; E576-E579 PolarHBondContact O-N 2.72Å; E576-K580 HydrophobicContact CG-CD 4.29Å; E576-K580 WeakPolarHBondContact O-CB 3.24Å; E576-K580 WeakPolarHBondContact O-CG 3.17Å; E576-K580 PolarHBondContact O-N 2.95Å; E576-K580 WeakPolarHBondContact OE1-CE 3.01Å; E576-K580 IonicContact OE1-NZ 3.98Å; E576-K580 PolarHBondContact OE1-NZ 3.17Å
577	Q	68.3	Low	65	Low	29 Å²	29	68 Å²	68	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-71.3	-33.4	179.9	-62.3	-55.2	-46.9	0	0	112.9	V573 K575 A581 L619	V573-Q577 VanDerWaalsContact O-CG 3.3Å; V573-Q577 WeakPolarHBondContact O-CG 3.43Å; V573-Q577 PolarHBondContact O-N 2.81Å; V573-Q577 VanDerWaalsContact O-N 3.13Å; K575-Q577 VanDerWaalsContact C-N 3.31Å; K575-Q577 PolarHBondContact O-N 2.84Å; Q577-A581 WeakPolarHBondContact O-CB 3.45Å; Q577-A581 PolarHBondContact O-N 3.45Å; Q577-L619 HydrophobicContact CB-CD2 3.84Å; Q577-L619 HydrophobicContact CG-CD2 4.26Å
578	L	69.2	Low	64.3	Low	5 Å²	5	75.9 Å²	75.9	3%	0.026	39%	0.391	C	S	.	.	H	α-helix	trans	-68.2	-40.3	173.9	-73	165.1	0	0	0	112.1	V574 K575 A581 G582 L583 I589 L623	V574-L578 HydrophobicContact CG1-CD1 3.85Å; V574-L578 WeakPolarHBondContact O-CD1 3.09Å; V574-L578 VanDerWaalsContact O-CG 3.24Å; V574-L578 WeakPolarHBondContact O-CG 3.49Å; V574-L578 PolarHBondContact O-N 2.76Å; V574-L578 VanDerWaalsContact O-N 3.1Å; K575-L578 PolarHBondContact O-N 2.9Å; L578-A581 PolarHBondContact O-N 3.12Å; L578-G582 PolarHBondContact O-N 2.98Å; L578-L583 HydrophobicContact CD2-CD1 4.17Å; L578-L583 PolarHBondContact O-N 2.79Å; L578-I589 HydrophobicContact CD1-CD1 3.52Å; L578-I589 HydrophobicContact CD2-CD1 3.73Å; L578-I589 HydrophobicContact CG-CD1 4.3Å; L578-L623 HydrophobicContact CD2-CD1 3.8Å; L578-L623 HydrophobicContact CD2-CD2 4.12Å; L578-L623 HydrophobicContact CG-CD1 4.36Å
579	E	70.1	Confident	63.8	Low	122 Å²	122	75.2 Å²	75.2	57%	0.57	39%	0.389	S	S	*	.	H	α-helix	trans	-64.6	-45	174.5	-71.8	175.5	-172.5	0	0	111.2	K575 E576 A581 G582	K575-E579 WeakPolarHBondContact CE-OE1 3.15Å; K575-E579 WeakPolarHBondContact CG-OE1 3.13Å; K575-E579 WeakPolarHBondContact O-CG 3.42Å; K575-E579 PolarHBondContact O-N 2.9Å; E576-E579 PolarHBondContact O-N 2.72Å; E579-A581 VanDerWaalsContact C-N 3.27Å; E579-A581 PolarHBondContact O-N 3.11Å; E579-G582 PolarHBondContact O-N 3.3Å
580	K	66.9	Low	63.1	Low	110 Å²	110	75.8 Å²	75.8	48%	0.478	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-32.5	173.4	-77.4	173.8	174.7	175.6	0	113.4	E576 G582	E576-K580 HydrophobicContact CG-CD 4.29Å; E576-K580 WeakPolarHBondContact O-CB 3.24Å; E576-K580 WeakPolarHBondContact O-CG 3.17Å; E576-K580 PolarHBondContact O-N 2.95Å; E576-K580 WeakPolarHBondContact OE1-CE 3.01Å; E576-K580 IonicContact OE1-NZ 3.98Å; E576-K580 PolarHBondContact OE1-NZ 3.17Å; K580-G582 PolarHBondContact O-N 3.3Å
581	A	64.1	Low	62.8	Low	43 Å²	43	76.2 Å²	76.2	36%	0.355	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-0.7	174.4	0	0	0	0	0	113.8	Q577 L578 E579 L583	Q577-A581 WeakPolarHBondContact O-CB 3.45Å; Q577-A581 PolarHBondContact O-N 3.45Å; L578-A581 PolarHBondContact O-N 3.12Å; E579-A581 VanDerWaalsContact C-N 3.27Å; E579-A581 PolarHBondContact O-N 3.11Å; A581-L583 HydrophobicContact CB-CD1 4.35Å; A581-L583 HydrophobicContact CB-CG 4.3Å; A581-L583 PolarHBondContact O-N 3.2Å
582	G	59.2	Low	61.9	Low	63 Å²	63	78.8 Å²	78.8	65%	0.649	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	11	-179.8	0	0	0	0	0	114.3	L578 E579 K580 K584	L578-G582 PolarHBondContact O-N 2.98Å; E579-G582 PolarHBondContact O-N 3.3Å; K580-G582 PolarHBondContact O-N 3.3Å; G582-K584 PolarHBondContact O-N 3.33Å
583	L	60.6	Low	61.3	Low	91 Å²	91	76 Å²	76	48%	0.476	39%	0.391	S	S	.	.			trans	-82.7	96.2	178.5	-66.4	175.5	0	0	0	109.1	L578 A581 A585	L578-L583 HydrophobicContact CD2-CD1 4.17Å; L578-L583 PolarHBondContact O-N 2.79Å; A581-L583 HydrophobicContact CB-CD1 4.35Å; A581-L583 HydrophobicContact CB-CG 4.3Å; A581-L583 PolarHBondContact O-N 3.2Å; L583-A585 PolarHBondContact O-N 2.69Å
584	K	52	Low	60.3	Low	189 Å²	189	81.7 Å²	81.7	82%	0.822	42%	0.421	S	S	*	.			trans	-54.6	115.9	164.7	-68.3	-171.8	178.4	-172.9	0	108.1	G582 E586	G582-K584 PolarHBondContact O-N 3.33Å; K584-E586 PolarHBondContact O-N 3.31Å
585	A	53	Low	59.5	Low	40 Å²	40	84.5 Å²	84.5	33%	0.331	44%	0.438	S	S	.	.			trans	-81.3	51.6	-159.9	0	0	0	0	0	114.1	V538 L583 G587	V538-A585 HydrophobicContact CG2-CB 3.38Å; L583-A585 PolarHBondContact O-N 2.69Å; A585-G587 PolarHBondContact O-N 3.39Å
586	E	48	Very low	58.1	Low	192 Å²	192	91.6 Å²	91.6	90%	0.897	46%	0.462	S	S	*	.			trans	-74.9	61.1	171.7	-65.5	-176.2	-174.4	0	0	110.9	K584	K584-E586 PolarHBondContact O-N 3.31Å
587	G	52.1	Low	56.7	Low	34 Å²	34	95.3 Å²	95.3	35%	0.351	48%	0.477	S	S	.	.	S	Bend	trans	-170	145.9	-177.4	0	0	0	0	0	115.5	A585 I589	A585-G587 PolarHBondContact O-N 3.39Å; G587-I589 PolarHBondContact O-N 3.49Å
588	K	53.4	Low	55.6	Low	183 Å²	183	99.9 Å²	99.9	80%	0.796	50%	0.502	S	S	*	.			trans	-79.4	104.7	170.4	-67.4	179.7	-176.7	174.2	0	109.6
589	I	55.5	Low	54.3	Low	54 Å²	54	104.5 Å²	104.5	28%	0.277	54%	0.541	S	S	.	.			trans	-99.9	109.9	178.1	-60.8	170.3	0	0	0	108.7	L578 G587 V591	L578-I589 HydrophobicContact CD1-CD1 3.52Å; L578-I589 HydrophobicContact CD2-CD1 3.73Å; L578-I589 HydrophobicContact CG-CD1 4.3Å; G587-I589 PolarHBondContact O-N 3.49Å; I589-V591 HydrophobicContact CG2-CG2 4.08Å
590	E	54	Low	53.3	Low	108 Å²	108	107 Å²	107	51%	0.505	55%	0.553	S	S	.	*			trans	-97.8	127.8	176.9	-172.4	-177.6	-151.6	0	0	110.1	K541 K592	K541-E590 HydrophobicContact CB-CG 4.36Å; E590-K592 HydrophobicContact CG-CG 4.45Å; E590-K592 WeakPolarHBondContact OE1-CE 3.33Å; E590-K592 IonicContact OE1-NZ 2.65Å; E590-K592 PolarHBondContact OE1-NZ 2.85Å; E590-K592 WeakPolarHBondContact OE2-CE 3.38Å; E590-K592 IonicContact OE2-NZ 2.8Å; E590-K592 PolarHBondContact OE2-NZ 3.05Å
591	V	58.4	Low	52.3	Low	20 Å²	20	106.8 Å²	106.8	12%	0.121	56%	0.557	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.8	105.2	-173.8	-177.5	0	0	0	0	109.9	K541 I589 I593 F615	K541-V591 PolarHBondContact O-N 3.08Å; I589-V591 HydrophobicContact CG2-CG2 4.08Å; V591-I593 HydrophobicContact CG1-CG1 4.19Å; V591-F615 HydrophobicContact CG1-CE2 4.09Å; V591-F615 HydrophobicContact CG1-CZ 3.87Å
592	K	53.8	Low	51.4	Low	106 Å²	106	111.8 Å²	111.8	46%	0.461	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99	109.2	-177	-72.6	173.5	170	142.8	0	110.7	E590	E590-K592 HydrophobicContact CG-CG 4.45Å; E590-K592 WeakPolarHBondContact OE1-CE 3.33Å; E590-K592 IonicContact OE1-NZ 2.65Å; E590-K592 PolarHBondContact OE1-NZ 2.85Å; E590-K592 WeakPolarHBondContact OE2-CE 3.38Å; E590-K592 IonicContact OE2-NZ 2.8Å; E590-K592 PolarHBondContact OE2-NZ 3.05Å
593	I	58.3	Low	50.8	Low	28 Å²	28	111 Å²	111	14%	0.144	58%	0.576	C	S	.	*			trans	-98.4	116.5	-177.8	-53.3	180	0	0	0	109.2	I542 I570 V591 T595 F615	I542-I593 HydrophobicContact CG2-CD1 4.21Å; I570-I593 HydrophobicContact CG2-CD1 4.37Å; V591-I593 HydrophobicContact CG1-CG1 4.19Å; I593-T595 HydrophobicContact CG2-CG2 4.19Å; I593-F615 HydrophobicContact CD1-CD2 4.4Å; I593-F615 HydrophobicContact CD1-CE2 4Å; I593-F615 HydrophobicContact CD1-CZ 4.2Å; I593-F615 HydrophobicContact CG1-CE2 4.17Å
594	L	52.3	Low	50.4	Low	129 Å²	129	114.1 Å²	114.1	68%	0.675	59%	0.593	S	S	*	*			trans	-108.1	91.6	-178.7	-74.1	167.5	0	0	0	110.5	Y545	Y545-L594 HydrophobicContact CD2-CD2 3.35Å; Y545-L594 HydrophobicContact CD2-CG 4.42Å; Y545-L594 HydrophobicContact CE2-CD2 4.05Å; Y545-L594 HydrophobicContact CG-CD2 3.73Å
595	T	52.7	Low	50.4	Low	60 Å²	60	111.5 Å²	111.5	37%	0.368	58%	0.583	S	S	.	*			trans	-88.6	140.7	174	53.9	0	0	0	0	111.9	I593 L607	I593-T595 HydrophobicContact CG2-CG2 4.19Å; T595-L607 HydrophobicContact CG2-CD2 3.87Å
596	R	43.8	Very low	50.6	Low	245 Å²	245	112.1 Å²	112.1	93%	0.925	58%	0.577	S	S	*	*			trans	-100.9	115.7	175.1	-139.3	-173.3	-69.8	-175.5	-0.2	107.3
597	K	45	Very low	51.1	Low	151 Å²	151	104.1 Å²	104.1	66%	0.657	54%	0.54	S	S	*	.			trans	-78.7	126.5	-176.5	176.9	159.2	-175.1	160.5	0	111.6	D601	K597-D601 WeakPolarHBondContact CE-O 3.41Å; K597-D601 PolarHBondContact NZ-O 2.81Å
598	N	45	Very low	51.9	Low	125 Å²	125	105.2 Å²	105.2	67%	0.668	54%	0.54	S	S	*	.			trans	-80.3	149.9	161.5	-69.6	-17.4	0	0	0	109.8	E600	N598-E600 VanDerWaalsContact C-N 3.27Å; N598-E600 PolarHBondContact O-N 3.41Å; N598-E600 VanDerWaalsContact O-N 3.14Å
599	A	42.9	Very low	52.5	Low	101 Å²	101	104.6 Å²	104.6	84%	0.835	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.9	-159.1	0	0	0	0	0	116
600	E	47.8	Very low	53.1	Low	175 Å²	175	109.5 Å²	109.5	82%	0.818	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-12.4	-165.8	-66	-177	144.5	0	0	115.1	N598 T602	N598-E600 VanDerWaalsContact C-N 3.27Å; N598-E600 PolarHBondContact O-N 3.41Å; N598-E600 VanDerWaalsContact O-N 3.14Å; E600-T602 PolarHBondContact O-N 3.11Å
601	D	47.5	Very low	53.8	Low	105 Å²	105	108 Å²	108	56%	0.561	56%	0.557	S	S	*	*			trans	-73.7	100.7	178.8	-61.6	-51.3	0	0	0	112	K597 G603	K597-D601 WeakPolarHBondContact CE-O 3.41Å; K597-D601 PolarHBondContact NZ-O 2.81Å; D601-G603 VanDerWaalsContact C-N 3.29Å; D601-G603 PolarHBondContact O-N 2.96Å
602	T	44.9	Very low	54.3	Low	148 Å²	148	108 Å²	108	91%	0.908	56%	0.558	S	S	*	*			trans	-91.5	28.2	176.6	52.5	0	0	0	0	113.9	E600	E600-T602 PolarHBondContact O-N 3.11Å
603	G	45.3	Very low	55	Low	48 Å²	48	109.3 Å²	109.3	50%	0.495	56%	0.563	S	S	.	*	S	Bend	trans	-109	151.2	170.8	0	0	0	0	0	112.7	D601 Q605	D601-G603 VanDerWaalsContact C-N 3.29Å; D601-G603 PolarHBondContact O-N 2.96Å; G603-Q605 PolarHBondContact O-N 3.07Å
604	D	51.9	Low	55.4	Low	156 Å²	156	111.4 Å²	111.4	83%	0.834	58%	0.58	S	S	*	*			trans	-81.8	20	172.7	-96.1	-30.9	0	0	0	112.9	W606	D604-W606 PolarHBondContact O-N 2.95Å
605	Q	53.2	Low	56.3	Low	133 Å²	133	106.6 Å²	106.6	62%	0.621	55%	0.554	S	S	*	*			trans	-72.7	122.8	179.2	-159.2	160.6	6.9	0	0	110.1	G603	G603-Q605 PolarHBondContact O-N 3.07Å
606	W	56	Low	57	Low	54 Å²	54	107.8 Å²	107.8	21%	0.205	55%	0.552	C	S	.	*	S	Bend	trans	-78.8	-36.9	-170.3	-85.9	63	0	0	0	115.2	I542 K544 M560 Q566 D604	I542-W606 HydrophobicContact CG2-CZ3 4.41Å; K544-W606 HydrophobicContact CB-CH2 3.68Å; K544-W606 HydrophobicContact CB-CZ3 3.65Å; K544-W606 HydrophobicContact CD-CD2 4.07Å; K544-W606 HydrophobicContact CD-CE3 3.82Å; K544-W606 HydrophobicContact CD-CH2 3.76Å; K544-W606 HydrophobicContact CD-CZ2 4Å; K544-W606 HydrophobicContact CD-CZ3 3.68Å; K544-W606 HydrophobicContact CG-CH2 4.38Å; K544-W606 HydrophobicContact CG-CZ3 4.22Å; M560-W606 HydrophobicContact CB-CH2 3.83Å; M560-W606 HydrophobicContact CB-CZ2 4.37Å; M560-W606 HydrophobicContact CB-CZ3 4.47Å; M560-W606 HydrophobicContact CE-CD2 3.63Å; M560-W606 VanDerWaalsContact CE-CE2 3.48Å; M560-W606 HydrophobicContact CE-CE3 3.94Å; M560-W606 HydrophobicContact CE-CG 4.16Å; M560-W606 HydrophobicContact CE-CH2 4.01Å; M560-W606 HydrophobicContact CE-CZ2 3.7Å; M560-W606 HydrophobicContact CE-CZ3 4.1Å; M560-W606 HydrophobicContact CG-CH2 3.85Å; M560-W606 HydrophobicContact CG-CZ2 3.99Å; M560-W606 HydrophobicContact CG-CZ3 4.47Å; M560-W606 HydrophobicContact SD-CD2 4.38Å; M560-W606 HydrophobicContact SD-CE3 4.1Å; M560-W606 HydrophobicContact SD-CH2 3.7Å; M560-W606 HydrophobicContact SD-CZ2 3.99Å; M560-W606 HydrophobicContact SD-CZ3 3.73Å; Q566-W606 VanDerWaalsContact OE1-CD1 3.23Å; D604-W606 PolarHBondContact O-N 2.95Å
607	L	59.9	Low	58.1	Low	23 Å²	23	100.9 Å²	100.9	12%	0.12	53%	0.53	C	S	.	.	S	Bend	trans	-145	141.4	177	-63.7	175.1	0	0	0	105.4	I570 T595 D611	I570-L607 HydrophobicContact CD1-CD1 4.03Å; T595-L607 HydrophobicContact CG2-CD2 3.87Å; L607-D611 HydrophobicContact CB-CB 3.78Å; L607-D611 HydrophobicContact CD2-CB 3.94Å; L607-D611 HydrophobicContact CG-CB 4.39Å
608	T	67.8	Low	59.2	Low	57 Å²	57	98.6 Å²	98.6	35%	0.35	52%	0.524	S	S	.	.			trans	-69.1	171.3	164	62.7	0	0	0	0	110.3	E610 D611 T612	T608-E610 PolarHBondContact O-N 2.8Å; T608-E610 PolarHBondContact OG1-N 3.34Å; T608-D611 PolarHBondContact N-OD2 3.31Å; T608-D611 PolarHBondContact O-N 2.97Å; T608-D611 PolarHBondContact OG1-N 2.91Å; T608-D611 PolarHBondContact OG1-OD2 3.39Å; T608-T612 WeakPolarHBondContact O-CB 3.37Å; T608-T612 PolarHBondContact O-N 3.02Å; T608-T612 PolarHBondContact O-OG1 2.84Å
609	E	67.4	Low	60.2	Low	171 Å²	171	93.3 Å²	93.3	80%	0.799	50%	0.496	S	S	*	.	H	α-helix	trans	-62.1	-35	171.3	-62.9	-169.2	162.5	0	0	111.2	T612 K613	E609-T612 PolarHBondContact O-N 2.79Å; E609-K613 WeakPolarHBondContact O-CB 3.41Å; E609-K613 PolarHBondContact O-N 2.87Å
610	E	67.3	Low	61.1	Low	157 Å²	157	90.7 Å²	90.7	73%	0.734	47%	0.467	S	S	*	.	H	α-helix	trans	-65.3	-45.9	174.3	-57.5	179.8	143.6	0	0	112.1	T608 T612 K613 S614	T608-E610 PolarHBondContact O-N 2.8Å; T608-E610 PolarHBondContact OG1-N 3.34Å; E610-T612 VanDerWaalsContact C-N 3.27Å; E610-T612 PolarHBondContact O-N 3.24Å; E610-K613 PolarHBondContact O-N 2.81Å; E610-S614 WeakPolarHBondContact O-CB 3.02Å; E610-S614 PolarHBondContact O-N 3.26Å
611	D	68.3	Low	61.8	Low	75 Å²	75	86.2 Å²	86.2	40%	0.401	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-38.2	173.3	-75.2	-31.5	0	0	0	111.3	L607 T608 S614 F615	L607-D611 HydrophobicContact CB-CB 3.78Å; L607-D611 HydrophobicContact CD2-CB 3.94Å; L607-D611 HydrophobicContact CG-CB 4.39Å; T608-D611 PolarHBondContact N-OD2 3.31Å; T608-D611 PolarHBondContact O-N 2.97Å; T608-D611 PolarHBondContact OG1-N 2.91Å; T608-D611 PolarHBondContact OG1-OD2 3.39Å; D611-S614 PolarHBondContact O-N 2.94Å; D611-F615 VanDerWaalsContact O-CB 3.26Å; D611-F615 WeakPolarHBondContact O-CB 3.35Å; D611-F615 PolarHBondContact O-N 2.81Å
612	T	68.8	Low	62.7	Low	22 Å²	22	87.7 Å²	87.7	14%	0.135	46%	0.456	C	S	.	.	H	α-helix	trans	-68.1	-38.9	178.3	-57.3	0	0	0	0	111.1	T608 E609 E610 F615 R616	T608-T612 WeakPolarHBondContact O-CB 3.37Å; T608-T612 PolarHBondContact O-N 3.02Å; T608-T612 PolarHBondContact O-OG1 2.84Å; E609-T612 PolarHBondContact O-N 2.79Å; E610-T612 VanDerWaalsContact C-N 3.27Å; E610-T612 PolarHBondContact O-N 3.24Å; T612-F615 PolarHBondContact O-N 3.28Å; T612-R616 WeakPolarHBondContact O-CG 3.32Å; T612-R616 PolarHBondContact O-N 2.92Å
613	K	68.1	Low	63.5	Low	133 Å²	133	83.9 Å²	83.9	58%	0.578	43%	0.43	S	S	*	.	H	α-helix	trans	-65.4	-47.5	172.3	-176.3	-178.8	175.7	-174.8	0	111.6	E609 E610 F615 R616 E617	E609-K613 WeakPolarHBondContact O-CB 3.41Å; E609-K613 PolarHBondContact O-N 2.87Å; E610-K613 PolarHBondContact O-N 2.81Å; K613-F615 VanDerWaalsContact C-N 3.29Å; K613-F615 PolarHBondContact O-N 2.86Å; K613-R616 WeakPolarHBondContact O-CB 3.26Å; K613-R616 PolarHBondContact O-N 2.89Å; K613-R616 VanDerWaalsContact O-N 3.13Å; K613-E617 WeakPolarHBondContact CE-OE1 3.47Å; K613-E617 WeakPolarHBondContact O-CG 3.42Å; K613-E617 PolarHBondContact O-N 2.91Å
614	S	68.3	Low	64.1	Low	71 Å²	71	83.8 Å²	83.8	50%	0.497	42%	0.42	S	S	.	.	H	α-helix	trans	-58.4	-40.6	174.7	-177.1	0	0	0	0	111.9	E610 D611 E617 L618	E610-S614 WeakPolarHBondContact O-CB 3.02Å; E610-S614 PolarHBondContact O-N 3.26Å; D611-S614 PolarHBondContact O-N 2.94Å; S614-E617 PolarHBondContact O-N 2.78Å; S614-L618 VanDerWaalsContact O-CB 3.32Å; S614-L618 WeakPolarHBondContact O-CB 3.43Å; S614-L618 PolarHBondContact O-N 2.76Å
615	F	71.1	Confident	64.3	Low	29 Å²	29	79.4 Å²	79.4	13%	0.127	41%	0.412	C	S	.	.	H	α-helix	trans	-65.1	-41.9	174.1	175.5	-100.8	0	0	0	112.7	I570 V574 V591 I593 D611 T612 K613 L618 L619	I570-F615 HydrophobicContact CG2-CE1 4.1Å; V574-F615 HydrophobicContact CG2-CE1 3.92Å; V574-F615 HydrophobicContact CG2-CZ 4.1Å; V591-F615 HydrophobicContact CG1-CE2 4.09Å; V591-F615 HydrophobicContact CG1-CZ 3.87Å; I593-F615 HydrophobicContact CD1-CD2 4.4Å; I593-F615 HydrophobicContact CD1-CE2 4Å; I593-F615 HydrophobicContact CD1-CZ 4.2Å; I593-F615 HydrophobicContact CG1-CE2 4.17Å; D611-F615 VanDerWaalsContact O-CB 3.26Å; D611-F615 WeakPolarHBondContact O-CB 3.35Å; D611-F615 PolarHBondContact O-N 2.81Å; T612-F615 PolarHBondContact O-N 3.28Å; K613-F615 VanDerWaalsContact C-N 3.29Å; K613-F615 PolarHBondContact O-N 2.86Å; F615-L618 PolarHBondContact O-N 3.2Å; F615-L619 HydrophobicContact CZ-CD1 4.01Å; F615-L619 WeakPolarHBondContact O-CB 3.42Å; F615-L619 PolarHBondContact O-N 3.39Å
616	R	67.4	Low	64.4	Low	84 Å²	84	75.3 Å²	75.3	32%	0.317	41%	0.405	S	S	.	.	H	α-helix	trans	-58.9	-48.8	172.9	-73.8	176	-168.7	-159.8	8.7	111.1	H569 V573 T612 K613 L618 L619 I620	H569-R616 PolarHBondContact NE2-NH2 3.35Å; H569-R616 VanDerWaalsContact NE2-NH2 3.17Å; V573-R616 HydrophobicContact CG1-CG 3.48Å; V573-R616 VanDerWaalsContact CG1-CG 3.48Å; V573-R616 VanDerWaalsContact CG2-NH2 3.26Å; T612-R616 WeakPolarHBondContact O-CG 3.32Å; T612-R616 PolarHBondContact O-N 2.92Å; K613-R616 WeakPolarHBondContact O-CB 3.26Å; K613-R616 PolarHBondContact O-N 2.89Å; K613-R616 VanDerWaalsContact O-N 3.13Å; R616-L618 PolarHBondContact O-N 3.01Å; R616-L619 PolarHBondContact O-N 2.03Å; R616-I620 VanDerWaalsContact O-CG1 3.29Å; R616-I620 WeakPolarHBondContact O-CG1 3.23Å; R616-I620 PolarHBondContact O-N 2.77Å
617	E	65.4	Low	64.5	Low	100 Å²	100	75.3 Å²	75.3	47%	0.467	41%	0.411	S	S	.	.	H	α-helix	trans	-62.1	-40.1	177.9	-70.9	174.5	-167	0	0	112.1	K613 S614 I620 N621	K613-E617 WeakPolarHBondContact CE-OE1 3.47Å; K613-E617 WeakPolarHBondContact O-CG 3.42Å; K613-E617 PolarHBondContact O-N 2.91Å; S614-E617 PolarHBondContact O-N 2.78Å; E617-I620 PolarHBondContact O-N 3.22Å; E617-N621 WeakPolarHBondContact O-CB 3.36Å; E617-N621 PolarHBondContact O-N 3.31Å; E617-N621 PolarHBondContact O-ND2 2.95Å
618	L	68.2	Low	64.6	Low	103 Å²	103	78.4 Å²	78.4	54%	0.539	43%	0.425	S	S	.	.	H	α-helix	trans	-67.9	-39.4	176.2	-170.8	146.9	0	0	0	112.1	S614 F615 R616 N621 L622	S614-L618 VanDerWaalsContact O-CB 3.32Å; S614-L618 WeakPolarHBondContact O-CB 3.43Å; S614-L618 PolarHBondContact O-N 2.76Å; F615-L618 PolarHBondContact O-N 3.2Å; R616-L618 PolarHBondContact O-N 3.01Å; L618-N621 PolarHBondContact O-N 3.43Å; L618-L622 VanDerWaalsContact O-CB 3.3Å; L618-L622 WeakPolarHBondContact O-CB 3.35Å; L618-L622 PolarHBondContact O-N 3.23Å
619	L	66.7	Low	64.6	Low	15 Å²	15	83.3 Å²	83.3	8%	0.079	44%	0.444	C	S	.	.	H	α-helix	trans	-64	-43.3	175.4	-160.9	92.4	0	0	0	111.2	V574 Q577 F615 R616 L622 L623	V574-L619 HydrophobicContact CG2-CD1 4.41Å; V574-L619 HydrophobicContact CG2-CD2 4.15Å; Q577-L619 HydrophobicContact CB-CD2 3.84Å; Q577-L619 HydrophobicContact CG-CD2 4.26Å; F615-L619 HydrophobicContact CZ-CD1 4.01Å; F615-L619 WeakPolarHBondContact O-CB 3.42Å; F615-L619 PolarHBondContact O-N 3.39Å; R616-L619 PolarHBondContact O-N 2.03Å; L619-L622 PolarHBondContact O-N 3Å; L619-L623 HydrophobicContact CD2-CD1 3.82Å; L619-L623 HydrophobicContact CG-CD1 3.78Å; L619-L623 HydrophobicContact CG-CG 4.31Å; L619-L623 WeakPolarHBondContact O-CB 3.34Å; L619-L623 WeakPolarHBondContact O-CG 3.31Å; L619-L623 PolarHBondContact O-N 2.97Å
620	I	62.1	Low	64.7	Low	45 Å²	45	79.2 Å²	79.2	23%	0.231	43%	0.431	C	S	.	.	H	α-helix	trans	-58.6	-51.5	173.4	-69.9	163.3	0	0	0	109.8	R616 E617 L622 T624	R616-I620 VanDerWaalsContact O-CG1 3.29Å; R616-I620 WeakPolarHBondContact O-CG1 3.23Å; R616-I620 PolarHBondContact O-N 2.77Å; E617-I620 PolarHBondContact O-N 3.22Å; I620-L622 VanDerWaalsContact C-N 3.29Å; I620-L622 PolarHBondContact O-N 3.34Å; I620-T624 VanDerWaalsContact O-CB 3.28Å; I620-T624 WeakPolarHBondContact O-CB 2.97Å; I620-T624 WeakPolarHBondContact O-CG2 3.49Å; I620-T624 PolarHBondContact O-N 3.47Å; I620-T624 PolarHBondContact O-OG1 3.16Å
621	N	62.7	Low	65	Low	82 Å²	82	78 Å²	78	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-60.7	-37.6	-179.2	-79.6	-49.7	0	0	0	112.8	E617 L618 G625 G626	E617-N621 WeakPolarHBondContact O-CB 3.36Å; E617-N621 PolarHBondContact O-N 3.31Å; E617-N621 PolarHBondContact O-ND2 2.95Å; L618-N621 PolarHBondContact O-N 3.43Å; N621-G625 VanDerWaalsContact O-CA 3.31Å; N621-G625 WeakPolarHBondContact O-CA 3.15Å; N621-G625 PolarHBondContact O-N 3.34Å; N621-G626 PolarHBondContact O-N 3.33Å; N621-G626 VanDerWaalsContact O-N 3.16Å
622	L	65.3	Low	65.5	Low	135 Å²	135	79.8 Å²	79.8	71%	0.707	42%	0.424	S	S	*	.	H	α-helix	trans	-77.5	-46	-178.7	-174.7	66.3	0	0	0	113.4	L618 L619 I620	L618-L622 VanDerWaalsContact O-CB 3.3Å; L618-L622 WeakPolarHBondContact O-CB 3.35Å; L618-L622 PolarHBondContact O-N 3.23Å; L619-L622 PolarHBondContact O-N 3Å; I620-L622 VanDerWaalsContact C-N 3.29Å; I620-L622 PolarHBondContact O-N 3.34Å
623	L	62.3	Low	66	Low	69 Å²	69	82 Å²	82	36%	0.361	43%	0.433	S	S	.	.	H	α-helix	trans	-71.7	-35.5	-179.3	-72	174.8	0	0	0	112.2	L578 L619	L578-L623 HydrophobicContact CD2-CD1 3.8Å; L578-L623 HydrophobicContact CD2-CD2 4.12Å; L578-L623 HydrophobicContact CG-CD1 4.36Å; L619-L623 HydrophobicContact CD2-CD1 3.82Å; L619-L623 HydrophobicContact CG-CD1 3.78Å; L619-L623 HydrophobicContact CG-CG 4.31Å; L619-L623 WeakPolarHBondContact O-CB 3.34Å; L619-L623 WeakPolarHBondContact O-CG 3.31Å; L619-L623 PolarHBondContact O-N 2.97Å
624	T	57.4	Low	66.6	Low	46 Å²	46	81.5 Å²	81.5	28%	0.282	43%	0.433	S	S	.	.	H	α-helix	trans	-100.2	-12	-173.9	77.9	0	0	0	0	112.4	I620 T627	I620-T624 VanDerWaalsContact O-CB 3.28Å; I620-T624 WeakPolarHBondContact O-CB 2.97Å; I620-T624 WeakPolarHBondContact O-CG2 3.49Å; I620-T624 PolarHBondContact O-N 3.47Å; I620-T624 PolarHBondContact O-OG1 3.16Å; T624-T627 WeakPolarHBondContact CB-OG1 3.17Å; T624-T627 WeakPolarHBondContact O-CB 3.24Å; T624-T627 WeakPolarHBondContact O-CG2 3.28Å; T624-T627 PolarHBondContact O-OG1 2.85Å; T624-T627 PolarHBondContact OG1-OG1 2.7Å
625	G	55.8	Low	67.3	Low	64 Å²	64	83.2 Å²	83.2	66%	0.66	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	39.9	173.5	0	0	0	0	0	113.9	N621	N621-G625 VanDerWaalsContact O-CA 3.31Å; N621-G625 WeakPolarHBondContact O-CA 3.15Å; N621-G625 PolarHBondContact O-N 3.34Å
626	G	56	Low	67.9	Low	47 Å²	47	86.5 Å²	86.5	49%	0.485	44%	0.443	S	S	.	.	S	Bend	trans	76	22.5	-176.3	0	0	0	0	0	114.4	N621	N621-G626 PolarHBondContact O-N 3.33Å; N621-G626 VanDerWaalsContact O-N 3.16Å
627	T	57.2	Low	68.8	Low	53 Å²	53	87.5 Å²	87.5	33%	0.325	45%	0.451	S	S	.	.			trans	-98.6	24.3	-173.3	62.4	0	0	0	0	114.2	T624 E629 V630 Y631	T624-T627 WeakPolarHBondContact CB-OG1 3.17Å; T624-T627 WeakPolarHBondContact O-CB 3.24Å; T624-T627 WeakPolarHBondContact O-CG2 3.28Å; T624-T627 PolarHBondContact O-OG1 2.85Å; T624-T627 PolarHBondContact OG1-OG1 2.7Å; T627-E629 PolarHBondContact O-N 2.94Å; T627-V630 HydrophobicContact CG2-CB 4.44Å; T627-V630 HydrophobicContact CG2-CG2 3.83Å; T627-V630 WeakPolarHBondContact O-CA 3.31Å; T627-V630 WeakPolarHBondContact O-CB 3.41Å; T627-V630 PolarHBondContact O-N 2.96Å; T627-Y631 PolarHBondContact O-N 3.4Å
628	E	63.9	Low	69.8	Low	89 Å²	89	88.5 Å²	88.5	42%	0.416	46%	0.456	S	S	.	.	H	α-helix	trans	-56.7	-38.5	171.1	-160.9	-156	168.9	0	0	111.2	V630 Y631 K632	E628-V630 VanDerWaalsContact C-N 3.34Å; E628-V630 PolarHBondContact O-N 3.22Å; E628-Y631 PolarHBondContact O-N 2.91Å; E628-K632 WeakPolarHBondContact O-CB 3.3Å; E628-K632 VanDerWaalsContact O-CG 3.31Å; E628-K632 WeakPolarHBondContact O-CG 3.46Å; E628-K632 PolarHBondContact O-N 3.04Å; E628-K632 WeakPolarHBondContact OE1-CE 3.13Å; E628-K632 IonicContact OE1-NZ 2.88Å; E628-K632 PolarHBondContact OE1-NZ 2.71Å; E628-K632 IonicContact OE2-NZ 3.69Å; E628-K632 PolarHBondContact OE2-NZ 2.7Å
629	E	66	Low	70.7	Confident	160 Å²	160	88 Å²	88	75%	0.748	45%	0.45	S	S	*	.	H	α-helix	trans	-62.8	-38.1	172.4	-62.1	-170.3	158.5	0	0	112.4	T627 K632 E633	T627-E629 PolarHBondContact O-N 2.94Å; E629-K632 PolarHBondContact O-N 2.91Å; E629-E633 VanDerWaalsContact O-CB 3.31Å; E629-E633 WeakPolarHBondContact O-CB 3.36Å; E629-E633 PolarHBondContact O-N 3.18Å
630	V	70.1	Confident	71.7	Confident	85 Å²	85	89.3 Å²	89.3	52%	0.515	46%	0.457	S	S	.	.	H	α-helix	trans	-70.3	-39.6	177.9	-171.1	0	0	0	0	110.7	T627 E628 E633 Q634	T627-V630 HydrophobicContact CG2-CB 4.44Å; T627-V630 HydrophobicContact CG2-CG2 3.83Å; T627-V630 WeakPolarHBondContact O-CA 3.31Å; T627-V630 WeakPolarHBondContact O-CB 3.41Å; T627-V630 PolarHBondContact O-N 2.96Å; E628-V630 VanDerWaalsContact C-N 3.34Å; E628-V630 PolarHBondContact O-N 3.22Å; V630-E633 PolarHBondContact O-N 2.94Å; V630-Q634 VanDerWaalsContact O-CB 3.26Å; V630-Q634 WeakPolarHBondContact O-CB 3.22Å; V630-Q634 PolarHBondContact O-N 3.32Å
631	Y	73.6	Confident	72.9	Confident	130 Å²	130	92.1 Å²	92.1	51%	0.51	47%	0.47	S	S	.	.	H	α-helix	trans	-65.2	-43.5	175.1	-178.8	-95.9	0	0	0	111.5	T627 E628 E633 Q634 K635	T627-Y631 PolarHBondContact O-N 3.4Å; E628-Y631 PolarHBondContact O-N 2.91Å; Y631-E633 VanDerWaalsContact C-N 3.35Å; Y631-E633 PolarHBondContact O-N 2.81Å; Y631-Q634 PolarHBondContact O-N 2.94Å; Y631-K635 WeakPolarHBondContact O-CB 3.33Å; Y631-K635 PolarHBondContact O-N 3.46Å
632	K	78.2	Confident	74.2	Confident	114 Å²	114	92.6 Å²	92.6	50%	0.496	47%	0.472	S	S	.	.	H	α-helix	trans	-59.1	-44.7	173.2	-74.2	170.1	-177.2	166.1	0	111.4	E628 E629 R636	E628-K632 WeakPolarHBondContact O-CB 3.3Å; E628-K632 VanDerWaalsContact O-CG 3.31Å; E628-K632 WeakPolarHBondContact O-CG 3.46Å; E628-K632 PolarHBondContact O-N 3.04Å; E628-K632 WeakPolarHBondContact OE1-CE 3.13Å; E628-K632 IonicContact OE1-NZ 2.88Å; E628-K632 PolarHBondContact OE1-NZ 2.71Å; E628-K632 IonicContact OE2-NZ 3.69Å; E628-K632 PolarHBondContact OE2-NZ 2.7Å; E629-K632 PolarHBondContact O-N 2.91Å; K632-R636 VanDerWaalsContact O-CB 3.29Å; K632-R636 WeakPolarHBondContact O-CB 3.41Å; K632-R636 PolarHBondContact O-N 3.48Å
633	E	81.3	Confident	75.3	Confident	69 Å²	69	88 Å²	88	32%	0.322	45%	0.448	S	S	.	.	H	α-helix	trans	-69.3	-37.9	177.9	-176.5	57.8	-155.6	0	0	112.5	E629 V630 Y631 R636 Q637	E629-E633 VanDerWaalsContact O-CB 3.31Å; E629-E633 WeakPolarHBondContact O-CB 3.36Å; E629-E633 PolarHBondContact O-N 3.18Å; V630-E633 PolarHBondContact O-N 2.94Å; Y631-E633 VanDerWaalsContact C-N 3.35Å; Y631-E633 PolarHBondContact O-N 2.81Å; E633-R636 PolarHBondContact O-N 3.23Å; E633-R636 IonicContact OE1-NH1 2.88Å; E633-R636 WeakPolarHBondContact OE2-CD 3.48Å; E633-R636 IonicContact OE2-CZ 2.8Å; E633-R636 IonicContact OE2-NE 3.32Å; E633-R636 IonicContact OE2-NH1 3.77Å; E633-R636 PolarHBondContact OE2-NH1 2.82Å; E633-Q637 WeakPolarHBondContact O-CB 3.43Å; E633-Q637 VanDerWaalsContact O-CG 3.32Å; E633-Q637 WeakPolarHBondContact O-CG 3.41Å; E633-Q637 PolarHBondContact O-N 2.9Å; E633-Q637 PolarHBondContact OE1-NE2 3.05Å
634	Q	78.7	Confident	76.4	Confident	122 Å²	122	88.7 Å²	88.7	57%	0.57	45%	0.447	S	S	*	.	H	α-helix	trans	-64.4	-45.5	174.7	-177.8	178.9	-10	0	0	111.4	V630 Y631 Q637 Q638	V630-Q634 VanDerWaalsContact O-CB 3.26Å; V630-Q634 WeakPolarHBondContact O-CB 3.22Å; V630-Q634 PolarHBondContact O-N 3.32Å; Y631-Q634 PolarHBondContact O-N 2.94Å; Q634-Q637 PolarHBondContact O-N 3.38Å; Q634-Q638 PolarHBondContact O-N 2.93Å
635	K	83.7	Confident	77.8	Confident	106 Å²	106	92.5 Å²	92.5	46%	0.461	46%	0.456	S	S	.	.	H	α-helix	trans	-59.9	-46.1	174.4	178.1	174.4	171.3	177.3	0	111	Y631 Q637 Q638 E639	Y631-K635 WeakPolarHBondContact O-CB 3.33Å; Y631-K635 PolarHBondContact O-N 3.46Å; K635-Q637 VanDerWaalsContact C-N 3.34Å; K635-Q637 PolarHBondContact O-N 3.37Å; K635-Q638 WeakPolarHBondContact O-CB 3.35Å; K635-Q638 PolarHBondContact O-N 3.5Å; K635-E639 WeakPolarHBondContact CE-OE1 3.33Å; K635-E639 IonicContact NZ-OE1 2.74Å; K635-E639 WeakPolarHBondContact O-CG 3.47Å; K635-E639 PolarHBondContact O-N 2.86Å
636	R	84.6	Confident	79	Confident	99 Å²	99	93.1 Å²	93.1	37%	0.374	44%	0.441	S	S	.	.	H	α-helix	trans	-58.9	-41.9	175.3	177.4	-174.1	170.7	-144.9	-3	112.3	K632 E633 E639 L640	K632-R636 VanDerWaalsContact O-CB 3.29Å; K632-R636 WeakPolarHBondContact O-CB 3.41Å; K632-R636 PolarHBondContact O-N 3.48Å; E633-R636 PolarHBondContact O-N 3.23Å; E633-R636 IonicContact OE1-NH1 2.88Å; E633-R636 WeakPolarHBondContact OE2-CD 3.48Å; E633-R636 IonicContact OE2-CZ 2.8Å; E633-R636 IonicContact OE2-NE 3.32Å; E633-R636 IonicContact OE2-NH1 3.77Å; E633-R636 PolarHBondContact OE2-NH1 2.82Å; R636-E639 PolarHBondContact O-N 3.48Å; R636-L640 HydrophobicContact CG-CD1 4.26Å; R636-L640 VanDerWaalsContact O-CG 3.26Å; R636-L640 WeakPolarHBondContact O-CG 3.33Å; R636-L640 PolarHBondContact O-N 2.82Å
637	Q	85.1	Confident	80.2	Confident	105 Å²	105	92.1 Å²	92.1	49%	0.491	43%	0.425	S	S	.	.	H	α-helix	trans	-65.1	-40.4	175.8	-75	175.2	18	0	0	111.8	E633 Q634 K635 L640 E641	E633-Q637 WeakPolarHBondContact O-CB 3.43Å; E633-Q637 VanDerWaalsContact O-CG 3.32Å; E633-Q637 WeakPolarHBondContact O-CG 3.41Å; E633-Q637 PolarHBondContact O-N 2.9Å; E633-Q637 PolarHBondContact OE1-NE2 3.05Å; Q634-Q637 PolarHBondContact O-N 3.38Å; K635-Q637 VanDerWaalsContact C-N 3.34Å; K635-Q637 PolarHBondContact O-N 3.37Å; Q637-L640 PolarHBondContact O-N 3.47Å; Q637-E641 PolarHBondContact O-N 3.19Å
638	Q	86.9	Confident	81	Confident	120 Å²	120	92.3 Å²	92.3	56%	0.561	42%	0.42	S	S	*	.	H	α-helix	trans	-63.6	-41.9	175	-170.2	177.6	7	0	0	112.1	Q634 K635 E641 N642	Q634-Q638 PolarHBondContact O-N 2.93Å; K635-Q638 WeakPolarHBondContact O-CB 3.35Å; K635-Q638 PolarHBondContact O-N 3.5Å; Q638-E641 PolarHBondContact O-N 2.98Å; Q638-N642 WeakPolarHBondContact O-CB 3.3Å; Q638-N642 PolarHBondContact O-N 3.44Å; Q638-N642 PolarHBondContact O-ND2 3.29Å
639	E	88.3	Confident	81.1	Confident	92 Å²	92	91.5 Å²	91.5	43%	0.43	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-43.5	173.6	-72.6	169.5	-178.6	0	0	111.8	K635 R636 N642 N643	K635-E639 WeakPolarHBondContact CE-OE1 3.33Å; K635-E639 IonicContact NZ-OE1 2.74Å; K635-E639 WeakPolarHBondContact O-CG 3.47Å; K635-E639 PolarHBondContact O-N 2.86Å; R636-E639 PolarHBondContact O-N 3.48Å; E639-N642 PolarHBondContact O-N 2.78Å; E639-N643 WeakPolarHBondContact O-CB 3.25Å; E639-N643 VanDerWaalsContact O-CG 3.24Å; E639-N643 PolarHBondContact O-N 3.31Å
640	L	87.3	Confident	80.8	Confident	43 Å²	43	89.3 Å²	89.3	23%	0.225	43%	0.425	C	S	.	.	H	α-helix	trans	-64.3	-39.6	175.5	-70.6	170.8	0	0	0	112.6	I47 R636 Q637 Y644	I47-L640 HydrophobicContact CB-CD2 4.05Å; I47-L640 HydrophobicContact CG1-CD2 4.23Å; R636-L640 HydrophobicContact CG-CD1 4.26Å; R636-L640 VanDerWaalsContact O-CG 3.26Å; R636-L640 WeakPolarHBondContact O-CG 3.33Å; R636-L640 PolarHBondContact O-N 2.82Å; Q637-L640 PolarHBondContact O-N 3.47Å; L640-Y644 VanDerWaalsContact O-CB 3.24Å; L640-Y644 WeakPolarHBondContact O-CB 3.38Å; L640-Y644 PolarHBondContact O-N 3.17Å
641	E	87.2	Confident	79.5	Confident	105 Å²	105	89 Å²	89	49%	0.491	43%	0.427	S	S	.	.	H	α-helix	trans	-64.8	-44.3	173.9	-84.7	-154.8	-151.3	0	0	112.3	Q637 Q638 Y644 R645	Q637-E641 PolarHBondContact O-N 3.19Å; Q638-E641 PolarHBondContact O-N 2.98Å; E641-Y644 PolarHBondContact O-N 3.1Å; E641-R645 WeakPolarHBondContact O-CB 3.19Å; E641-R645 WeakPolarHBondContact O-CG 3.46Å; E641-R645 PolarHBondContact O-N 3.01Å; E641-R645 IonicContact OE2-CZ 2.98Å; E641-R645 IonicContact OE2-NE 3.56Å; E641-R645 PolarHBondContact OE2-NE 2.93Å; E641-R645 IonicContact OE2-NH2 3.15Å; E641-R645 PolarHBondContact OE2-NH2 3.44Å
642	N	88.5	Confident	78.2	Confident	91 Å²	91	90.2 Å²	90.2	49%	0.487	44%	0.437	S	S	.	.	H	α-helix	trans	-60.8	-47.9	177.5	-71.5	-18.1	0	0	0	110.6	Q638 E639 Y644 R645 F646	Q638-N642 WeakPolarHBondContact O-CB 3.3Å; Q638-N642 PolarHBondContact O-N 3.44Å; Q638-N642 PolarHBondContact O-ND2 3.29Å; E639-N642 PolarHBondContact O-N 2.78Å; N642-Y644 PolarHBondContact O-N 2.82Å; N642-R645 PolarHBondContact O-N 2.9Å; N642-F646 PolarHBondContact O-N 3.25Å; N642-F646 VanDerWaalsContact O-N 3.1Å
643	N	88.9	Confident	76.5	Confident	39 Å²	39	92.7 Å²	92.7	21%	0.209	45%	0.451	C	S	.	.	H	α-helix	trans	-65.2	-38.6	177.6	-66.8	-11.6	0	0	0	111.7	I47 Y73 E639 R645 F646	I47-N643 HydrophobicContact CB-CB 4.18Å; I47-N643 HydrophobicContact CG2-CB 3.81Å; I47-N643 PolarHBondContact O-ND2 3.45Å; Y73-N643 PolarHBondContact OH-O 3.33Å; E639-N643 WeakPolarHBondContact O-CB 3.25Å; E639-N643 VanDerWaalsContact O-CG 3.24Å; E639-N643 PolarHBondContact O-N 3.31Å; N643-R645 PolarHBondContact O-N 2.97Å; N643-F646 WeakPolarHBondContact O-CB 3.4Å; N643-F646 PolarHBondContact O-N 3.17Å
644	Y	86.6	Confident	74.6	Confident	84 Å²	84	95.9 Å²	95.9	33%	0.329	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-35.2	174.9	178.9	-94.3	0	0	0	113.4	I47 N67 K68 Y69 L640 E641 N642 F646	I47-Y644 HydrophobicContact CD1-CD2 4Å; I47-Y644 HydrophobicContact CD1-CG 4.45Å; N67-Y644 HydrophobicContact CB-CD2 4.04Å; N67-Y644 HydrophobicContact CB-CE1 4.43Å; N67-Y644 HydrophobicContact CB-CE2 3.5Å; N67-Y644 VanDerWaalsContact CB-CE2 3.5Å; N67-Y644 PolarHBondContact ND2-O 3.48Å; K68-Y644 HydrophobicContact CD-CE1 4.2Å; K68-Y644 HydrophobicContact CG-CE1 4.07Å; K68-Y644 PolarHBondContact N-OH 3.48Å; K68-Y644 VanDerWaalsContact N-OH 3.13Å; Y69-Y644 HydrophobicContact CE2-CD1 4.49Å; Y69-Y644 HydrophobicContact CE2-CE1 4.29Å; L640-Y644 VanDerWaalsContact O-CB 3.24Å; L640-Y644 WeakPolarHBondContact O-CB 3.38Å; L640-Y644 PolarHBondContact O-N 3.17Å; E641-Y644 PolarHBondContact O-N 3.1Å; N642-Y644 PolarHBondContact O-N 2.82Å; Y644-F646 VanDerWaalsContact C-N 3.32Å
645	R	86.2	Confident	72.7	Confident	125 Å²	125	93.4 Å²	93.4	47%	0.472	46%	0.459	S	S	.	.	H	α-helix	trans	-77.7	-15.6	177.9	-71.8	170.8	-172.1	-111.3	8.2	113.2	Y69 E641 N642 N643	Y69-R645 HydrophobicContact CE2-CB 4.33Å; Y69-R645 HydrophobicContact CE2-CG 4.14Å; E641-R645 WeakPolarHBondContact O-CB 3.19Å; E641-R645 WeakPolarHBondContact O-CG 3.46Å; E641-R645 PolarHBondContact O-N 3.01Å; E641-R645 IonicContact OE2-CZ 2.98Å; E641-R645 IonicContact OE2-NE 3.56Å; E641-R645 PolarHBondContact OE2-NE 2.93Å; E641-R645 IonicContact OE2-NH2 3.15Å; E641-R645 PolarHBondContact OE2-NH2 3.44Å; N642-R645 PolarHBondContact O-N 2.9Å; N643-R645 PolarHBondContact O-N 2.97Å
646	F	81.3	Confident	70.6	Confident	78 Å²	78	96 Å²	96	34%	0.342	47%	0.473	S	S	.	.			trans	-66.6	135.2	179	-169.9	-112.6	0	0	0	111.7	Y73 N642 N643 Y644 W648	Y73-F646 PolarHBondContact OH-O 3.31Å; N642-F646 PolarHBondContact O-N 3.25Å; N642-F646 VanDerWaalsContact O-N 3.1Å; N643-F646 WeakPolarHBondContact O-CB 3.4Å; N643-F646 PolarHBondContact O-N 3.17Å; Y644-F646 VanDerWaalsContact C-N 3.32Å; F646-W648 AromaticContact CE1-CE3 3.73Å; F646-W648 HydrophobicContact CE1-CE3 3.73Å; F646-W648 HydrophobicContact CE1-CZ3 4.29Å; F646-W648 AromaticContact CZ-CE3 3.6Å; F646-W648 HydrophobicContact CZ-CE3 3.6Å; F646-W648 AromaticContact CZ-CZ3 3.85Å; F646-W648 HydrophobicContact CZ-CZ3 3.85Å
647	V	80.6	Confident	68.2	Low	25 Å²	25	95.5 Å²	95.5	15%	0.152	48%	0.484	C	S	.	.			trans	-134.9	126.7	179.3	-177.8	0	0	0	0	107.8	Y69 G649 E650	Y69-V647 VanDerWaalsContact CB-CG2 3.45Å; Y69-V647 HydrophobicContact CG-CG2 3.98Å; V647-G649 PolarHBondContact O-N 3.13Å; V647-E650 HydrophobicContact CG1-CB 4.41Å; V647-E650 HydrophobicContact CG1-CG 4.31Å
648	W	73.6	Confident	65.8	Low	57 Å²	57	95 Å²	95	22%	0.216	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	117.9	-178.6	-168.6	-98.8	0	0	0	111.9	L251 Q255 Y259 F646	L251-W648 HydrophobicContact CD1-CD2 3.95Å; L251-W648 HydrophobicContact CD1-CG 3.89Å; L251-W648 HydrophobicContact CD2-CB 3.54Å; L251-W648 HydrophobicContact CD2-CG 3.68Å; L251-W648 HydrophobicContact CG-CG 4.47Å; Q255-W648 PolarHBondContact O-NE1 3.49Å; Y259-W648 AromaticContact CD2-CH2 3.76Å; Y259-W648 HydrophobicContact CD2-CH2 3.76Å; Y259-W648 AromaticContact CD2-CZ3 3.81Å; Y259-W648 HydrophobicContact CD2-CZ3 3.81Å; Y259-W648 HydrophobicContact CG-CH2 4.2Å; F646-W648 AromaticContact CE1-CE3 3.73Å; F646-W648 HydrophobicContact CE1-CE3 3.73Å; F646-W648 HydrophobicContact CE1-CZ3 4.29Å; F646-W648 AromaticContact CZ-CE3 3.6Å; F646-W648 HydrophobicContact CZ-CE3 3.6Å; F646-W648 AromaticContact CZ-CZ3 3.85Å; F646-W648 HydrophobicContact CZ-CZ3 3.85Å
649	G	65.7	Low	63.2	Low	73 Å²	73	93.6 Å²	93.6	75%	0.753	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-0.1	173	0	0	0	0	0	116.1	V647	V647-G649 PolarHBondContact O-N 3.13Å
650	E	59.6	Low	60.7	Low	113 Å²	113	95.4 Å²	95.4	53%	0.528	51%	0.513	S	S	.	.	S	Bend	trans	-90.3	131.5	162	-77.7	178.8	170	0	0	109.3	V647	V647-E650 HydrophobicContact CG1-CB 4.41Å; V647-E650 HydrophobicContact CG1-CG 4.31Å
651	S	44.5	Very low	58.4	Low	78 Å²	78	98 Å²	98	55%	0.545	54%	0.535	S	S	.	.			trans	-65.6	131.7	172.1	38.9	0	0	0	0	110.1	E653 E654	S651-E653 PolarHBondContact O-N 3.05Å; S651-E654 PolarHBondContact O-N 3.12Å
652	Q	46.3	Very low	55.7	Low	156 Å²	156	100 Å²	100	73%	0.729	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-8.3	-174.5	-75.4	-177.5	-23.2	0	0	115.2	E654 T655	Q652-E654 VanDerWaalsContact C-N 3.33Å; Q652-E654 PolarHBondContact O-N 3.32Å; Q652-T655 PolarHBondContact O-OG1 2.98Å
653	E	41.8	Very low	53.2	Low	167 Å²	167	100.9 Å²	100.9	78%	0.78	56%	0.563	S	S	*	*	H	α-helix	trans	-64.8	-29.7	176.6	-60.7	-176	150.7	0	0	113.5	S651	S651-E653 PolarHBondContact O-N 3.05Å
654	E	40.5	Very low	50.6	Low	136 Å²	136	106.1 Å²	106.1	64%	0.636	59%	0.59	S	S	*	*	H	α-helix	trans	-83.8	-16.3	-178.2	-67.2	-161	152.5	0	0	114.1	S651 Q652 S657	S651-E654 PolarHBondContact O-N 3.12Å; Q652-E654 VanDerWaalsContact C-N 3.33Å; Q652-E654 PolarHBondContact O-N 3.32Å; E654-S657 PolarHBondContact O-OG 3.48Å
655	T	40	Very low	48.4	Very low	70 Å²	70	109.5 Å²	109.5	43%	0.429	61%	0.614	S	S	.	*	H	α-helix	trans	-84	-14.9	-178.1	16	0	0	0	0	114.5	Q652	Q652-T655 PolarHBondContact O-OG1 2.98Å
656	Q	38.8	Very low	46	Very low	160 Å²	160	110 Å²	110	75%	0.748	63%	0.631	S	S	*	*	H	α-helix	trans	-85.7	-31.1	173	-70.5	-171.1	-7.8	0	0	112.8	S658 S659	Q656-S658 VanDerWaalsContact C-N 3.32Å; Q656-S658 PolarHBondContact O-N 3.49Å; Q656-S659 PolarHBondContact O-N 3.47Å; Q656-S659 PolarHBondContact O-OG 3.38Å
657	S	34.2	Very low	43.6	Very low	89 Å²	89	113.4 Å²	113.4	62%	0.622	65%	0.653	S	S	*	*	H	α-helix	trans	-75.3	-14.8	-174.8	63.8	0	0	0	0	114.6	E654	E654-S657 PolarHBondContact O-OG 3.48Å
658	S	34.3	Very low	41.3	Very low	93 Å²	93	123.7 Å²	123.7	65%	0.65	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	10.5	176.6	88.7	0	0	0	0	114.4	Q656	Q656-S658 VanDerWaalsContact C-N 3.32Å; Q656-S658 PolarHBondContact O-N 3.49Å
659	S	34	Very low	39.7	Very low	92 Å²	92	127.1 Å²	127.1	64%	0.643	73%	0.729	S	S	*	*	S	Bend	trans	-90.5	-3.5	-177	65.2	0	0	0	0	114.5	Q656	Q656-S659 PolarHBondContact O-N 3.47Å; Q656-S659 PolarHBondContact O-OG 3.38Å
660	T	35.7	Very low	38.3	Very low	129 Å²	129	129.9 Å²	129.9	79%	0.791	73%	0.728	S	S	*	*	S	Bend	trans	-125	49.7	-176.7	62.8	0	0	0	0	113.3
661	S	37.5	Very low	37.1	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	74%	0.739	S	S	*	*			trans	-154.5	145.7	155.7	-167.4	0	0	0	0	109.9
662	D	30.2	Very low	36.7	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	75%	0.75	S	S	*	*			trans	97	56.4	169.8	-54	8.9	0	0	0	115.4
663	S	37.2	Very low	36.1	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	75%	0.752	S	S	*	*				-71.9	122	129.1	164.4	0	0	0	0	107.9
664	D	35.2	Very low	35.7	Very low	148 Å²	148	130.3 Å²	130.3	79%	0.791	75%	0.75	S	S	*	*			trans	-167.6	151.7	141.8	-97.5	-14.8	0	0	0	111
665	D	39	Very low	35.4	Very low	155 Å²	155	129.9 Å²	129.9	83%	0.829	76%	0.758	S	S	*	*			trans	-59.8	144.5	-172.8	-64.8	-70.3	0	0	0	115
666	V	35.6	Very low	35	Very low	135 Å²	135	134.5 Å²	134.5	82%	0.818	78%	0.783	S	S	*	*			trans	-138.3	102	151.3	-174.4	0	0	0	0	110.3
667	D	31.8	Very low	34.7	Very low	151 Å²	151	132.3 Å²	132.3	81%	0.807	79%	0.786	S	S	*	*			trans	-57.6	137.1	159.8	-79.1	-55.1	0	0	0	111.2
668	I	32.2	Very low	34.8	Very low	241 Å²	241	136.3 Å²	136.3	100%	1.236	80%	0.801	S	S	*	*			trans	-162.1	0	145.2	-102.6	156	0	0	0	110.4

Retrieved 668 of 668 residues in 948.8 ms (Link to these results)

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