A0A087X680_POEFO Loading...

Guanine nucleotide-binding protein G(o) subunit alpha

Guanine nucleotide-binding proteins (G proteins) function as transducers downstream of G protein-coupled receptors (GPCRs) in numerous signaling cascades. The alpha chain contains the guanine nucleotide binding site and alternates between an active, GTP-bound state and an inactive, GDP-bound state. Signaling by an activated GPCR promotes GDP release and GTP binding. The alpha subunit has a low GTPase activity that converts bound GTP to GDP, thereby terminating the signal. Both GDP release and GTP hydrolysis are modulated by numerous regulatory proteins. Signaling is mediated via effector proteins, such as adenylate cyclase. Inhibits adenylate cyclase activity, leading to decreased intracellular cAMP levels.

AlphaFold DB , UniProt , Accession A0A087X680, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 354 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	71.2	Confident	255 Å²	255	120.3 Å²	120.3	100%	1.256	69%	0.694	S	S	*	*				0	110.9	0	-79.3	-170.1	-83.5	0	0	107.7
2	G	51.3	Low	72.5	Confident	73 Å²	73	114.1 Å²	114.1	75%	0.753	67%	0.668	S	S	*	*			trans	168.5	71	-177.8	0	0	0	0	0	112.2
3	C	52.8	Low	73.7	Confident	138 Å²	138	111.6 Å²	111.6	93%	0.932	65%	0.65	S	S	*	*			trans	-95	93.3	164.1	-92.8	0	0	0	0	107.5
4	T	64.2	Low	74.9	Confident	133 Å²	133	110.1 Å²	110.1	82%	0.816	64%	0.638	S	S	*	*			trans	-85.9	114.3	167.3	48.2	0	0	0	0	107.9
5	L	70.9	Confident	76	Confident	107 Å²	107	113.5 Å²	113.5	56%	0.56	64%	0.636	S	S	*	*			trans	-50.8	137.6	172.3	-76.6	151.5	0	0	0	110.4	E9	L5-E9 HydrophobicContact CB-CB 4.44Å; L5-E9 HydrophobicContact CD2-CB 3.85Å
6	S	80.2	Confident	76.9	Confident	51 Å²	51	110.1 Å²	110.1	36%	0.357	62%	0.622	S	S	.	*			trans	-62.9	157.4	173.8	67.5	0	0	0	0	111.1	E8 E9 R10	S6-E8 PolarHBondContact O-N 3.35Å; S6-E9 WeakPolarHBondContact CB-OE2 3.34Å; S6-E9 PolarHBondContact N-OE2 2.96Å; S6-E9 PolarHBondContact O-N 2.99Å; S6-E9 WeakPolarHBondContact OG-CB 3.4Å; S6-E9 VanDerWaalsContact OG-CD 3.25Å; S6-E9 WeakPolarHBondContact OG-CG 3.37Å; S6-E9 PolarHBondContact OG-N 3.47Å; S6-E9 PolarHBondContact OG-OE2 3.45Å; S6-R10 PolarHBondContact O-N 3.19Å
7	A	80.1	Confident	77.8	Confident	89 Å²	89	110.8 Å²	110.8	74%	0.736	62%	0.617	S	S	*	*	H	α-helix	trans	-59.6	-34.1	179.3	0	0	0	0	0	112.3	A11	A7-A11 WeakPolarHBondContact O-CB 3.02Å; A7-A11 PolarHBondContact O-N 2.73Å
8	E	82.8	Confident	78.6	Confident	161 Å²	161	107.4 Å²	107.4	75%	0.752	61%	0.605	S	S	*	*	H	α-helix	trans	-69.5	-43.1	175.4	-74.3	-175	153.5	0	0	112.4	S6 R10 A11 A12	S6-E8 PolarHBondContact O-N 3.35Å; E8-R10 VanDerWaalsContact C-N 3.3Å; E8-R10 PolarHBondContact O-N 3.27Å; E8-A11 PolarHBondContact O-N 2.96Å; E8-A12 VanDerWaalsContact O-CB 3.32Å; E8-A12 WeakPolarHBondContact O-CB 3.49Å; E8-A12 PolarHBondContact O-N 3.23Å
9	E	83.5	Confident	79.2	Confident	103 Å²	103	107.1 Å²	107.1	48%	0.481	60%	0.6	S	S	.	*	H	α-helix	trans	-63.6	-38.5	175.8	-73	165.9	135.8	0	0	111.3	L5 S6 A12 L13	L5-E9 HydrophobicContact CB-CB 4.44Å; L5-E9 HydrophobicContact CD2-CB 3.85Å; S6-E9 WeakPolarHBondContact CB-OE2 3.34Å; S6-E9 PolarHBondContact N-OE2 2.96Å; S6-E9 PolarHBondContact O-N 2.99Å; S6-E9 WeakPolarHBondContact OG-CB 3.4Å; S6-E9 VanDerWaalsContact OG-CD 3.25Å; S6-E9 WeakPolarHBondContact OG-CG 3.37Å; S6-E9 PolarHBondContact OG-N 3.47Å; S6-E9 PolarHBondContact OG-OE2 3.45Å; E9-A12 PolarHBondContact O-N 3.34Å; E9-L13 WeakPolarHBondContact O-CB 3.39Å; E9-L13 PolarHBondContact O-N 2.96Å
10	R	83.6	Confident	79.7	Confident	171 Å²	171	108 Å²	108	65%	0.645	60%	0.6	S	S	*	*	H	α-helix	trans	-66.5	-44.7	176.2	-161.3	170.7	-174.3	170.5	1.1	111.7	S6 E8 A12 L13 D14	S6-R10 PolarHBondContact O-N 3.19Å; E8-R10 VanDerWaalsContact C-N 3.3Å; E8-R10 PolarHBondContact O-N 3.27Å; R10-A12 VanDerWaalsContact C-N 3.33Å; R10-A12 PolarHBondContact O-N 2.83Å; R10-L13 PolarHBondContact O-N 3.24Å; R10-D14 PolarHBondContact O-N 3.39Å
11	A	86.4	Confident	80.2	Confident	42 Å²	42	108.9 Å²	108.9	35%	0.347	60%	0.597	S	S	.	*	H	α-helix	trans	-65.1	-35	175.3	0	0	0	0	0	112.7	A7 E8 R15	A7-A11 WeakPolarHBondContact O-CB 3.02Å; A7-A11 PolarHBondContact O-N 2.73Å; E8-A11 PolarHBondContact O-N 2.96Å; A11-R15 WeakPolarHBondContact O-CB 3.34Å; A11-R15 WeakPolarHBondContact O-CG 3.29Å; A11-R15 PolarHBondContact O-N 2.95Å; A11-R15 PolarHBondContact O-NE 3.25Å
12	A	86.6	Confident	82.1	Confident	46 Å²	46	100.8 Å²	100.8	38%	0.38	56%	0.559	S	S	.	*	H	α-helix	trans	-66.9	-42	172.9	0	0	0	0	0	111.8	E8 E9 R10 R15 S16	E8-A12 VanDerWaalsContact O-CB 3.32Å; E8-A12 WeakPolarHBondContact O-CB 3.49Å; E8-A12 PolarHBondContact O-N 3.23Å; E9-A12 PolarHBondContact O-N 3.34Å; R10-A12 VanDerWaalsContact C-N 3.33Å; R10-A12 PolarHBondContact O-N 2.83Å; A12-R15 PolarHBondContact O-N 3.4Å; A12-S16 WeakPolarHBondContact O-CB 3.48Å; A12-S16 PolarHBondContact O-N 2.93Å
13	L	88.4	Confident	83.5	Confident	82 Å²	82	102.7 Å²	102.7	43%	0.429	55%	0.552	S	S	.	*	H	α-helix	trans	-65.8	-40.5	178.2	-147.4	114.3	0	0	0	112	E9 R10 S16 K17	E9-L13 WeakPolarHBondContact O-CB 3.39Å; E9-L13 PolarHBondContact O-N 2.96Å; R10-L13 PolarHBondContact O-N 3.24Å; L13-S16 PolarHBondContact O-N 2.87Å; L13-K17 HydrophobicContact CD2-CD 4.44Å; L13-K17 WeakPolarHBondContact O-CG 3.37Å; L13-K17 PolarHBondContact O-N 3.49Å
14	D	90.1	Very high	84.7	Confident	91 Å²	91	103.6 Å²	103.6	49%	0.487	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-39.3	176.4	-69.3	-22.4	0	0	0	111.5	R10 K17 A18	R10-D14 PolarHBondContact O-N 3.39Å; D14-K17 PolarHBondContact O-N 3.48Å; D14-A18 WeakPolarHBondContact O-CB 3.45Å; D14-A18 PolarHBondContact O-N 3.01Å
15	R	91.5	Very high	85.5	Confident	161 Å²	161	101.7 Å²	101.7	61%	0.608	52%	0.522	S	S	*	.	H	α-helix	trans	-62.8	-43.6	170.8	-78.5	-176.4	-68.9	-139.7	0.7	112.3	A11 A12 K17 A18 I19	A11-R15 WeakPolarHBondContact O-CB 3.34Å; A11-R15 WeakPolarHBondContact O-CG 3.29Å; A11-R15 PolarHBondContact O-N 2.95Å; A11-R15 PolarHBondContact O-NE 3.25Å; A12-R15 PolarHBondContact O-N 3.4Å; R15-K17 PolarHBondContact O-N 3.26Å; R15-A18 PolarHBondContact O-N 3.34Å; R15-I19 VanDerWaalsContact O-CG1 3.29Å; R15-I19 WeakPolarHBondContact O-CG1 3.49Å; R15-I19 PolarHBondContact O-N 3.36Å
16	S	91.3	Very high	85.7	Confident	59 Å²	59	101.5 Å²	101.5	41%	0.413	52%	0.521	S	S	.	.	H	α-helix	trans	-61.7	-44	177.8	-164.5	0	0	0	0	111.6	A12 L13 A18 I19 E20	A12-S16 WeakPolarHBondContact O-CB 3.48Å; A12-S16 PolarHBondContact O-N 2.93Å; L13-S16 PolarHBondContact O-N 2.87Å; S16-A18 VanDerWaalsContact C-N 3.34Å; S16-A18 PolarHBondContact O-N 3.46Å; S16-I19 PolarHBondContact O-N 3.06Å; S16-E20 PolarHBondContact O-N 2.95Å
17	K	91.6	Very high	85.3	Confident	122 Å²	122	101 Å²	101	53%	0.53	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-38.6	175.5	-75.6	176.1	178.3	174.7	0	112.6	L13 D14 R15 K21	L13-K17 HydrophobicContact CD2-CD 4.44Å; L13-K17 WeakPolarHBondContact O-CG 3.37Å; L13-K17 PolarHBondContact O-N 3.49Å; D14-K17 PolarHBondContact O-N 3.48Å; R15-K17 PolarHBondContact O-N 3.26Å; K17-K21 WeakPolarHBondContact O-CB 3.37Å; K17-K21 PolarHBondContact O-N 3.26Å
18	A	91.9	Very high	84.9	Confident	50 Å²	50	102.1 Å²	102.1	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-64.9	-42	174.8	0	0	0	0	0	111.5	D14 R15 S16 K21 N22	D14-A18 WeakPolarHBondContact O-CB 3.45Å; D14-A18 PolarHBondContact O-N 3.01Å; R15-A18 PolarHBondContact O-N 3.34Å; S16-A18 VanDerWaalsContact C-N 3.34Å; S16-A18 PolarHBondContact O-N 3.46Å; A18-K21 PolarHBondContact O-N 2.87Å; A18-N22 VanDerWaalsContact O-CG 3.23Å; A18-N22 PolarHBondContact O-N 2.83Å; A18-N22 PolarHBondContact O-OD1 3.09Å
19	I	91.1	Very high	84.3	Confident	100 Å²	100	98.3 Å²	98.3	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-63.4	-47	175.4	-67.3	164.6	0	0	0	110.8	R15 S16 K21 N22 L23	R15-I19 VanDerWaalsContact O-CG1 3.29Å; R15-I19 WeakPolarHBondContact O-CG1 3.49Å; R15-I19 PolarHBondContact O-N 3.36Å; S16-I19 PolarHBondContact O-N 3.06Å; I19-K21 VanDerWaalsContact C-N 3.31Å; I19-K21 PolarHBondContact O-N 2.91Å; I19-N22 PolarHBondContact O-N 3.24Å; I19-L23 HydrophobicContact CG2-CD1 3.85Å; I19-L23 HydrophobicContact CG2-CG 4.24Å; I19-L23 WeakPolarHBondContact O-CB 3.42Å; I19-L23 VanDerWaalsContact O-CG 3.3Å; I19-L23 WeakPolarHBondContact O-CG 3.18Å; I19-L23 PolarHBondContact O-N 3.5Å
20	E	88.7	Confident	83.6	Confident	125 Å²	125	96.1 Å²	96.1	58%	0.584	50%	0.504	S	S	*	.	H	α-helix	trans	-60.6	-40.3	176.9	-78.5	179.7	177.6	0	0	112.4	S16 L23 K24	S16-E20 PolarHBondContact O-N 2.95Å; E20-L23 PolarHBondContact O-N 2.95Å; E20-K24 WeakPolarHBondContact O-CB 3.43Å; E20-K24 PolarHBondContact O-N 3.15Å
21	K	89.3	Confident	83	Confident	127 Å²	127	91 Å²	91	55%	0.552	50%	0.498	S	S	*	.	H	α-helix	trans	-62.6	-47.4	175.5	-173.5	-174.9	171	-164.5	0	110.9	K17 A18 I19 K24 E25	K17-K21 WeakPolarHBondContact O-CB 3.37Å; K17-K21 PolarHBondContact O-N 3.26Å; A18-K21 PolarHBondContact O-N 2.87Å; I19-K21 VanDerWaalsContact C-N 3.31Å; I19-K21 PolarHBondContact O-N 2.91Å; K21-K24 PolarHBondContact O-N 3.35Å; K21-E25 WeakPolarHBondContact CE-OE1 3.34Å; K21-E25 IonicContact NZ-OE1 3.16Å; K21-E25 WeakPolarHBondContact O-CG 3.5Å; K21-E25 PolarHBondContact O-N 3.41Å
22	N	86.9	Confident	82.7	Confident	86 Å²	86	93.9 Å²	93.9	46%	0.46	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-45.3	177.4	-68.8	-2.3	0	0	0	111.1	A18 I19 K24 E25 D26	A18-N22 VanDerWaalsContact O-CG 3.23Å; A18-N22 PolarHBondContact O-N 2.83Å; A18-N22 PolarHBondContact O-OD1 3.09Å; I19-N22 PolarHBondContact O-N 3.24Å; N22-K24 PolarHBondContact O-N 3.28Å; N22-E25 PolarHBondContact O-N 3.27Å; N22-E25 VanDerWaalsContact O-N 3.14Å; N22-D26 WeakPolarHBondContact O-CB 3.32Å; N22-D26 PolarHBondContact O-N 3.08Å
23	L	81	Confident	82.7	Confident	112 Å²	112	94.2 Å²	94.2	59%	0.586	50%	0.499	S	S	*	.	H	α-helix	trans	-59.3	-36.1	176.1	-74.1	171.4	0	0	0	112.5	I19 E20 G27	I19-L23 HydrophobicContact CG2-CD1 3.85Å; I19-L23 HydrophobicContact CG2-CG 4.24Å; I19-L23 WeakPolarHBondContact O-CB 3.42Å; I19-L23 VanDerWaalsContact O-CG 3.3Å; I19-L23 WeakPolarHBondContact O-CG 3.18Å; I19-L23 PolarHBondContact O-N 3.5Å; E20-L23 PolarHBondContact O-N 2.95Å; L23-G27 PolarHBondContact O-N 3.44Å
24	K	79.3	Confident	82.8	Confident	157 Å²	157	90.3 Å²	90.3	68%	0.683	48%	0.478	S	S	*	.	H	α-helix	trans	-71.8	-40.4	176.5	-167.7	177.8	-177.7	179.5	0	111.9	E20 K21 N22 G27 L28	E20-K24 WeakPolarHBondContact O-CB 3.43Å; E20-K24 PolarHBondContact O-N 3.15Å; K21-K24 PolarHBondContact O-N 3.35Å; N22-K24 PolarHBondContact O-N 3.28Å; K24-G27 PolarHBondContact O-N 3.13Å; K24-L28 WeakPolarHBondContact O-CG 3.35Å; K24-L28 PolarHBondContact O-N 3.41Å; K24-L28 VanDerWaalsContact O-N 3.08Å
25	E	79.4	Confident	83	Confident	94 Å²	94	87.1 Å²	87.1	44%	0.439	46%	0.46	S	S	.	.	H	α-helix	trans	-65.5	-45.9	174.7	-73.1	176.6	179.6	0	0	110.9	K21 N22 G27 L28 V29	K21-E25 WeakPolarHBondContact CE-OE1 3.34Å; K21-E25 IonicContact NZ-OE1 3.16Å; K21-E25 WeakPolarHBondContact O-CG 3.5Å; K21-E25 PolarHBondContact O-N 3.41Å; N22-E25 PolarHBondContact O-N 3.27Å; N22-E25 VanDerWaalsContact O-N 3.14Å; E25-G27 VanDerWaalsContact C-N 3.31Å; E25-G27 PolarHBondContact O-N 2.99Å; E25-L28 WeakPolarHBondContact O-CB 3.45Å; E25-L28 PolarHBondContact O-N 3.46Å; E25-L28 VanDerWaalsContact O-N 3.13Å; E25-V29 WeakPolarHBondContact O-CG2 3.44Å; E25-V29 PolarHBondContact O-N 2.77Å
26	D	76.6	Confident	83.1	Confident	103 Å²	103	79.4 Å²	79.4	55%	0.551	43%	0.431	S	S	*	.	H	α-helix	trans	-60.1	-41	174.3	-68	-17.4	0	0	0	111.2	N22 L28 V29 A30	N22-D26 WeakPolarHBondContact O-CB 3.32Å; N22-D26 PolarHBondContact O-N 3.08Å; D26-L28 VanDerWaalsContact C-N 3.34Å; D26-L28 PolarHBondContact O-N 2.88Å; D26-V29 PolarHBondContact O-N 3.14Å; D26-A30 VanDerWaalsContact O-CB 3.25Å; D26-A30 WeakPolarHBondContact O-CB 3.3Å; D26-A30 PolarHBondContact O-N 3.27Å
27	G	71.1	Confident	83.3	Confident	41 Å²	41	76.6 Å²	76.6	42%	0.423	41%	0.411	S	S	.	.	H	α-helix	trans	-63.5	-36	175.2	0	0	0	0	0	113.4	L23 K24 E25 A31	L23-G27 PolarHBondContact O-N 3.44Å; K24-G27 PolarHBondContact O-N 3.13Å; E25-G27 VanDerWaalsContact C-N 3.31Å; E25-G27 PolarHBondContact O-N 2.99Å; G27-A31 WeakPolarHBondContact O-CB 3.37Å; G27-A31 PolarHBondContact O-N 2.97Å
28	L	71.2	Confident	83.5	Confident	112 Å²	112	70.8 Å²	70.8	59%	0.586	39%	0.386	S	S	*	.	H	α-helix	trans	-72.8	-32.5	175.4	-72.4	170.2	0	0	0	112.6	K24 E25 D26	K24-L28 WeakPolarHBondContact O-CG 3.35Å; K24-L28 PolarHBondContact O-N 3.41Å; K24-L28 VanDerWaalsContact O-N 3.08Å; E25-L28 WeakPolarHBondContact O-CB 3.45Å; E25-L28 PolarHBondContact O-N 3.46Å; E25-L28 VanDerWaalsContact O-N 3.13Å; D26-L28 VanDerWaalsContact C-N 3.34Å; D26-L28 PolarHBondContact O-N 2.88Å
29	V	71.4	Confident	83.8	Confident	80 Å²	80	68.4 Å²	68.4	49%	0.485	37%	0.366	S	S	.	.	H	α-helix	trans	-71.5	-47.4	173	174.3	0	0	0	0	110	E25 D26 A31 K32	E25-V29 WeakPolarHBondContact O-CG2 3.44Å; E25-V29 PolarHBondContact O-N 2.77Å; D26-V29 PolarHBondContact O-N 3.14Å; V29-A31 PolarHBondContact O-N 3.47Å; V29-K32 WeakPolarHBondContact O-CA 3.27Å; V29-K32 WeakPolarHBondContact O-CB 3.47Å; V29-K32 PolarHBondContact O-N 2.83Å
30	A	68.6	Low	84.1	Confident	57 Å²	57	63.7 Å²	63.7	47%	0.471	34%	0.342	S	S	.	.	H	α-helix	trans	-60.1	-33	177.8	0	0	0	0	0	112.6	D26 K32 D33	D26-A30 VanDerWaalsContact O-CB 3.25Å; D26-A30 WeakPolarHBondContact O-CB 3.3Å; D26-A30 PolarHBondContact O-N 3.27Å; A30-K32 PolarHBondContact O-N 3.48Å; A30-K32 VanDerWaalsContact O-N 3.16Å; A30-D33 WeakPolarHBondContact O-CB 3Å; A30-D33 PolarHBondContact O-N 3.08Å
31	A	70.9	Confident	84.3	Confident	63 Å²	63	58.1 Å²	58.1	52%	0.521	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.5	173.7	0	0	0	0	0	114	G27 V29	G27-A31 WeakPolarHBondContact O-CB 3.37Å; G27-A31 PolarHBondContact O-N 2.97Å; V29-A31 PolarHBondContact O-N 3.47Å
32	K	80.3	Confident	84.4	Confident	104 Å²	104	53.4 Å²	53.4	45%	0.452	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-6.4	175.4	-60.6	179.1	-178.4	179.7	0	113.1	V29 A30 L195 H196	V29-K32 WeakPolarHBondContact O-CA 3.27Å; V29-K32 WeakPolarHBondContact O-CB 3.47Å; V29-K32 PolarHBondContact O-N 2.83Å; A30-K32 PolarHBondContact O-N 3.48Å; A30-K32 VanDerWaalsContact O-N 3.16Å; K32-L195 HydrophobicContact CB-CD2 4.23Å; K32-H196 PolarHBondContact O-N 2.66Å
33	D	86.8	Confident	84.6	Confident	53 Å²	53	51.5 Å²	51.5	28%	0.283	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.2	178.4	-72.4	-12	0	0	0	109.9	A30 H196	A30-D33 WeakPolarHBondContact O-CB 3Å; A30-D33 PolarHBondContact O-N 3.08Å; D33-H196 WeakPolarHBondContact CA-O 3.47Å; D33-H196 WeakPolarHBondContact OD1-CB 3.36Å; D33-H196 IonicContact OD1-CD2 3.48Å; D33-H196 IonicContact OD1-CG 3.74Å
34	V	90.6	Very high	85.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	115.4	177.2	178.9	0	0	0	0	108.8	L36 L195 H196 F197 R198 T220 I343	V34-L36 HydrophobicContact CG1-CD2 3.78Å; V34-L36 HydrophobicContact CG1-CG 3.97Å; V34-L195 HydrophobicContact CG2-CB 4.36Å; V34-L195 HydrophobicContact CG2-CD1 4.06Å; V34-H196 PolarHBondContact N-O 3.48Å; V34-F197 HydrophobicContact CB-CD1 3.8Å; V34-F197 HydrophobicContact CB-CE1 3.88Å; V34-F197 HydrophobicContact CB-CG 4.4Å; V34-F197 HydrophobicContact CB-CZ 4.5Å; V34-F197 HydrophobicContact CG1-CD1 3.73Å; V34-F197 HydrophobicContact CG1-CE1 3.61Å; V34-F197 HydrophobicContact CG2-CE1 4.34Å; V34-F197 WeakPolarHBondContact O-CA 3.18Å; V34-R198 PolarHBondContact O-N 3.33Å; V34-T220 HydrophobicContact CG1-CG2 4.07Å; V34-I343 HydrophobicContact CG1-CD1 4.45Å; V34-I343 HydrophobicContact CG1-CG2 3.84Å; V34-I343 HydrophobicContact CG2-CG2 4.16Å
35	K	92.9	Very high	86	Confident	23 Å²	23	39.2 Å²	39.2	10%	0.1	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	114.9	174.6	-178.5	172.1	178.5	-175.1	0	109.9	F200 C215 E217 D218 V219 T220 A221	K35-F200 HydrophobicContact CD-CD2 4.43Å; K35-F200 HydrophobicContact CD-CE2 3.96Å; K35-F200 HydrophobicContact CG-CD2 3.96Å; K35-F200 HydrophobicContact CG-CE2 3.75Å; K35-C215 VanDerWaalsContact CE-O 3.24Å; K35-C215 WeakPolarHBondContact CE-O 3.28Å; K35-C215 PolarHBondContact NZ-O 3.4Å; K35-E217 PolarHBondContact NZ-O 3.4Å; K35-D218 WeakPolarHBondContact CB-O 3.26Å; K35-V219 HydrophobicContact CD-CG2 4.3Å; K35-V219 HydrophobicContact CG-CG2 4.49Å; K35-T220 PolarHBondContact N-OG1 3.27Å; K35-T220 WeakPolarHBondContact O-CB 3.46Å; K35-T220 PolarHBondContact O-N 2.95Å; K35-A221 PolarHBondContact O-N 3.36Å
36	L	94.6	Very high	86.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.7	177.2	-62.5	-176	0	0	0	110.8	V34 F197 R198 L199 F200 A221 I223 F336 I343	V34-L36 HydrophobicContact CG1-CD2 3.78Å; V34-L36 HydrophobicContact CG1-CG 3.97Å; L36-F197 HydrophobicContact CD1-CD1 3.58Å; L36-F197 HydrophobicContact CD1-CE1 3.88Å; L36-F197 HydrophobicContact CG-CD1 4.05Å; L36-F197 HydrophobicContact CG-CE1 4.45Å; L36-R198 PolarHBondContact N-O 3.26Å; L36-L199 HydrophobicContact CB-CD1 3.57Å; L36-L199 HydrophobicContact CD1-CD1 4.31Å; L36-L199 WeakPolarHBondContact O-CA 3.45Å; L36-F200 PolarHBondContact O-N 3.27Å; L36-A221 WeakPolarHBondContact CA-O 3.47Å; L36-A221 HydrophobicContact CD2-CB 3.89Å; L36-I223 HydrophobicContact CD1-CD1 4.07Å; L36-F336 HydrophobicContact CD1-CE2 4.07Å; L36-F336 HydrophobicContact CD1-CZ 4Å; L36-I343 HydrophobicContact CD1-CD1 4.49Å; L36-I343 HydrophobicContact CD2-CD1 3.73Å
37	L	95.9	Very high	87.7	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.9	177.4	-176.2	58.9	0	0	0	110.8	L39 F200 V202 C215 F216 V219 A221 I223 F260	L37-L39 HydrophobicContact CD1-CD2 4.12Å; L37-L39 HydrophobicContact CD2-CD1 3.96Å; L37-L39 HydrophobicContact CD2-CD2 3.93Å; L37-L39 HydrophobicContact CD2-CG 4.05Å; L37-L39 HydrophobicContact CG-CD1 4.28Å; L37-L39 HydrophobicContact CG-CD2 3.76Å; L37-L39 HydrophobicContact CG-CG 3.84Å; L37-F200 HydrophobicContact CD1-CB 3.74Å; L37-V202 HydrophobicContact CD1-CG1 4.2Å; L37-C215 HydrophobicContact CD1-CB 4.27Å; L37-C215 WeakPolarHBondContact CD1-SG 3.39Å; L37-F216 HydrophobicContact CD2-CD1 3.69Å; L37-F216 HydrophobicContact CD2-CE1 3.71Å; L37-V219 HydrophobicContact CB-CG1 3.94Å; L37-V219 HydrophobicContact CB-CG2 4.31Å; L37-V219 HydrophobicContact CD2-CG2 4.31Å; L37-A221 PolarHBondContact N-O 2.78Å; L37-I223 PolarHBondContact O-N 2.88Å; L37-F260 HydrophobicContact CD2-CZ 3.97Å
38	L	96.1	Very high	88.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	110.6	175.7	-78	167.2	0	0	0	110.9	K46 I49 V50 L199 F200 V202 I223	L38-K46 HydrophobicContact CB-CB 4.34Å; L38-K46 HydrophobicContact CB-CD 4.28Å; L38-K46 HydrophobicContact CB-CG 4.29Å; L38-K46 WeakPolarHBondContact O-CD 3.49Å; L38-I49 HydrophobicContact CD1-CG2 4.46Å; L38-I49 HydrophobicContact CD2-CD1 4.34Å; L38-I49 HydrophobicContact CD2-CG2 4.29Å; L38-V50 HydrophobicContact CD1-CG2 3.49Å; L38-V50 VanDerWaalsContact CD1-CG2 3.49Å; L38-L199 HydrophobicContact CD1-CD1 3.69Å; L38-L199 HydrophobicContact CD1-CD2 3.77Å; L38-L199 HydrophobicContact CD1-CG 3.73Å; L38-L199 HydrophobicContact CG-CD1 3.67Å; L38-L199 HydrophobicContact CG-CG 4.26Å; L38-F200 WeakPolarHBondContact CB-O 3.39Å; L38-F200 PolarHBondContact N-O 3.45Å; L38-V202 WeakPolarHBondContact O-CG2 3.45Å; L38-I223 WeakPolarHBondContact CA-O 3.4Å; L38-I223 HydrophobicContact CD2-CB 3.64Å; L38-I223 HydrophobicContact CD2-CD1 4.32Å; L38-I223 HydrophobicContact CD2-CG2 3.54Å
39	L	97	Very high	90	Very high	0 Å²	0	26 Å²	26	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	164.3	178.8	-59.7	-176.9	0	0	0	111.6	L37 V202 W212 I222 I223 F224 C225 I254 F260	L37-L39 HydrophobicContact CD1-CD2 4.12Å; L37-L39 HydrophobicContact CD2-CD1 3.96Å; L37-L39 HydrophobicContact CD2-CD2 3.93Å; L37-L39 HydrophobicContact CD2-CG 4.05Å; L37-L39 HydrophobicContact CG-CD1 4.28Å; L37-L39 HydrophobicContact CG-CD2 3.76Å; L37-L39 HydrophobicContact CG-CG 3.84Å; L39-V202 HydrophobicContact CD2-CG2 3.51Å; L39-W212 HydrophobicContact CB-CZ3 4.36Å; L39-W212 HydrophobicContact CD1-CE3 4.49Å; L39-W212 HydrophobicContact CD1-CZ3 4.44Å; L39-W212 HydrophobicContact CD2-CD2 3.91Å; L39-W212 HydrophobicContact CD2-CE3 3.67Å; L39-W212 HydrophobicContact CD2-CH2 4.25Å; L39-W212 HydrophobicContact CD2-CZ2 4.46Å; L39-W212 HydrophobicContact CD2-CZ3 3.84Å; L39-W212 HydrophobicContact CG-CZ3 4.44Å; L39-I222 HydrophobicContact CB-CG2 4.33Å; L39-I222 HydrophobicContact CD1-CD1 4.48Å; L39-I222 HydrophobicContact CD1-CG2 3.91Å; L39-I222 HydrophobicContact CG-CG2 4.16Å; L39-I223 PolarHBondContact N-O 2.73Å; L39-F224 HydrophobicContact CB-CD2 3.84Å; L39-F224 HydrophobicContact CB-CE2 4.3Å; L39-F224 WeakPolarHBondContact O-CA 3.36Å; L39-C225 PolarHBondContact O-N 3.25Å; L39-I254 HydrophobicContact CD1-CD1 3.83Å; L39-I254 HydrophobicContact CD1-CG1 4.04Å; L39-I254 HydrophobicContact CD1-CG2 3.72Å; L39-F260 HydrophobicContact CD1-CE2 4.47Å
40	G	96.7	Very high	91.1	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.147	C	C	.	.			trans	138.2	168.9	176.6	0	0	0	0	0	112.8	K46 G204 C225	G40-K46 PolarHBondContact O-NZ 3.43Å; G40-G204 WeakPolarHBondContact O-CA 3.5Å; G40-C225 WeakPolarHBondContact CA-O 3.48Å
41	G	93.8	Very high	92.4	Very high	8 Å²	8	21.3 Å²	21.3	8%	0.082	13%	0.129	C	C	.	.	S	Bend	trans	-59.1	168.7	-177.8	0	0	0	0	0	114.5	S44 K46	G41-S44 WeakPolarHBondContact O-CB 3.34Å; G41-S44 PolarHBondContact O-N 2.96Å; G41-S44 PolarHBondContact O-OG 3.5Å; G41-S44 VanDerWaalsContact O-OG 3.05Å; G41-K46 PolarHBondContact O-NZ 2.9Å
42	G	90.9	Very high	93.5	Very high	29 Å²	29	18.3 Å²	18.3	30%	0.299	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	142.5	170	0	0	0	0	0	111	S44 G204	G42-S44 PolarHBondContact O-N 3.36Å; G42-G204 PolarHBondContact N-O 3.48Å
43	E	90.9	Very high	94.1	Very high	45 Å²	45	13.3 Å²	13.3	21%	0.21	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	12.6	178.6	-58	165	-151.5	0	0	115.6	G45 R179 R243 K271	E43-G45 PolarHBondContact O-N 2.92Å; E43-G45 VanDerWaalsContact O-N 3.17Å; E43-R179 IonicContact OE1-CZ 3.34Å; E43-R179 IonicContact OE1-NH1 3.66Å; E43-R179 PolarHBondContact OE1-NH1 2.96Å; E43-R179 IonicContact OE1-NH2 3.51Å; E43-R179 PolarHBondContact OE1-NH2 3.34Å; E43-R179 IonicContact OE2-NH1 3.25Å; E43-R179 PolarHBondContact OE2-NH1 3.39Å; E43-R243 IonicContact OE1-NH2 3.4Å; E43-R243 IonicContact OE2-CZ 2.77Å; E43-R243 IonicContact OE2-NH1 2.68Å; E43-R243 PolarHBondContact OE2-NH1 3.43Å; E43-R243 IonicContact OE2-NH2 2.73Å; E43-R243 PolarHBondContact OE2-NH2 3.36Å; E43-R243 VanDerWaalsContact OE2-NH2 3.16Å; E43-K271 WeakPolarHBondContact O-CE 3.17Å; E43-K271 PolarHBondContact O-NZ 3.37Å
44	S	95.9	Very high	94.3	Very high	3 Å²	3	13 Å²	13	2%	0.021	8%	0.079	C	C	.	.	S	Bend	trans	-71.4	-7.3	-179.9	67.4	0	0	0	0	115.4	G41 G42 K46 C225 N270	G41-S44 WeakPolarHBondContact O-CB 3.34Å; G41-S44 PolarHBondContact O-N 2.96Å; G41-S44 PolarHBondContact O-OG 3.5Å; G41-S44 VanDerWaalsContact O-OG 3.05Å; G42-S44 PolarHBondContact O-N 3.36Å; S44-K46 PolarHBondContact OG-NZ 3.11Å; S44-C225 WeakPolarHBondContact CB-O 3.15Å; S44-C225 WeakPolarHBondContact OG-CB 3.37Å; S44-C225 PolarHBondContact OG-O 3.03Å; S44-C225 VanDerWaalsContact OG-O 3.08Å; S44-N270 PolarHBondContact O-ND2 3.46Å
45	G	95.4	Very high	94.4	Very high	9 Å²	9	14.3 Å²	14.3	9%	0.093	9%	0.085	C	C	.	.	S	Bend	trans	101.1	11.6	176.4	0	0	0	0	0	115.9	E43 S47 T48 I49	E43-G45 PolarHBondContact O-N 2.92Å; E43-G45 VanDerWaalsContact O-N 3.17Å; G45-S47 PolarHBondContact O-N 3.35Å; G45-T48 WeakPolarHBondContact O-CB 3.36Å; G45-T48 PolarHBondContact O-N 3.21Å; G45-T48 VanDerWaalsContact O-N 3.14Å; G45-I49 WeakPolarHBondContact O-CG1 3.41Å; G45-I49 PolarHBondContact O-N 3.43Å
46	K	95.6	Very high	94.4	Very high	10 Å²	10	14.8 Å²	14.8	4%	0.043	9%	0.089	C	C	.	.	H	α-helix	trans	-52.5	-55.2	176.8	-63.3	-178.6	-67.2	-65.9	0	113.2	L38 G40 G41 S44 T48 I49 V50 D201 V202 C225	L38-K46 HydrophobicContact CB-CB 4.34Å; L38-K46 HydrophobicContact CB-CD 4.28Å; L38-K46 HydrophobicContact CB-CG 4.29Å; L38-K46 WeakPolarHBondContact O-CD 3.49Å; G40-K46 PolarHBondContact O-NZ 3.43Å; G41-K46 PolarHBondContact O-NZ 2.9Å; S44-K46 PolarHBondContact OG-NZ 3.11Å; K46-T48 PolarHBondContact O-N 3.49Å; K46-I49 WeakPolarHBondContact O-CA 3.49Å; K46-I49 WeakPolarHBondContact O-CB 3.25Å; K46-I49 PolarHBondContact O-N 3.39Å; K46-V50 WeakPolarHBondContact O-CG2 3.35Å; K46-V50 PolarHBondContact O-N 3.37Å; K46-D201 VanDerWaalsContact CB-OD1 3.27Å; K46-D201 WeakPolarHBondContact CB-OD1 2.94Å; K46-V202 WeakPolarHBondContact CE-O 3.39Å; K46-C225 HydrophobicContact CG-CB 4.04Å
47	S	95.3	Very high	94.1	Very high	33 Å²	33	16.5 Å²	16.5	23%	0.231	10%	0.097	C	C	.	.	H	α-helix	trans	-66.8	-23.8	-179.7	-46.8	0	0	0	0	112.7	G45 K51 T182 D201	G45-S47 PolarHBondContact O-N 3.35Å; S47-K51 VanDerWaalsContact O-CG 3.3Å; S47-K51 WeakPolarHBondContact O-CG 3.38Å; S47-K51 PolarHBondContact O-N 3.03Å; S47-K51 VanDerWaalsContact O-N 3.07Å; S47-T182 PolarHBondContact OG-OG1 3.01Å; S47-D201 WeakPolarHBondContact CA-OD2 3.41Å; S47-D201 WeakPolarHBondContact CB-OD2 3.42Å; S47-D201 PolarHBondContact OG-OD2 3.29Å
48	T	96.1	Very high	93.6	Very high	26 Å²	26	20.1 Å²	20.1	16%	0.16	11%	0.114	C	C	.	.	H	α-helix	trans	-69.5	-39.3	170.7	-49.3	0	0	0	0	111	G45 K46 V50 K51 Q52 L176 A326 T327	G45-T48 WeakPolarHBondContact O-CB 3.36Å; G45-T48 PolarHBondContact O-N 3.21Å; G45-T48 VanDerWaalsContact O-N 3.14Å; K46-T48 PolarHBondContact O-N 3.49Å; T48-V50 VanDerWaalsContact C-N 3.35Å; T48-K51 WeakPolarHBondContact O-CB 3.4Å; T48-K51 PolarHBondContact O-N 2.97Å; T48-Q52 WeakPolarHBondContact O-CG 3.46Å; T48-Q52 PolarHBondContact O-N 2.96Å; T48-L176 HydrophobicContact CG2-CD2 4.14Å; T48-A326 HydrophobicContact CG2-CB 3.67Å; T48-A326 VanDerWaalsContact CG2-O 3.28Å; T48-A326 WeakPolarHBondContact CG2-O 3.42Å; T48-T327 HydrophobicContact CG2-CG2 4.36Å
49	I	95.4	Very high	93.2	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-40.9	174.4	-66.9	155.8	0	0	0	110.9	L38 G45 K46 K51 Q52 M53 C225 F268 A326	L38-I49 HydrophobicContact CD1-CG2 4.46Å; L38-I49 HydrophobicContact CD2-CD1 4.34Å; L38-I49 HydrophobicContact CD2-CG2 4.29Å; G45-I49 WeakPolarHBondContact O-CG1 3.41Å; G45-I49 PolarHBondContact O-N 3.43Å; K46-I49 WeakPolarHBondContact O-CA 3.49Å; K46-I49 WeakPolarHBondContact O-CB 3.25Å; K46-I49 PolarHBondContact O-N 3.39Å; I49-K51 VanDerWaalsContact C-N 3.34Å; I49-K51 PolarHBondContact O-N 2.89Å; I49-Q52 WeakPolarHBondContact O-CB 3.28Å; I49-Q52 PolarHBondContact O-N 3.16Å; I49-Q52 VanDerWaalsContact O-N 3.1Å; I49-M53 HydrophobicContact CG2-CE 4.31Å; I49-M53 WeakPolarHBondContact O-CG 3.42Å; I49-M53 PolarHBondContact O-N 3.19Å; I49-C225 WeakPolarHBondContact CD1-SG 3.22Å; I49-F268 HydrophobicContact CD1-CD2 3.64Å; I49-F268 HydrophobicContact CD1-CE2 4.05Å; I49-A326 HydrophobicContact CG1-CB 4.14Å
50	V	93.9	Very high	92.9	Very high	18 Å²	18	28.9 Å²	28.9	11%	0.109	16%	0.162	C	C	.	.	H	α-helix	trans	-60.5	-45.9	175.6	176.7	0	0	0	0	110.8	L38 K46 T48 Q52 M53 K54 T188 L199 D201	L38-V50 HydrophobicContact CD1-CG2 3.49Å; L38-V50 VanDerWaalsContact CD1-CG2 3.49Å; K46-V50 WeakPolarHBondContact O-CG2 3.35Å; K46-V50 PolarHBondContact O-N 3.37Å; T48-V50 VanDerWaalsContact C-N 3.35Å; V50-Q52 VanDerWaalsContact C-N 3.26Å; V50-Q52 PolarHBondContact O-N 2.9Å; V50-M53 WeakPolarHBondContact O-CB 3.48Å; V50-M53 PolarHBondContact O-N 3.07Å; V50-K54 PolarHBondContact O-N 3.26Å; V50-T188 HydrophobicContact CG1-CG2 4.48Å; V50-T188 WeakPolarHBondContact CG1-OG1 3.35Å; V50-L199 HydrophobicContact CG2-CD2 4.07Å; V50-D201 HydrophobicContact CG2-CB 3.64Å
51	K	95	Very high	92.6	Very high	21 Å²	21	30.1 Å²	30.1	9%	0.091	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-38.3	173.5	-75.5	173	-176.2	178.1	0	112.3	S47 T48 I49 M53 K54 I55 F61 I175 L176 T178	S47-K51 VanDerWaalsContact O-CG 3.3Å; S47-K51 WeakPolarHBondContact O-CG 3.38Å; S47-K51 PolarHBondContact O-N 3.03Å; S47-K51 VanDerWaalsContact O-N 3.07Å; T48-K51 WeakPolarHBondContact O-CB 3.4Å; T48-K51 PolarHBondContact O-N 2.97Å; I49-K51 VanDerWaalsContact C-N 3.34Å; I49-K51 PolarHBondContact O-N 2.89Å; K51-M53 VanDerWaalsContact C-N 3.34Å; K51-K54 WeakPolarHBondContact O-CB 3.28Å; K51-K54 PolarHBondContact O-N 3.03Å; K51-I55 WeakPolarHBondContact O-CG1 3.3Å; K51-I55 PolarHBondContact O-N 2.51Å; K51-F61 HydrophobicContact CB-CZ 3.98Å; K51-F61 HydrophobicContact CG-CE1 4.49Å; K51-F61 HydrophobicContact CG-CZ 4.14Å; K51-I175 PolarHBondContact NZ-O 3.16Å; K51-L176 HydrophobicContact CB-CD2 3.76Å; K51-T178 PolarHBondContact NZ-O 3.45Å; K51-T178 PolarHBondContact NZ-OG1 2.89Å
52	Q	95.1	Very high	92.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-36.1	174.7	-69.6	-74.1	10.5	0	0	112.3	T48 I49 V50 K54 I55 I56 L176 A326 T329 I332	T48-Q52 WeakPolarHBondContact O-CG 3.46Å; T48-Q52 PolarHBondContact O-N 2.96Å; I49-Q52 WeakPolarHBondContact O-CB 3.28Å; I49-Q52 PolarHBondContact O-N 3.16Å; I49-Q52 VanDerWaalsContact O-N 3.1Å; V50-Q52 VanDerWaalsContact C-N 3.26Å; V50-Q52 PolarHBondContact O-N 2.9Å; Q52-K54 VanDerWaalsContact C-N 3.25Å; Q52-K54 PolarHBondContact O-N 2.8Å; Q52-I55 PolarHBondContact O-N 3.38Å; Q52-I55 VanDerWaalsContact O-N 3.09Å; Q52-I56 HydrophobicContact CB-CD1 4.17Å; Q52-I56 WeakPolarHBondContact O-CB 3.25Å; Q52-I56 VanDerWaalsContact O-CG1 3.25Å; Q52-I56 WeakPolarHBondContact O-CG1 3.45Å; Q52-I56 PolarHBondContact O-N 3.01Å; Q52-L176 HydrophobicContact CG-CD2 3.8Å; Q52-A326 VanDerWaalsContact CG-O 3.32Å; Q52-A326 WeakPolarHBondContact CG-O 3.45Å; Q52-A326 PolarHBondContact NE2-O 3.2Å; Q52-T329 PolarHBondContact NE2-OG1 3.47Å; Q52-T329 PolarHBondContact OE1-OG1 3.41Å; Q52-I332 HydrophobicContact CB-CB 4.44Å; Q52-I332 HydrophobicContact CB-CG2 3.82Å; Q52-I332 HydrophobicContact CG-CB 4.36Å; Q52-I332 HydrophobicContact CG-CG1 4.21Å; Q52-I332 HydrophobicContact CG-CG2 4.23Å
53	M	92.6	Very high	92.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-37.9	175.6	-60.7	-58.2	100.2	0	0	111.6	I49 V50 K51 I55 I56 H57 F190 L199 I332 F336	I49-M53 HydrophobicContact CG2-CE 4.31Å; I49-M53 WeakPolarHBondContact O-CG 3.42Å; I49-M53 PolarHBondContact O-N 3.19Å; V50-M53 WeakPolarHBondContact O-CB 3.48Å; V50-M53 PolarHBondContact O-N 3.07Å; K51-M53 VanDerWaalsContact C-N 3.34Å; M53-I55 VanDerWaalsContact C-N 3.35Å; M53-I56 HydrophobicContact CE-CD1 4.47Å; M53-I56 PolarHBondContact O-N 3.42Å; M53-H57 WeakPolarHBondContact O-CA 3.49Å; M53-H57 WeakPolarHBondContact O-CB 3.49Å; M53-H57 PolarHBondContact O-N 3.37Å; M53-F190 HydrophobicContact CB-CD1 4.13Å; M53-F190 HydrophobicContact CB-CE1 3.99Å; M53-F190 HydrophobicContact CB-CZ 4.42Å; M53-F190 HydrophobicContact CG-CD1 4.46Å; M53-F190 HydrophobicContact CG-CE1 3.82Å; M53-F190 HydrophobicContact CG-CZ 4.01Å; M53-F190 HydrophobicContact SD-CE1 4.13Å; M53-F190 HydrophobicContact SD-CE2 4.16Å; M53-F190 HydrophobicContact SD-CZ 3.67Å; M53-L199 HydrophobicContact CG-CD2 3.7Å; M53-I332 HydrophobicContact CE-CG2 3.76Å; M53-F336 HydrophobicContact CE-CB 4.46Å; M53-F336 HydrophobicContact CE-CD2 3.85Å; M53-F336 HydrophobicContact CE-CE2 4.33Å; M53-F336 HydrophobicContact CE-CG 4.08Å; M53-F336 HydrophobicContact SD-CD1 4.3Å; M53-F336 HydrophobicContact SD-CD2 3.79Å; M53-F336 HydrophobicContact SD-CE1 4.22Å; M53-F336 HydrophobicContact SD-CE2 3.68Å; M53-F336 HydrophobicContact SD-CG 4.11Å; M53-F336 HydrophobicContact SD-CZ 3.93Å
54	K	91.8	Very high	92.4	Very high	47 Å²	47	36.1 Å²	36.1	20%	0.204	21%	0.209	C	C	.	.	H	α-helix	trans	-64.8	-35.6	173.7	-178.6	162.9	178.4	173.3	0	112.8	V50 K51 Q52 E58 G60 F61 D65	V50-K54 PolarHBondContact O-N 3.26Å; K51-K54 WeakPolarHBondContact O-CB 3.28Å; K51-K54 PolarHBondContact O-N 3.03Å; Q52-K54 VanDerWaalsContact C-N 3.25Å; Q52-K54 PolarHBondContact O-N 2.8Å; K54-E58 HydrophobicContact CG-CB 4.45Å; K54-E58 WeakPolarHBondContact CG-OE2 3.41Å; K54-E58 CarbonylContact O-C 3.17Å; K54-E58 WeakPolarHBondContact O-CB 3.48Å; K54-E58 PolarHBondContact O-N 2.94Å; K54-G60 WeakPolarHBondContact CE-O 2.94Å; K54-G60 WeakPolarHBondContact CG-O 3.4Å; K54-G60 WeakPolarHBondContact O-CA 3.41Å; K54-G60 PolarHBondContact O-N 2.93Å; K54-G60 VanDerWaalsContact O-N 3.12Å; K54-F61 HydrophobicContact CD-CD1 4.07Å; K54-F61 HydrophobicContact CD-CE1 4Å; K54-F61 HydrophobicContact CG-CE1 4.46Å; K54-D65 IonicContact NZ-OD1 2.59Å; K54-D65 PolarHBondContact NZ-OD1 3.25Å; K54-D65 IonicContact NZ-OD2 3.25Å; K54-D65 PolarHBondContact NZ-OD2 2.83Å
55	I	92.5	Very high	92.2	Very high	27 Å²	27	37 Å²	37	14%	0.138	21%	0.213	C	C	.	.	H	α-helix	trans	-72.8	-43.2	176.2	-61.8	170.5	0	0	0	111.7	K51 Q52 M53 F61 E172 L176 T329	K51-I55 WeakPolarHBondContact O-CG1 3.3Å; K51-I55 PolarHBondContact O-N 2.51Å; Q52-I55 PolarHBondContact O-N 3.38Å; Q52-I55 VanDerWaalsContact O-N 3.09Å; M53-I55 VanDerWaalsContact C-N 3.35Å; I55-F61 HydrophobicContact CD1-CE2 3.75Å; I55-F61 HydrophobicContact CD1-CZ 4.43Å; I55-F61 HydrophobicContact CG1-CD2 4.25Å; I55-F61 HydrophobicContact CG1-CE2 3.66Å; I55-F61 HydrophobicContact CG1-CZ 4.25Å; I55-E172 HydrophobicContact CD1-CB 4.45Å; I55-L176 HydrophobicContact CD1-CD1 3.66Å; I55-L176 HydrophobicContact CD1-CD2 3.76Å; I55-L176 HydrophobicContact CD1-CG 3.75Å; I55-T329 HydrophobicContact CG2-CG2 4.04Å
56	I	91.4	Very high	92	Very high	33 Å²	33	37.7 Å²	37.7	17%	0.169	22%	0.216	C	C	.	.	H	α-helix	trans	-86.1	-34.8	-168.9	-60.4	165.3	0	0	0	111.9	Q52 M53 T329 I332 Q333	Q52-I56 HydrophobicContact CB-CD1 4.17Å; Q52-I56 WeakPolarHBondContact O-CB 3.25Å; Q52-I56 VanDerWaalsContact O-CG1 3.25Å; Q52-I56 WeakPolarHBondContact O-CG1 3.45Å; Q52-I56 PolarHBondContact O-N 3.01Å; M53-I56 HydrophobicContact CE-CD1 4.47Å; M53-I56 PolarHBondContact O-N 3.42Å; I56-T329 HydrophobicContact CD1-CG2 4.21Å; I56-T329 HydrophobicContact CG1-CG2 3.8Å; I56-I332 HydrophobicContact CD1-CB 4.3Å; I56-I332 HydrophobicContact CD1-CG2 3.87Å; I56-Q333 HydrophobicContact CD1-CB 4.11Å; I56-Q333 HydrophobicContact CG2-CB 4.39Å; I56-Q333 HydrophobicContact CG2-CG 4.02Å
57	H	88	Confident	91.9	Very high	36 Å²	36	43.9 Å²	43.9	17%	0.167	24%	0.243	C	C	.	.	H	α-helix	trans	-120.5	-1.7	-169.6	-58	-53.5	0	0	0	114.4	M53 F190 F192 F336	M53-H57 WeakPolarHBondContact O-CA 3.49Å; M53-H57 WeakPolarHBondContact O-CB 3.49Å; M53-H57 PolarHBondContact O-N 3.37Å; H57-F190 HydrophobicContact CB-CB 4.05Å; H57-F190 HydrophobicContact CB-CD2 3.83Å; H57-F190 HydrophobicContact CB-CG 4.19Å; H57-F190 AromaticContact CD2-CD2 3.67Å; H57-F190 AromaticContact CD2-CE2 3.64Å; H57-F190 AromaticContact CG-CD2 3.87Å; H57-F192 AromaticContact CE1-CD2 3.28Å; H57-F192 WeakPolarHBondContact CE1-CD2 3.27Å; H57-F192 AromaticContact CE1-CE2 3.64Å; H57-F192 AromaticContact CE1-CG 3.56Å; H57-F192 AromaticContact ND1-CD2 3.45Å; H57-F192 WeakPolarHBondContact ND1-CD2 3.46Å; H57-F192 AromaticContact ND1-CG 3.9Å; H57-F336 AromaticContact NE2-CD1 3.49Å; H57-F336 WeakPolarHBondContact NE2-CD1 3.26Å; H57-F336 AromaticContact NE2-CE1 3.83Å
58	E	86.8	Confident	91.9	Very high	76 Å²	76	48.7 Å²	48.7	36%	0.355	26%	0.262	S	S	.	.	S	Bend	trans	-126	-167	171.6	-55.2	179.5	-175.2	0	0	109.9	K54 G60	K54-E58 HydrophobicContact CG-CB 4.45Å; K54-E58 WeakPolarHBondContact CG-OE2 3.41Å; K54-E58 CarbonylContact O-C 3.17Å; K54-E58 WeakPolarHBondContact O-CB 3.48Å; K54-E58 PolarHBondContact O-N 2.94Å; E58-G60 PolarHBondContact O-N 3.19Å
59	D	88	Confident	92	Very high	174 Å²	174	49.8 Å²	49.8	93%	0.93	26%	0.263	S	S	*	.			trans	-82.8	22	-179.9	-62	-51.9	0	0	0	113.3
60	G	89.6	Confident	92.1	Very high	9 Å²	9	52.2 Å²	52.2	9%	0.093	27%	0.274	C	S	.	.			trans	67.7	-151.3	-177.3	0	0	0	0	0	113.6	K54 E58	K54-G60 WeakPolarHBondContact CE-O 2.94Å; K54-G60 WeakPolarHBondContact CG-O 3.4Å; K54-G60 WeakPolarHBondContact O-CA 3.41Å; K54-G60 PolarHBondContact O-N 2.93Å; K54-G60 VanDerWaalsContact O-N 3.12Å; E58-G60 PolarHBondContact O-N 3.19Å
61	F	91.4	Very high	92.3	Very high	26 Å²	26	53.5 Å²	53.5	11%	0.114	28%	0.283	C	S	.	.			trans	-92	125.1	-179.7	-61.7	-70.2	0	0	0	111.9	K51 K54 I55 D65 Y69 E172 I175	K51-F61 HydrophobicContact CB-CZ 3.98Å; K51-F61 HydrophobicContact CG-CE1 4.49Å; K51-F61 HydrophobicContact CG-CZ 4.14Å; K54-F61 HydrophobicContact CD-CD1 4.07Å; K54-F61 HydrophobicContact CD-CE1 4Å; K54-F61 HydrophobicContact CG-CE1 4.46Å; I55-F61 HydrophobicContact CD1-CE2 3.75Å; I55-F61 HydrophobicContact CD1-CZ 4.43Å; I55-F61 HydrophobicContact CG1-CD2 4.25Å; I55-F61 HydrophobicContact CG1-CE2 3.66Å; I55-F61 HydrophobicContact CG1-CZ 4.25Å; F61-D65 HydrophobicContact CB-CB 3.93Å; F61-D65 HydrophobicContact CD1-CB 4.08Å; F61-D65 HydrophobicContact CG-CB 4.46Å; F61-Y69 HydrophobicContact CD1-CE2 4.32Å; F61-Y69 HydrophobicContact CE1-CE2 4.29Å; F61-E172 HydrophobicContact CD2-CB 4.42Å; F61-E172 HydrophobicContact CD2-CG 4.23Å; F61-I175 HydrophobicContact CB-CD1 3.85Å; F61-I175 HydrophobicContact CD1-CD1 4.35Å; F61-I175 HydrophobicContact CD1-CG2 3.96Å; F61-I175 HydrophobicContact CD2-CB 4.21Å; F61-I175 HydrophobicContact CD2-CD1 3.81Å; F61-I175 HydrophobicContact CD2-CG2 4Å; F61-I175 HydrophobicContact CE1-CG2 3.6Å; F61-I175 HydrophobicContact CE2-CB 4Å; F61-I175 HydrophobicContact CE2-CD1 4.46Å; F61-I175 HydrophobicContact CE2-CG2 3.62Å; F61-I175 HydrophobicContact CG-CD1 3.74Å; F61-I175 HydrophobicContact CG-CG2 4.16Å; F61-I175 HydrophobicContact CZ-CB 4.31Å; F61-I175 HydrophobicContact CZ-CG2 3.43Å; F61-I175 VanDerWaalsContact CZ-CG2 3.43Å
62	S	91.3	Very high	92.4	Very high	59 Å²	59	54.1 Å²	54.1	41%	0.413	29%	0.288	S	S	.	.			trans	-74.4	168	176.9	71	0	0	0	0	112.5	D64 D65 V66	S62-D64 PolarHBondContact O-N 3.36Å; S62-D64 PolarHBondContact OG-N 3.47Å; S62-D65 WeakPolarHBondContact CB-OD2 3.46Å; S62-D65 PolarHBondContact N-OD2 3.25Å; S62-D65 WeakPolarHBondContact O-CB 3.37Å; S62-D65 PolarHBondContact O-N 3.34Å; S62-D65 VanDerWaalsContact O-N 3.07Å; S62-D65 PolarHBondContact OG-N 3.35Å; S62-D65 PolarHBondContact OG-OD2 2.87Å; S62-V66 WeakPolarHBondContact O-CG2 3.36Å; S62-V66 PolarHBondContact O-N 3.41Å
63	G	89	Confident	92.6	Very high	51 Å²	51	54.1 Å²	54.1	53%	0.526	29%	0.288	S	S	.	.	H	α-helix	trans	-59.5	-26.8	173.6	0	0	0	0	0	113.8	K67	G63-K67 WeakPolarHBondContact O-CG 3.5Å; G63-K67 PolarHBondContact O-N 2.83Å
64	D	91.5	Very high	92.8	Very high	98 Å²	98	54.4 Å²	54.4	52%	0.524	29%	0.289	S	S	.	.	H	α-helix	trans	-78.8	-34.4	175.1	-70.8	-25.4	0	0	0	112	S62 V66 K67 Q68	S62-D64 PolarHBondContact O-N 3.36Å; S62-D64 PolarHBondContact OG-N 3.47Å; D64-V66 VanDerWaalsContact C-N 3.32Å; D64-V66 PolarHBondContact O-N 2.97Å; D64-K67 PolarHBondContact O-N 3.47Å; D64-K67 IonicContact OD1-NZ 3.32Å; D64-K67 PolarHBondContact OD1-NZ 3.31Å; D64-Q68 WeakPolarHBondContact O-CG 3.35Å; D64-Q68 PolarHBondContact O-N 3.15Å; D64-Q68 VanDerWaalsContact O-N 3.08Å
65	D	90.9	Very high	93.2	Very high	21 Å²	21	53.3 Å²	53.3	11%	0.112	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-46.6	168.8	-66.5	-75	0	0	0	110.3	K54 F61 S62 K67 Q68 Y69	K54-D65 IonicContact NZ-OD1 2.59Å; K54-D65 PolarHBondContact NZ-OD1 3.25Å; K54-D65 IonicContact NZ-OD2 3.25Å; K54-D65 PolarHBondContact NZ-OD2 2.83Å; F61-D65 HydrophobicContact CB-CB 3.93Å; F61-D65 HydrophobicContact CD1-CB 4.08Å; F61-D65 HydrophobicContact CG-CB 4.46Å; S62-D65 WeakPolarHBondContact CB-OD2 3.46Å; S62-D65 PolarHBondContact N-OD2 3.25Å; S62-D65 WeakPolarHBondContact O-CB 3.37Å; S62-D65 PolarHBondContact O-N 3.34Å; S62-D65 VanDerWaalsContact O-N 3.07Å; S62-D65 PolarHBondContact OG-N 3.35Å; S62-D65 PolarHBondContact OG-OD2 2.87Å; D65-K67 VanDerWaalsContact C-N 3.29Å; D65-K67 PolarHBondContact O-N 2.98Å; D65-Q68 WeakPolarHBondContact O-CB 3.35Å; D65-Q68 PolarHBondContact O-N 3.46Å; D65-Y69 HydrophobicContact CB-CD2 4.27Å; D65-Y69 HydrophobicContact CB-CE2 4.35Å; D65-Y69 WeakPolarHBondContact O-CD2 3.26Å; D65-Y69 PolarHBondContact O-N 3.09Å
66	V	91.6	Very high	93.4	Very high	24 Å²	24	52.9 Å²	52.9	15%	0.145	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-42.7	178.7	175.4	0	0	0	0	111.3	S62 D64 Q68 Y69 K70 Q169 P170 I175	S62-V66 WeakPolarHBondContact O-CG2 3.36Å; S62-V66 PolarHBondContact O-N 3.41Å; D64-V66 VanDerWaalsContact C-N 3.32Å; D64-V66 PolarHBondContact O-N 2.97Å; V66-Q68 VanDerWaalsContact C-N 3.34Å; V66-Q68 PolarHBondContact O-N 3.19Å; V66-Y69 PolarHBondContact O-N 3.21Å; V66-K70 VanDerWaalsContact O-CB 3.32Å; V66-K70 WeakPolarHBondContact O-CB 3.39Å; V66-K70 PolarHBondContact O-N 3.12Å; V66-Q169 HydrophobicContact CG1-CB 4.21Å; V66-P170 HydrophobicContact CG1-CG 4.29Å; V66-I175 HydrophobicContact CG2-CD1 4.3Å
67	K	93.6	Very high	93.8	Very high	141 Å²	141	51.3 Å²	51.3	61%	0.613	28%	0.278	S	S	*	.	H	α-helix	trans	-63.5	-37.7	175.4	-69.1	170.6	-162.6	156.8	0	112.5	G63 D64 D65 P71	G63-K67 WeakPolarHBondContact O-CG 3.5Å; G63-K67 PolarHBondContact O-N 2.83Å; D64-K67 PolarHBondContact O-N 3.47Å; D64-K67 IonicContact OD1-NZ 3.32Å; D64-K67 PolarHBondContact OD1-NZ 3.31Å; D65-K67 VanDerWaalsContact C-N 3.29Å; D65-K67 PolarHBondContact O-N 2.98Å; K67-P71 WeakPolarHBondContact O-CD 3.48Å
68	Q	95.4	Very high	94.2	Very high	133 Å²	133	49.6 Å²	49.6	62%	0.621	27%	0.27	S	S	*	.	H	α-helix	trans	-72.4	-38.1	179.3	-70.5	177.8	11.2	0	0	112.5	D64 D65 V66	D64-Q68 WeakPolarHBondContact O-CG 3.35Å; D64-Q68 PolarHBondContact O-N 3.15Å; D64-Q68 VanDerWaalsContact O-N 3.08Å; D65-Q68 WeakPolarHBondContact O-CB 3.35Å; D65-Q68 PolarHBondContact O-N 3.46Å; V66-Q68 VanDerWaalsContact C-N 3.34Å; V66-Q68 PolarHBondContact O-N 3.19Å
69	Y	97	Very high	94.8	Very high	49 Å²	49	49.1 Å²	49.1	19%	0.192	27%	0.267	C	S	.	.	H	α-helix	trans	-83.3	-22.3	-178.4	-75.4	-70.7	0	0	0	113.8	F61 D65 V66 V72 V73 I175 T178	F61-Y69 HydrophobicContact CD1-CE2 4.32Å; F61-Y69 HydrophobicContact CE1-CE2 4.29Å; D65-Y69 HydrophobicContact CB-CD2 4.27Å; D65-Y69 HydrophobicContact CB-CE2 4.35Å; D65-Y69 WeakPolarHBondContact O-CD2 3.26Å; D65-Y69 PolarHBondContact O-N 3.09Å; V66-Y69 PolarHBondContact O-N 3.21Å; Y69-V72 WeakPolarHBondContact O-CA 3.35Å; Y69-V72 WeakPolarHBondContact O-CB 3.32Å; Y69-V72 PolarHBondContact O-N 2.89Å; Y69-V73 PolarHBondContact O-N 2.87Å; Y69-I175 HydrophobicContact CD1-CG2 4.02Å; Y69-I175 HydrophobicContact CD2-CB 4.46Å; Y69-I175 HydrophobicContact CD2-CD1 4.2Å; Y69-I175 HydrophobicContact CD2-CG1 4.14Å; Y69-I175 HydrophobicContact CD2-CG2 3.54Å; Y69-I175 HydrophobicContact CE1-CG2 4.11Å; Y69-I175 HydrophobicContact CE2-CG2 3.67Å; Y69-I175 HydrophobicContact CG-CB 4.41Å; Y69-I175 HydrophobicContact CG-CG1 4.08Å; Y69-I175 HydrophobicContact CG-CG2 3.74Å; Y69-T178 HydrophobicContact CD1-CG2 4.24Å; Y69-T178 WeakPolarHBondContact CD1-OG1 3.24Å
70	K	97.4	Very high	95.3	Very high	53 Å²	53	41 Å²	41	23%	0.23	23%	0.225	C	C	.	.	H	α-helix	trans	-55.8	-50.5	179.8	-179.3	172.8	-179.8	173.3	0	113.1	V66 V72 V73 Y74 Y168 P170	V66-K70 VanDerWaalsContact O-CB 3.32Å; V66-K70 WeakPolarHBondContact O-CB 3.39Å; V66-K70 PolarHBondContact O-N 3.12Å; K70-V72 PolarHBondContact O-N 3.47Å; K70-V73 PolarHBondContact O-N 3.02Å; K70-Y74 HydrophobicContact CD-CE2 4.34Å; K70-Y74 WeakPolarHBondContact CE-OH 3.38Å; K70-Y74 HydrophobicContact CG-CD2 4.35Å; K70-Y74 HydrophobicContact CG-CE2 3.75Å; K70-Y74 PolarHBondContact O-N 2.82Å; K70-Y74 VanDerWaalsContact O-N 3.14Å; K70-Y168 VanDerWaalsContact CE-O 3.28Å; K70-Y168 WeakPolarHBondContact CE-O 3.16Å; K70-Y168 HydrophobicContact CG-CD1 4.42Å; K70-Y168 HydrophobicContact CG-CE1 4.38Å; K70-Y168 PolarHBondContact NZ-O 2.88Å; K70-P170 HydrophobicContact CB-CG 3.6Å; K70-P170 HydrophobicContact CG-CG 4.14Å
71	P	97.9	Very high	95.7	Very high	46 Å²	46	40.6 Å²	40.6	30%	0.299	22%	0.22	S	C	.	.	H	α-helix	trans	-59.9	-33.5	173.8	-23.5	33.8	0	0	0	113.6	K67 Y74 S75 T117	K67-P71 WeakPolarHBondContact O-CD 3.48Å; P71-Y74 PolarHBondContact O-N 3.12Å; P71-S75 WeakPolarHBondContact O-CB 3.48Å; P71-S75 PolarHBondContact O-N 3.15Å; P71-T117 WeakPolarHBondContact CA-O 3.45Å; P71-T117 HydrophobicContact CB-CG2 4.36Å; P71-T117 WeakPolarHBondContact CB-O 3.49Å
72	V	98	Very high	96	Very high	34 Å²	34	39.4 Å²	39.4	21%	0.206	22%	0.215	C	C	.	.	H	α-helix	trans	-68.7	-41	178.7	-176.4	0	0	0	0	111.1	Y69 K70 Y74 S75 N76 T178 V180	Y69-V72 WeakPolarHBondContact O-CA 3.35Å; Y69-V72 WeakPolarHBondContact O-CB 3.32Å; Y69-V72 PolarHBondContact O-N 2.89Å; K70-V72 PolarHBondContact O-N 3.47Å; V72-Y74 VanDerWaalsContact C-N 3.32Å; V72-S75 PolarHBondContact O-N 2.83Å; V72-N76 VanDerWaalsContact O-CB 3.24Å; V72-N76 WeakPolarHBondContact O-CB 3.47Å; V72-N76 PolarHBondContact O-N 2.92Å; V72-N76 PolarHBondContact O-ND2 3.06Å; V72-T178 HydrophobicContact CB-CG2 4.27Å; V72-T178 HydrophobicContact CG1-CG2 3.94Å; V72-V180 HydrophobicContact CG1-CG2 3.6Å; V72-V180 HydrophobicContact CG2-CG2 4.38Å
73	V	98.4	Very high	96.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-44.2	174.2	174.5	0	0	0	0	110.3	Y69 K70 S75 N76 T77 Y156 I163 Y168 P170 D174 T178	Y69-V73 PolarHBondContact O-N 2.87Å; K70-V73 PolarHBondContact O-N 3.02Å; V73-S75 PolarHBondContact O-N 3.32Å; V73-N76 PolarHBondContact O-N 2.84Å; V73-T77 WeakPolarHBondContact O-CB 3.48Å; V73-T77 PolarHBondContact O-N 2.92Å; V73-T77 PolarHBondContact O-OG1 3.45Å; V73-Y156 HydrophobicContact CB-CE1 4.45Å; V73-Y156 HydrophobicContact CG1-CD1 3.9Å; V73-Y156 HydrophobicContact CG1-CE1 3.6Å; V73-Y156 HydrophobicContact CG2-CE1 4.32Å; V73-I163 HydrophobicContact CG1-CD1 4.26Å; V73-I163 HydrophobicContact CG1-CG2 4.2Å; V73-Y168 HydrophobicContact CG1-CE1 4.39Å; V73-Y168 WeakPolarHBondContact CG1-OH 3.42Å; V73-P170 HydrophobicContact CG2-CB 4.45Å; V73-P170 HydrophobicContact CG2-CG 4.4Å; V73-D174 HydrophobicContact CG2-CB 4.03Å; V73-T178 HydrophobicContact CG2-CG2 3.48Å; V73-T178 VanDerWaalsContact CG2-CG2 3.48Å
74	Y	98.4	Very high	96.8	Very high	6 Å²	6	35.2 Å²	35.2	2%	0.024	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-51.7	176.9	-66.8	-30.3	0	0	0	112.1	K70 P71 V72 N76 T77 I78 D116 E118 P119 Y120 I163 Y168	K70-Y74 HydrophobicContact CD-CE2 4.34Å; K70-Y74 WeakPolarHBondContact CE-OH 3.38Å; K70-Y74 HydrophobicContact CG-CD2 4.35Å; K70-Y74 HydrophobicContact CG-CE2 3.75Å; K70-Y74 PolarHBondContact O-N 2.82Å; K70-Y74 VanDerWaalsContact O-N 3.14Å; P71-Y74 PolarHBondContact O-N 3.12Å; V72-Y74 VanDerWaalsContact C-N 3.32Å; Y74-N76 PolarHBondContact O-N 3.39Å; Y74-T77 PolarHBondContact O-N 3.33Å; Y74-I78 WeakPolarHBondContact O-CG1 3.5Å; Y74-I78 PolarHBondContact O-N 3.22Å; Y74-D116 CarbonylContact C-O 3.6Å; Y74-D116 WeakPolarHBondContact CB-O 3.36Å; Y74-E118 WeakPolarHBondContact CD2-O 3.28Å; Y74-P119 HydrophobicContact CE2-CB 4.2Å; Y74-P119 HydrophobicContact CE2-CG 4.06Å; Y74-Y120 WeakPolarHBondContact CA-OH 3.47Å; Y74-Y120 HydrophobicContact CD1-CD1 4.42Å; Y74-Y120 AromaticContact CD1-CE1 3.71Å; Y74-Y120 HydrophobicContact CD1-CE1 3.71Å; Y74-Y120 HydrophobicContact CD1-CE2 4.29Å; Y74-Y120 AromaticContact CD1-CZ 3.65Å; Y74-Y120 HydrophobicContact CE1-CE1 4.48Å; Y74-Y120 AromaticContact CG-CE1 3.98Å; Y74-Y120 HydrophobicContact CG-CE1 3.98Å; Y74-Y120 PolarHBondContact O-OH 3.18Å; Y74-I163 HydrophobicContact CD1-CG2 3.77Å; Y74-I163 HydrophobicContact CE1-CG2 3.74Å; Y74-I163 WeakPolarHBondContact CE1-O 3.17Å; Y74-Y168 AromaticContact CE1-CD1 3.69Å; Y74-Y168 HydrophobicContact CE1-CD1 3.69Å; Y74-Y168 AromaticContact CE1-CE1 3.9Å; Y74-Y168 HydrophobicContact CE1-CE1 3.9Å; Y74-Y168 AromaticContact CZ-CD1 3.88Å
75	S	98.2	Very high	97.1	Very high	24 Å²	24	30.9 Å²	30.9	17%	0.168	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-47.5	-180	174.4	0	0	0	0	111.1	P71 V72 V73 T77 I78 Q79 D116	P71-S75 WeakPolarHBondContact O-CB 3.48Å; P71-S75 PolarHBondContact O-N 3.15Å; V72-S75 PolarHBondContact O-N 2.83Å; V73-S75 PolarHBondContact O-N 3.32Å; S75-T77 VanDerWaalsContact C-N 3.26Å; S75-T77 PolarHBondContact O-N 2.79Å; S75-I78 PolarHBondContact O-N 3.35Å; S75-Q79 WeakPolarHBondContact O-CB 3.49Å; S75-Q79 WeakPolarHBondContact O-CG 3.24Å; S75-Q79 PolarHBondContact O-N 3.07Å; S75-D116 WeakPolarHBondContact CA-O 3.48Å; S75-D116 VanDerWaalsContact CB-OD2 3.31Å; S75-D116 WeakPolarHBondContact CB-OD2 3.42Å; S75-D116 PolarHBondContact N-O 2.76Å; S75-D116 PolarHBondContact OG-OD2 3.41Å
76	N	98.3	Very high	97.4	Very high	18 Å²	18	35.3 Å²	35.3	10%	0.096	17%	0.171	C	C	.	.	H	α-helix	trans	-58	-37.9	178.8	-78.9	-165.6	0	0	0	113	V72 V73 Y74 S80 Y156 T178 R179	V72-N76 VanDerWaalsContact O-CB 3.24Å; V72-N76 WeakPolarHBondContact O-CB 3.47Å; V72-N76 PolarHBondContact O-N 2.92Å; V72-N76 PolarHBondContact O-ND2 3.06Å; V73-N76 PolarHBondContact O-N 2.84Å; Y74-N76 PolarHBondContact O-N 3.39Å; N76-S80 VanDerWaalsContact O-CB 3.24Å; N76-S80 WeakPolarHBondContact O-CB 3.48Å; N76-S80 PolarHBondContact O-N 3.05Å; N76-S80 PolarHBondContact O-OG 3.31Å; N76-Y156 HydrophobicContact CB-CE2 4.1Å; N76-T178 WeakPolarHBondContact OD1-CA 3.41Å; N76-R179 PolarHBondContact ND2-O 3.01Å; N76-R179 PolarHBondContact OD1-N 3.18Å; N76-R179 PolarHBondContact OD1-O 3.03Å
77	T	98.4	Very high	97.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70.1	-50.8	179.1	-51.5	0	0	0	0	111	V73 Y74 S75 S80 L81 Y120 M128 Y156 L157 L160	V73-T77 WeakPolarHBondContact O-CB 3.48Å; V73-T77 PolarHBondContact O-N 2.92Å; V73-T77 PolarHBondContact O-OG1 3.45Å; Y74-T77 PolarHBondContact O-N 3.33Å; S75-T77 VanDerWaalsContact C-N 3.26Å; S75-T77 PolarHBondContact O-N 2.79Å; T77-S80 PolarHBondContact O-N 3.21Å; T77-L81 PolarHBondContact O-N 2.87Å; T77-L81 VanDerWaalsContact O-N 3.11Å; T77-Y120 WeakPolarHBondContact CB-OH 3.5Å; T77-M128 HydrophobicContact CG2-CE 3.79Å; T77-Y156 WeakPolarHBondContact OG1-CB 3.39Å; T77-L157 HydrophobicContact CG2-CD2 4.04Å; T77-L160 HydrophobicContact CG2-CD2 3.78Å
78	I	98.2	Very high	97.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.9	-46.3	-179.6	-66.4	172.8	0	0	0	110.5	Y74 S75 S80 L81 A82 V107 V110 V111 D116 Y120 L124 M128	Y74-I78 WeakPolarHBondContact O-CG1 3.5Å; Y74-I78 PolarHBondContact O-N 3.22Å; S75-I78 PolarHBondContact O-N 3.35Å; I78-S80 VanDerWaalsContact C-N 3.3Å; I78-S80 PolarHBondContact O-N 3.29Å; I78-L81 PolarHBondContact O-N 2.85Å; I78-A82 WeakPolarHBondContact O-CB 3.44Å; I78-A82 PolarHBondContact O-N 3.29Å; I78-V107 HydrophobicContact CG2-CG1 4.16Å; I78-V110 HydrophobicContact CD1-CG1 4.16Å; I78-V111 HydrophobicContact CG2-CG2 3.44Å; I78-V111 VanDerWaalsContact CG2-CG2 3.44Å; I78-D116 HydrophobicContact CB-CB 4.12Å; I78-D116 HydrophobicContact CD1-CB 3.98Å; I78-D116 HydrophobicContact CG2-CB 3.99Å; I78-Y120 HydrophobicContact CD1-CD1 3.91Å; I78-Y120 HydrophobicContact CD1-CE1 3.45Å; I78-Y120 VanDerWaalsContact CD1-CE1 3.45Å; I78-Y120 HydrophobicContact CG1-CD1 4.47Å; I78-Y120 HydrophobicContact CG1-CE1 3.73Å; I78-L124 HydrophobicContact CD1-CD2 4.07Å; I78-M128 HydrophobicContact CB-CE 4.49Å; I78-M128 HydrophobicContact CG1-CE 3.73Å; I78-M128 HydrophobicContact CG1-SD 4.06Å
79	Q	98	Very high	97.8	Very high	65 Å²	65	27.7 Å²	27.7	30%	0.304	14%	0.141	S	C	.	.	H	α-helix	trans	-63.6	-35.6	178.9	-66.3	-74.1	-9.5	0	0	111.9	S75 A82 A83 D116	S75-Q79 WeakPolarHBondContact O-CB 3.49Å; S75-Q79 WeakPolarHBondContact O-CG 3.24Å; S75-Q79 PolarHBondContact O-N 3.07Å; Q79-A82 PolarHBondContact O-N 3.01Å; Q79-A83 WeakPolarHBondContact O-CB 3.26Å; Q79-A83 PolarHBondContact O-N 3.35Å; Q79-D116 WeakPolarHBondContact CG-OD2 3.42Å; Q79-D116 PolarHBondContact NE2-OD2 3.1Å
80	S	98.3	Very high	97.7	Very high	5 Å²	5	30 Å²	30	4%	0.035	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-45.2	174.9	-63.3	0	0	0	0	111.3	N76 T77 I78 A83 I84	N76-S80 VanDerWaalsContact O-CB 3.24Å; N76-S80 WeakPolarHBondContact O-CB 3.48Å; N76-S80 PolarHBondContact O-N 3.05Å; N76-S80 PolarHBondContact O-OG 3.31Å; T77-S80 PolarHBondContact O-N 3.21Å; I78-S80 VanDerWaalsContact C-N 3.3Å; I78-S80 PolarHBondContact O-N 3.29Å; S80-A83 PolarHBondContact O-N 2.96Å; S80-I84 WeakPolarHBondContact O-CG1 3.4Å; S80-I84 PolarHBondContact O-N 3.47Å
81	L	98.4	Very high	97.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-46.7	175.5	-173.7	58.1	0	0	0	111.3	T77 I78 A83 I84 L85 V107 M128 L131 T137 L157	T77-L81 PolarHBondContact O-N 2.87Å; T77-L81 VanDerWaalsContact O-N 3.11Å; I78-L81 PolarHBondContact O-N 2.85Å; L81-A83 VanDerWaalsContact C-N 3.27Å; L81-A83 PolarHBondContact O-N 2.91Å; L81-I84 WeakPolarHBondContact O-CB 3.27Å; L81-I84 PolarHBondContact O-N 2.88Å; L81-I84 VanDerWaalsContact O-N 3.08Å; L81-L85 HydrophobicContact CG-CD1 4.24Å; L81-L85 HydrophobicContact CG-CG 4.46Å; L81-L85 WeakPolarHBondContact O-CG 3.5Å; L81-L85 PolarHBondContact O-N 3.01Å; L81-V107 HydrophobicContact CD2-CG1 4.25Å; L81-V107 HydrophobicContact CD2-CG2 4.07Å; L81-V107 HydrophobicContact CG-CG1 4.4Å; L81-M128 HydrophobicContact CD2-CB 3.86Å; L81-M128 HydrophobicContact CD2-CE 4.37Å; L81-M128 HydrophobicContact CD2-CG 3.77Å; L81-L131 HydrophobicContact CD1-CB 4.3Å; L81-L131 HydrophobicContact CD2-CB 4.25Å; L81-L131 HydrophobicContact CD2-CD1 4.02Å; L81-T137 HydrophobicContact CD1-CG2 4.31Å; L81-L157 HydrophobicContact CB-CD2 3.94Å; L81-L157 HydrophobicContact CD1-CD2 4.42Å
82	A	98.1	Very high	97.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-36.7	177.9	0	0	0	0	0	112.7	I78 Q79 L85 R86 V107 V111	I78-A82 WeakPolarHBondContact O-CB 3.44Å; I78-A82 PolarHBondContact O-N 3.29Å; Q79-A82 PolarHBondContact O-N 3.01Å; A82-L85 PolarHBondContact O-N 3.49Å; A82-R86 WeakPolarHBondContact O-CG 3.35Å; A82-R86 PolarHBondContact O-N 3.25Å; A82-V107 HydrophobicContact CB-CG1 4.36Å; A82-V111 HydrophobicContact CB-CG2 3.95Å
83	A	97.9	Very high	97.6	Very high	22 Å²	22	32 Å²	32	18%	0.182	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-43	174.2	0	0	0	0	0	112	Q79 S80 L81 R86 A87 L149	Q79-A83 WeakPolarHBondContact O-CB 3.26Å; Q79-A83 PolarHBondContact O-N 3.35Å; S80-A83 PolarHBondContact O-N 2.96Å; L81-A83 VanDerWaalsContact C-N 3.27Å; L81-A83 PolarHBondContact O-N 2.91Å; A83-R86 PolarHBondContact O-N 3.45Å; A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 3.15Å; A83-L149 HydrophobicContact CB-CD1 4.1Å
84	I	98.5	Very high	97.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-45.6	175.1	-61.2	165	0	0	0	110.1	S80 L81 R86 A87 M88 W132 T137 C140 F141 Y147 L149 L157	S80-I84 WeakPolarHBondContact O-CG1 3.4Å; S80-I84 PolarHBondContact O-N 3.47Å; L81-I84 WeakPolarHBondContact O-CB 3.27Å; L81-I84 PolarHBondContact O-N 2.88Å; L81-I84 VanDerWaalsContact O-N 3.08Å; I84-R86 PolarHBondContact O-N 3.18Å; I84-A87 CarbonylContact O-C 3.44Å; I84-A87 WeakPolarHBondContact O-CA 3.46Å; I84-A87 WeakPolarHBondContact O-CB 3.31Å; I84-A87 PolarHBondContact O-N 2.85Å; I84-A87 VanDerWaalsContact O-N 3.1Å; I84-M88 WeakPolarHBondContact O-CG 3.39Å; I84-M88 PolarHBondContact O-N 2.81Å; I84-W132 HydrophobicContact CD1-CZ3 3.99Å; I84-T137 HydrophobicContact CG2-CG2 3.89Å; I84-C140 HydrophobicContact CG2-CB 3.97Å; I84-C140 PolarHBondContact O-SG 3.4Å; I84-F141 HydrophobicContact CD1-CB 4.46Å; I84-F141 HydrophobicContact CD1-CD2 4.01Å; I84-Y147 HydrophobicContact CG1-CE2 4.4Å; I84-L149 HydrophobicContact CD1-CD1 4.31Å; I84-L149 HydrophobicContact CD1-CD2 4.23Å; I84-L149 HydrophobicContact CG1-CD1 3.84Å; I84-L149 HydrophobicContact CG1-CD2 4.03Å; I84-L157 HydrophobicContact CD1-CD1 3.86Å
85	L	97.8	Very high	97.5	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-42.8	179.9	-62	172.6	0	0	0	112.5	L81 A82 A87 M88 D89 F95 A104 V107 L131	L81-L85 HydrophobicContact CG-CD1 4.24Å; L81-L85 HydrophobicContact CG-CG 4.46Å; L81-L85 WeakPolarHBondContact O-CG 3.5Å; L81-L85 PolarHBondContact O-N 3.01Å; A82-L85 PolarHBondContact O-N 3.49Å; L85-A87 VanDerWaalsContact C-N 3.29Å; L85-A87 PolarHBondContact O-N 3.07Å; L85-M88 HydrophobicContact CD2-SD 4.17Å; L85-M88 WeakPolarHBondContact O-CB 3.46Å; L85-M88 PolarHBondContact O-N 2.78Å; L85-D89 PolarHBondContact O-N 3.21Å; L85-F95 HydrophobicContact CD2-CE1 3.81Å; L85-F95 HydrophobicContact CD2-CZ 3.87Å; L85-A104 HydrophobicContact CD1-CB 3.99Å; L85-A104 HydrophobicContact CD2-CB 4.13Å; L85-V107 HydrophobicContact CD1-CB 4.15Å; L85-V107 HydrophobicContact CD1-CG1 4.18Å; L85-L131 HydrophobicContact CD1-CD1 4.18Å; L85-L131 HydrophobicContact CD2-CD2 3.97Å
86	R	97.2	Very high	97.4	Very high	114 Å²	114	42.2 Å²	42.2	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-64.5	-35.4	174	-68.9	174.2	-167.8	138.2	1.4	112.1	A82 A83 I84 D89 S90	A82-R86 WeakPolarHBondContact O-CG 3.35Å; A82-R86 PolarHBondContact O-N 3.25Å; A83-R86 PolarHBondContact O-N 3.45Å; I84-R86 PolarHBondContact O-N 3.18Å; R86-D89 PolarHBondContact O-N 2.81Å; R86-S90 PolarHBondContact O-N 2.65Å; R86-S90 PolarHBondContact O-OG 2.79Å
87	A	97.6	Very high	97.2	Very high	5 Å²	5	44.1 Å²	44.1	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-69.5	-33.2	175.5	0	0	0	0	0	112	A83 I84 L85 D89 S90 L91 Y147	A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 3.15Å; I84-A87 CarbonylContact O-C 3.44Å; I84-A87 WeakPolarHBondContact O-CA 3.46Å; I84-A87 WeakPolarHBondContact O-CB 3.31Å; I84-A87 PolarHBondContact O-N 2.85Å; I84-A87 VanDerWaalsContact O-N 3.1Å; L85-A87 VanDerWaalsContact C-N 3.29Å; L85-A87 PolarHBondContact O-N 3.07Å; A87-D89 VanDerWaalsContact C-N 3.33Å; A87-D89 PolarHBondContact O-N 2.76Å; A87-S90 PolarHBondContact O-N 3.43Å; A87-L91 VanDerWaalsContact O-CB 3.28Å; A87-L91 WeakPolarHBondContact O-CB 3.41Å; A87-L91 VanDerWaalsContact O-CG 3.26Å; A87-L91 WeakPolarHBondContact O-CG 3.32Å; A87-L91 PolarHBondContact O-N 3.14Å; A87-Y147 HydrophobicContact CB-CD1 3.46Å; A87-Y147 VanDerWaalsContact CB-CD1 3.46Å; A87-Y147 HydrophobicContact CB-CD2 3.66Å; A87-Y147 HydrophobicContact CB-CE1 3.55Å; A87-Y147 HydrophobicContact CB-CE2 3.75Å; A87-Y147 HydrophobicContact CB-CG 3.51Å
88	M	97.8	Very high	96.9	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-58	-46.4	172.7	-70.1	179.6	68.6	0	0	111.3	I84 L85 S90 L91 T92 I93 F95 T137 C140	I84-M88 WeakPolarHBondContact O-CG 3.39Å; I84-M88 PolarHBondContact O-N 2.81Å; L85-M88 HydrophobicContact CD2-SD 4.17Å; L85-M88 WeakPolarHBondContact O-CB 3.46Å; L85-M88 PolarHBondContact O-N 2.78Å; M88-S90 VanDerWaalsContact C-N 3.33Å; M88-S90 PolarHBondContact O-N 3.22Å; M88-L91 PolarHBondContact O-N 3.1Å; M88-T92 WeakPolarHBondContact O-CA 3.48Å; M88-T92 PolarHBondContact O-N 3.32Å; M88-I93 HydrophobicContact CB-CB 4.4Å; M88-I93 HydrophobicContact CE-CG2 4.2Å; M88-I93 HydrophobicContact CG-CB 4.47Å; M88-I93 PolarHBondContact O-N 2.88Å; M88-F95 HydrophobicContact CE-CD1 3.51Å; M88-F95 HydrophobicContact CE-CE1 3.55Å; M88-F95 HydrophobicContact CE-CG 4.05Å; M88-F95 HydrophobicContact CE-CZ 4.11Å; M88-F95 HydrophobicContact SD-CD1 4.2Å; M88-F95 HydrophobicContact SD-CE1 3.66Å; M88-F95 HydrophobicContact SD-CZ 4.18Å; M88-T137 PolarHBondContact SD-OG1 2.93Å; M88-T137 VanDerWaalsContact SD-OG1 3.41Å; M88-C140 HydrophobicContact CG-CB 3.44Å; M88-C140 VanDerWaalsContact CG-CB 3.44Å; M88-C140 VanDerWaalsContact CG-SG 3.57Å; M88-C140 PolarHBondContact N-SG 3.41Å; M88-C140 HydrophobicContact SD-CB 4.41Å
89	D	94.5	Very high	96.5	Very high	131 Å²	131	57 Å²	57	70%	0.701	31%	0.31	S	S	*	.	H	α-helix	trans	-60.4	-43.6	175.9	-69.6	-29.2	0	0	0	111.5	L85 R86 A87 T92	L85-D89 PolarHBondContact O-N 3.21Å; R86-D89 PolarHBondContact O-N 2.81Å; A87-D89 VanDerWaalsContact C-N 3.33Å; A87-D89 PolarHBondContact O-N 2.76Å; D89-T92 PolarHBondContact O-N 2.91Å
90	S	95	Very high	96.5	Very high	99 Å²	99	55.7 Å²	55.7	69%	0.692	30%	0.302	S	S	*	.	H	α-helix	trans	-70	-36.4	-177.5	-53.4	0	0	0	0	113.1	R86 A87 M88 T92	R86-S90 PolarHBondContact O-N 2.65Å; R86-S90 PolarHBondContact O-OG 2.79Å; A87-S90 PolarHBondContact O-N 3.43Å; M88-S90 VanDerWaalsContact C-N 3.33Å; M88-S90 PolarHBondContact O-N 3.22Å; S90-T92 VanDerWaalsContact C-N 3.31Å
91	L	96.8	Very high	96.3	Very high	34 Å²	34	62 Å²	62	18%	0.178	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	4.3	178.9	-60.6	179.7	0	0	0	112.5	A87 M88 I93 R143 E146 Y147	A87-L91 VanDerWaalsContact O-CB 3.28Å; A87-L91 WeakPolarHBondContact O-CB 3.41Å; A87-L91 VanDerWaalsContact O-CG 3.26Å; A87-L91 WeakPolarHBondContact O-CG 3.32Å; A87-L91 PolarHBondContact O-N 3.14Å; M88-L91 PolarHBondContact O-N 3.1Å; L91-I93 VanDerWaalsContact C-N 3.29Å; L91-I93 HydrophobicContact CB-CD1 3.89Å; L91-I93 HydrophobicContact CB-CG1 3.95Å; L91-I93 HydrophobicContact CD1-CD1 4.18Å; L91-I93 PolarHBondContact O-N 2.85Å; L91-R143 HydrophobicContact CD1-CB 4.26Å; L91-E146 HydrophobicContact CD1-CB 4.49Å; L91-E146 HydrophobicContact CD2-CB 4.42Å; L91-E146 WeakPolarHBondContact CD2-OE2 3.37Å; L91-Y147 HydrophobicContact CD1-CD1 4.12Å; L91-Y147 HydrophobicContact CD1-CE1 4.18Å
92	T	96.9	Very high	96.2	Very high	125 Å²	125	65.2 Å²	65.2	77%	0.767	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	45.8	-177.4	64.1	0	0	0	0	113.2	M88 D89 S90	M88-T92 WeakPolarHBondContact O-CA 3.48Å; M88-T92 PolarHBondContact O-N 3.32Å; D89-T92 PolarHBondContact O-N 2.91Å; S90-T92 VanDerWaalsContact C-N 3.31Å
93	I	97.4	Very high	96.2	Very high	16 Å²	16	66 Å²	66	8%	0.082	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-95.1	120.9	176.6	-58.8	172.1	0	0	0	107.7	M88 L91 G136 E139 C140	M88-I93 HydrophobicContact CB-CB 4.4Å; M88-I93 HydrophobicContact CE-CG2 4.2Å; M88-I93 HydrophobicContact CG-CB 4.47Å; M88-I93 PolarHBondContact O-N 2.88Å; L91-I93 VanDerWaalsContact C-N 3.29Å; L91-I93 HydrophobicContact CB-CD1 3.89Å; L91-I93 HydrophobicContact CB-CG1 3.95Å; L91-I93 HydrophobicContact CD1-CD1 4.18Å; L91-I93 PolarHBondContact O-N 2.85Å; I93-G136 WeakPolarHBondContact CG2-O 3.5Å; I93-E139 HydrophobicContact CG2-CB 4.45Å; I93-C140 HydrophobicContact CD1-CB 3.7Å
94	E	97.2	Very high	96.2	Very high	154 Å²	154	65.5 Å²	65.5	72%	0.72	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-80.3	151	175.6	-61.9	-162.2	157.8	0	0	111.3	G136	E94-G136 WeakPolarHBondContact O-CA 3.32Å
95	F	97.9	Very high	96.1	Very high	32 Å²	32	72.1 Å²	72.1	14%	0.14	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-63.8	146	167.8	-65.4	-72.7	0	0	0	110.7	L85 M88 D97 R100 K101 A104 L131 D134	L85-F95 HydrophobicContact CD2-CE1 3.81Å; L85-F95 HydrophobicContact CD2-CZ 3.87Å; M88-F95 HydrophobicContact CE-CD1 3.51Å; M88-F95 HydrophobicContact CE-CE1 3.55Å; M88-F95 HydrophobicContact CE-CG 4.05Å; M88-F95 HydrophobicContact CE-CZ 4.11Å; M88-F95 HydrophobicContact SD-CD1 4.2Å; M88-F95 HydrophobicContact SD-CE1 3.66Å; M88-F95 HydrophobicContact SD-CZ 4.18Å; F95-D97 VanDerWaalsContact C-N 3.28Å; F95-D97 VanDerWaalsContact CB-O 3.26Å; F95-D97 WeakPolarHBondContact CB-O 3.31Å; F95-R100 HydrophobicContact CB-CB 4.15Å; F95-R100 HydrophobicContact CD1-CB 3.74Å; F95-R100 HydrophobicContact CD1-CG 4.47Å; F95-R100 HydrophobicContact CD2-CB 4.32Å; F95-R100 HydrophobicContact CE1-CB 4.23Å; F95-R100 HydrophobicContact CG-CB 3.81Å; F95-K101 HydrophobicContact CD2-CG 3.9Å; F95-K101 HydrophobicContact CE2-CG 4.05Å; F95-A104 HydrophobicContact CE2-CB 4.28Å; F95-A104 HydrophobicContact CZ-CB 3.74Å; F95-L131 HydrophobicContact CE1-CD2 3.86Å; F95-L131 HydrophobicContact CZ-CD2 4.35Å; F95-D134 WeakPolarHBondContact CA-OD1 3.48Å
96	G	95.8	Very high	96.1	Very high	58 Å²	58	73.9 Å²	73.9	60%	0.598	39%	0.394	S	S	*	.	S	Bend	trans	-64.7	-36.8	169.7	0	0	0	0	0	111.7	D134	G96-D134 WeakPolarHBondContact CA-OD2 3.28Å; G96-D134 PolarHBondContact N-OD1 3.39Å; G96-D134 PolarHBondContact N-OD2 3.03Å
97	D	93.7	Very high	96.1	Very high	58 Å²	58	68.4 Å²	68.4	31%	0.31	37%	0.374	S	S	.	.	S	Bend	trans	-113.6	120	172.9	177.6	1.9	0	0	0	111.2	F95 D99 R100 D134	F95-D97 VanDerWaalsContact C-N 3.28Å; F95-D97 VanDerWaalsContact CB-O 3.26Å; F95-D97 WeakPolarHBondContact CB-O 3.31Å; D97-D99 PolarHBondContact O-N 3.47Å; D97-D99 WeakPolarHBondContact OD1-CB 3.21Å; D97-D99 PolarHBondContact OD1-N 2.78Å; D97-R100 HydrophobicContact CB-CG 4Å; D97-R100 VanDerWaalsContact O-CB 3.22Å; D97-R100 WeakPolarHBondContact O-CB 3.41Å; D97-R100 VanDerWaalsContact O-CG 3.31Å; D97-R100 WeakPolarHBondContact O-CG 3.22Å; D97-R100 PolarHBondContact O-N 3.41Å; D97-R100 IonicContact OD2-CZ 2.83Å; D97-R100 VanDerWaalsContact OD2-CZ 3.25Å; D97-R100 IonicContact OD2-NH1 3.59Å; D97-R100 PolarHBondContact OD2-NH1 2.92Å; D97-R100 IonicContact OD2-NH2 2.79Å; D97-R100 PolarHBondContact OD2-NH2 3.26Å; D97-D134 PolarHBondContact N-OD2 3.38Å
98	K	90.9	Very high	96.1	Very high	154 Å²	154	69.8 Å²	69.8	67%	0.67	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.7	-177.9	-68.9	-176	179	179.2	0	113.2	R100 K101	K98-R100 PolarHBondContact O-N 3.27Å; K98-K101 PolarHBondContact O-N 2.77Å
99	D	91.5	Very high	96	Very high	116 Å²	116	72.3 Å²	72.3	62%	0.62	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.3	177.6	-67.6	-15.7	0	0	0	111.9	D97 K101 A102	D97-D99 PolarHBondContact O-N 3.47Å; D97-D99 WeakPolarHBondContact OD1-CB 3.21Å; D97-D99 PolarHBondContact OD1-N 2.78Å; D99-K101 PolarHBondContact O-N 3.36Å; D99-A102 PolarHBondContact O-N 3.5Å
100	R	96.5	Very high	96.2	Very high	37 Å²	37	66.9 Å²	66.9	14%	0.14	37%	0.368	C	S	.	.	H	α-helix	trans	-64.9	-16.3	174.9	-63.5	-63.2	86.3	80.2	14.7	113.8	F95 D97 K98 A102 D103 A104 L131 D134	F95-R100 HydrophobicContact CB-CB 4.15Å; F95-R100 HydrophobicContact CD1-CB 3.74Å; F95-R100 HydrophobicContact CD1-CG 4.47Å; F95-R100 HydrophobicContact CD2-CB 4.32Å; F95-R100 HydrophobicContact CE1-CB 4.23Å; F95-R100 HydrophobicContact CG-CB 3.81Å; D97-R100 HydrophobicContact CB-CG 4Å; D97-R100 VanDerWaalsContact O-CB 3.22Å; D97-R100 WeakPolarHBondContact O-CB 3.41Å; D97-R100 VanDerWaalsContact O-CG 3.31Å; D97-R100 WeakPolarHBondContact O-CG 3.22Å; D97-R100 PolarHBondContact O-N 3.41Å; D97-R100 IonicContact OD2-CZ 2.83Å; D97-R100 VanDerWaalsContact OD2-CZ 3.25Å; D97-R100 IonicContact OD2-NH1 3.59Å; D97-R100 PolarHBondContact OD2-NH1 2.92Å; D97-R100 IonicContact OD2-NH2 2.79Å; D97-R100 PolarHBondContact OD2-NH2 3.26Å; K98-R100 PolarHBondContact O-N 3.27Å; R100-A102 PolarHBondContact O-N 3.03Å; R100-D103 IonicContact CZ-OD2 2.94Å; R100-D103 IonicContact NE-OD2 2.6Å; R100-D103 PolarHBondContact NE-OD2 3.27Å; R100-D103 IonicContact NH2-OD2 3.55Å; R100-D103 WeakPolarHBondContact O-CB 3.02Å; R100-D103 PolarHBondContact O-N 2.83Å; R100-D103 VanDerWaalsContact O-N 3.15Å; R100-A104 WeakPolarHBondContact O-CB 3.44Å; R100-A104 PolarHBondContact O-N 3.29Å; R100-L131 HydrophobicContact CB-CD2 3.97Å; R100-D134 HydrophobicContact CG-CB 4.31Å
101	K	94.9	Very high	96.2	Very high	137 Å²	137	62.9 Å²	62.9	60%	0.596	34%	0.339	S	S	*	.	H	α-helix	trans	-59.1	-36	174.6	-70	-174.3	178.8	-172.1	0	112.7	F95 K98 D99 K105	F95-K101 HydrophobicContact CD2-CG 3.9Å; F95-K101 HydrophobicContact CE2-CG 4.05Å; K98-K101 PolarHBondContact O-N 2.77Å; D99-K101 PolarHBondContact O-N 3.36Å; K101-K105 PolarHBondContact O-N 2.9Å; K101-K105 VanDerWaalsContact O-N 3.13Å
102	A	96.3	Very high	96.2	Very high	69 Å²	69	65.7 Å²	65.7	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-69	-42.7	176.1	0	0	0	0	0	111.4	D99 R100 K105 L106	D99-A102 PolarHBondContact O-N 3.5Å; R100-A102 PolarHBondContact O-N 3.03Å; A102-K105 PolarHBondContact O-N 2.99Å; A102-L106 PolarHBondContact O-N 3.38Å
103	D	97.9	Very high	96.1	Very high	16 Å²	16	67.3 Å²	67.3	9%	0.086	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-44.4	176	-68.3	-29.9	0	0	0	111.3	R100 K105 L106 V107 A127 R130 L131	R100-D103 IonicContact CZ-OD2 2.94Å; R100-D103 IonicContact NE-OD2 2.6Å; R100-D103 PolarHBondContact NE-OD2 3.27Å; R100-D103 IonicContact NH2-OD2 3.55Å; R100-D103 WeakPolarHBondContact O-CB 3.02Å; R100-D103 PolarHBondContact O-N 2.83Å; R100-D103 VanDerWaalsContact O-N 3.15Å; D103-K105 VanDerWaalsContact C-N 3.32Å; D103-K105 PolarHBondContact O-N 2.8Å; D103-L106 WeakPolarHBondContact O-CB 3.28Å; D103-L106 PolarHBondContact O-N 2.79Å; D103-V107 PolarHBondContact O-N 2.72Å; D103-V107 VanDerWaalsContact O-N 3.11Å; D103-A127 HydrophobicContact CB-CB 3.8Å; D103-A127 WeakPolarHBondContact OD1-CB 3.45Å; D103-R130 IonicContact OD1-CZ 2.71Å; D103-R130 IonicContact OD1-NE 3.45Å; D103-R130 IonicContact OD1-NH2 2.59Å; D103-R130 PolarHBondContact OD1-NH2 3.12Å; D103-R130 IonicContact OD2-CZ 2.62Å; D103-R130 IonicContact OD2-NE 2.86Å; D103-R130 PolarHBondContact OD2-NE 3Å; D103-R130 IonicContact OD2-NH2 3.73Å; D103-L131 HydrophobicContact CB-CD1 3.88Å; D103-L131 HydrophobicContact CB-CD2 3.95Å; D103-L131 HydrophobicContact CB-CG 3.74Å
104	A	97.6	Very high	96	Very high	12 Å²	12	73.8 Å²	73.8	10%	0.099	39%	0.385	C	S	.	.	H	α-helix	trans	-61.5	-41.5	178.2	0	0	0	0	0	111.6	L85 F95 R100 L106 V107 C108 L131	L85-A104 HydrophobicContact CD1-CB 3.99Å; L85-A104 HydrophobicContact CD2-CB 4.13Å; F95-A104 HydrophobicContact CE2-CB 4.28Å; F95-A104 HydrophobicContact CZ-CB 3.74Å; R100-A104 WeakPolarHBondContact O-CB 3.44Å; R100-A104 PolarHBondContact O-N 3.29Å; A104-L106 PolarHBondContact O-N 2.63Å; A104-V107 PolarHBondContact O-N 2.6Å; A104-C108 WeakPolarHBondContact O-CB 3.49Å; A104-C108 PolarHBondContact O-N 3.29Å; A104-C108 PolarHBondContact O-SG 3.02Å; A104-C108 VanDerWaalsContact O-SG 3.39Å; A104-L131 HydrophobicContact CB-CD2 4.05Å
105	K	96.9	Very high	96	Very high	139 Å²	139	71 Å²	71	60%	0.604	37%	0.372	S	S	*	.	H	α-helix	trans	-60.7	-44.1	174.6	-178.7	171.2	179.9	167.4	0	111.7	K101 A102 D103 V107 C108 D109	K101-K105 PolarHBondContact O-N 2.9Å; K101-K105 VanDerWaalsContact O-N 3.13Å; A102-K105 PolarHBondContact O-N 2.99Å; D103-K105 VanDerWaalsContact C-N 3.32Å; D103-K105 PolarHBondContact O-N 2.8Å; K105-V107 PolarHBondContact O-N 2.9Å; K105-C108 PolarHBondContact O-N 3.44Å; K105-D109 WeakPolarHBondContact O-CB 3.36Å; K105-D109 VanDerWaalsContact O-CG 3.25Å; K105-D109 PolarHBondContact O-N 2.73Å
106	L	97.8	Very high	95.8	Very high	43 Å²	43	70 Å²	70	23%	0.225	37%	0.368	C	S	.	.	H	α-helix	trans	-58.1	-47.4	177.4	177.5	63.2	0	0	0	111.8	A102 D103 A104 C108 D109 V110 E123 L124 A127	A102-L106 PolarHBondContact O-N 3.38Å; D103-L106 WeakPolarHBondContact O-CB 3.28Å; D103-L106 PolarHBondContact O-N 2.79Å; A104-L106 PolarHBondContact O-N 2.63Å; L106-C108 PolarHBondContact O-N 2.63Å; L106-D109 PolarHBondContact O-N 3.14Å; L106-V110 WeakPolarHBondContact O-CG2 3.5Å; L106-V110 PolarHBondContact O-N 3.49Å; L106-V110 VanDerWaalsContact O-N 3.11Å; L106-E123 HydrophobicContact CD2-CG 3.88Å; L106-L124 HydrophobicContact CG-CD1 4.28Å; L106-A127 HydrophobicContact CD2-CB 3.93Å
107	V	97.8	Very high	95.9	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-61.7	-45	177.7	176.8	0	0	0	0	111.2	I78 L81 A82 L85 D103 A104 K105 D109 V110 V111 L124 M128 L131	I78-V107 HydrophobicContact CG2-CG1 4.16Å; L81-V107 HydrophobicContact CD2-CG1 4.25Å; L81-V107 HydrophobicContact CD2-CG2 4.07Å; L81-V107 HydrophobicContact CG-CG1 4.4Å; A82-V107 HydrophobicContact CB-CG1 4.36Å; L85-V107 HydrophobicContact CD1-CB 4.15Å; L85-V107 HydrophobicContact CD1-CG1 4.18Å; D103-V107 PolarHBondContact O-N 2.72Å; D103-V107 VanDerWaalsContact O-N 3.11Å; A104-V107 PolarHBondContact O-N 2.6Å; K105-V107 PolarHBondContact O-N 2.9Å; V107-D109 VanDerWaalsContact C-N 3.34Å; V107-D109 PolarHBondContact O-N 2.87Å; V107-V110 PolarHBondContact O-N 3.09Å; V107-V111 PolarHBondContact O-N 3.21Å; V107-L124 HydrophobicContact CG2-CD1 4.05Å; V107-M128 HydrophobicContact CG2-CG 3.97Å; V107-L131 HydrophobicContact CB-CD1 4.49Å; V107-L131 HydrophobicContact CG2-CD1 3.6Å
108	C	96.6	Very high	96	Very high	34 Å²	34	72.4 Å²	72.4	23%	0.23	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-35.7	178.1	-73.4	0	0	0	0	112.9	A104 K105 L106 V111 S112	A104-C108 WeakPolarHBondContact O-CB 3.49Å; A104-C108 PolarHBondContact O-N 3.29Å; A104-C108 PolarHBondContact O-SG 3.02Å; A104-C108 VanDerWaalsContact O-SG 3.39Å; K105-C108 PolarHBondContact O-N 3.44Å; L106-C108 PolarHBondContact O-N 2.63Å; C108-V111 PolarHBondContact O-N 2.8Å; C108-S112 WeakPolarHBondContact O-CB 3.26Å; C108-S112 PolarHBondContact O-N 2.77Å; C108-S112 PolarHBondContact O-OG 3.42Å
109	D	96.9	Very high	96.2	Very high	55 Å²	55	69 Å²	69	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-66.9	-42.2	177.7	-76.8	-10.7	0	0	0	111.1	K105 L106 V107 V111 S112 R113	K105-D109 WeakPolarHBondContact O-CB 3.36Å; K105-D109 VanDerWaalsContact O-CG 3.25Å; K105-D109 PolarHBondContact O-N 2.73Å; L106-D109 PolarHBondContact O-N 3.14Å; V107-D109 VanDerWaalsContact C-N 3.34Å; V107-D109 PolarHBondContact O-N 2.87Å; D109-V111 PolarHBondContact O-N 3.4Å; D109-S112 PolarHBondContact O-N 3.43Å; D109-R113 WeakPolarHBondContact O-CB 3.36Å; D109-R113 VanDerWaalsContact O-CG 3.29Å; D109-R113 WeakPolarHBondContact O-CG 3.41Å; D109-R113 PolarHBondContact O-N 3.3Å
110	V	97.2	Very high	96.4	Very high	16 Å²	16	64.3 Å²	64.3	10%	0.097	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-46.9	175.2	170	0	0	0	0	111.2	I78 L106 V107 S112 R113 M114 E115 D116 L124	I78-V110 HydrophobicContact CD1-CG1 4.16Å; L106-V110 WeakPolarHBondContact O-CG2 3.5Å; L106-V110 PolarHBondContact O-N 3.49Å; L106-V110 VanDerWaalsContact O-N 3.11Å; V107-V110 PolarHBondContact O-N 3.09Å; V110-S112 VanDerWaalsContact C-N 3.34Å; V110-S112 PolarHBondContact O-N 3.28Å; V110-R113 PolarHBondContact O-N 3.27Å; V110-M114 PolarHBondContact O-N 3.02Å; V110-E115 HydrophobicContact CG1-CB 4.12Å; V110-E115 PolarHBondContact O-N 2.83Å; V110-E115 VanDerWaalsContact O-N 3.08Å; V110-D116 HydrophobicContact CG1-CB 4.39Å; V110-L124 HydrophobicContact CG1-CD2 4.25Å; V110-L124 HydrophobicContact CG2-CD1 4.1Å; V110-L124 HydrophobicContact CG2-CD2 4.1Å
111	V	96.1	Very high	96.5	Very high	15 Å²	15	65.6 Å²	65.6	9%	0.091	35%	0.348	C	S	.	.	H	α-helix	trans	-61.5	-43.3	175.9	171.3	0	0	0	0	111.4	I78 A82 V107 C108 D109 R113 M114	I78-V111 HydrophobicContact CG2-CG2 3.44Å; I78-V111 VanDerWaalsContact CG2-CG2 3.44Å; A82-V111 HydrophobicContact CB-CG2 3.95Å; V107-V111 PolarHBondContact O-N 3.21Å; C108-V111 PolarHBondContact O-N 2.8Å; D109-V111 PolarHBondContact O-N 3.4Å; V111-R113 PolarHBondContact O-N 3Å; V111-M114 PolarHBondContact O-N 3.19Å; V111-M114 VanDerWaalsContact O-N 3.09Å
112	S	95.9	Very high	96.6	Very high	93 Å²	93	63.3 Å²	63.3	65%	0.65	35%	0.354	S	S	*	.	H	α-helix	trans	-67.5	-27	-178.3	-57.5	0	0	0	0	112.7	C108 D109 V110 M114	C108-S112 WeakPolarHBondContact O-CB 3.26Å; C108-S112 PolarHBondContact O-N 2.77Å; C108-S112 PolarHBondContact O-OG 3.42Å; D109-S112 PolarHBondContact O-N 3.43Å; V110-S112 VanDerWaalsContact C-N 3.34Å; V110-S112 PolarHBondContact O-N 3.28Å; S112-M114 VanDerWaalsContact C-N 3.34Å
113	R	96.3	Very high	96.6	Very high	159 Å²	159	66.4 Å²	66.4	60%	0.6	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.5	174.3	-67.1	175.2	-168.4	177.3	6.8	113.7	D109 V110 V111 E115	D109-R113 WeakPolarHBondContact O-CB 3.36Å; D109-R113 VanDerWaalsContact O-CG 3.29Å; D109-R113 WeakPolarHBondContact O-CG 3.41Å; D109-R113 PolarHBondContact O-N 3.3Å; V110-R113 PolarHBondContact O-N 3.27Å; V111-R113 PolarHBondContact O-N 3Å; R113-E115 HydrophobicContact CB-CB 4.47Å; R113-E115 HydrophobicContact CB-CG 3.88Å; R113-E115 PolarHBondContact O-N 3.3Å
114	M	94.8	Very high	96.6	Very high	153 Å²	153	66 Å²	66	75%	0.754	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	33.1	-174.7	-50.9	-177.5	66.1	0	0	112.8	V110 V111 S112 D116	V110-M114 PolarHBondContact O-N 3.02Å; V111-M114 PolarHBondContact O-N 3.19Å; V111-M114 VanDerWaalsContact O-N 3.09Å; S112-M114 VanDerWaalsContact C-N 3.34Å; M114-D116 VanDerWaalsContact C-N 3.32Å
115	E	96.1	Very high	96.7	Very high	95 Å²	95	66.9 Å²	66.9	44%	0.444	36%	0.358	S	S	.	.			trans	-95.9	11.3	177.7	-68.8	171.3	177.5	0	0	111.2	V110 R113 T117 E118	V110-E115 HydrophobicContact CG1-CB 4.12Å; V110-E115 PolarHBondContact O-N 2.83Å; V110-E115 VanDerWaalsContact O-N 3.08Å; R113-E115 HydrophobicContact CB-CB 4.47Å; R113-E115 HydrophobicContact CB-CG 3.88Å; R113-E115 PolarHBondContact O-N 3.3Å; E115-T117 PolarHBondContact O-N 3.17Å; E115-E118 PolarHBondContact O-N 3.44Å
116	D	95.4	Very high	96.7	Very high	11 Å²	11	61.9 Å²	61.9	6%	0.059	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.9	-175.6	61.9	-56.4	0	0	0	114	Y74 S75 I78 Q79 V110 M114	Y74-D116 CarbonylContact C-O 3.6Å; Y74-D116 WeakPolarHBondContact CB-O 3.36Å; S75-D116 WeakPolarHBondContact CA-O 3.48Å; S75-D116 VanDerWaalsContact CB-OD2 3.31Å; S75-D116 WeakPolarHBondContact CB-OD2 3.42Å; S75-D116 PolarHBondContact N-O 2.76Å; S75-D116 PolarHBondContact OG-OD2 3.41Å; I78-D116 HydrophobicContact CB-CB 4.12Å; I78-D116 HydrophobicContact CD1-CB 3.98Å; I78-D116 HydrophobicContact CG2-CB 3.99Å; Q79-D116 WeakPolarHBondContact CG-OD2 3.42Å; Q79-D116 PolarHBondContact NE2-OD2 3.1Å; V110-D116 HydrophobicContact CG1-CB 4.39Å; M114-D116 VanDerWaalsContact C-N 3.32Å
117	T	96.6	Very high	96.8	Very high	54 Å²	54	59.9 Å²	59.9	33%	0.331	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-7	174.7	52.7	0	0	0	0	113.8	P71 E115	P71-T117 WeakPolarHBondContact CA-O 3.45Å; P71-T117 HydrophobicContact CB-CG2 4.36Å; P71-T117 WeakPolarHBondContact CB-O 3.49Å; E115-T117 PolarHBondContact O-N 3.17Å
118	E	95.4	Very high	96.8	Very high	113 Å²	113	59.9 Å²	59.9	53%	0.528	33%	0.332	S	S	.	.	S	Bend	trans	-91.3	157.8	-175.9	-61.8	-53.7	130.6	0	0	112.5	Y74 E115	Y74-E118 WeakPolarHBondContact CD2-O 3.28Å; E115-E118 PolarHBondContact O-N 3.44Å
119	P	96	Very high	96.9	Very high	81 Å²	81	62.1 Å²	62.1	53%	0.526	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-55.2	141.9	170.5	-22.5	32.9	0	0	0	111.9	Y74 S121	Y74-P119 HydrophobicContact CE2-CB 4.2Å; Y74-P119 HydrophobicContact CE2-CG 4.06Å; P119-S121 PolarHBondContact O-N 2.84Å
120	Y	96.6	Very high	97	Very high	19 Å²	19	63.9 Å²	63.9	8%	0.075	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-68.3	132.7	-176.7	-52	-26	0	0	0	111.4	Y74 T77 I78 L124 L125 M128 L160 I163	Y74-Y120 WeakPolarHBondContact CA-OH 3.47Å; Y74-Y120 HydrophobicContact CD1-CD1 4.42Å; Y74-Y120 AromaticContact CD1-CE1 3.71Å; Y74-Y120 HydrophobicContact CD1-CE1 3.71Å; Y74-Y120 HydrophobicContact CD1-CE2 4.29Å; Y74-Y120 AromaticContact CD1-CZ 3.65Å; Y74-Y120 HydrophobicContact CE1-CE1 4.48Å; Y74-Y120 AromaticContact CG-CE1 3.98Å; Y74-Y120 HydrophobicContact CG-CE1 3.98Å; Y74-Y120 PolarHBondContact O-OH 3.18Å; T77-Y120 WeakPolarHBondContact CB-OH 3.5Å; I78-Y120 HydrophobicContact CD1-CD1 3.91Å; I78-Y120 HydrophobicContact CD1-CE1 3.45Å; I78-Y120 VanDerWaalsContact CD1-CE1 3.45Å; I78-Y120 HydrophobicContact CG1-CD1 4.47Å; I78-Y120 HydrophobicContact CG1-CE1 3.73Å; Y120-L124 HydrophobicContact CD1-CD2 4.14Å; Y120-L125 HydrophobicContact CD2-CD1 4.22Å; Y120-M128 HydrophobicContact CD2-SD 4.39Å; Y120-M128 HydrophobicContact CE2-CE 4.39Å; Y120-M128 HydrophobicContact CE2-SD 4.34Å; Y120-L160 HydrophobicContact CE2-CD2 4.4Å; Y120-I163 HydrophobicContact CE2-CB 4.5Å; Y120-I163 HydrophobicContact CE2-CG2 3.74Å
121	S	96.8	Very high	97.1	Very high	64 Å²	64	63.1 Å²	63.1	45%	0.448	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-65.1	154.3	164.2	75	0	0	0	0	109.7	P119 E123 L124 L125	P119-S121 PolarHBondContact O-N 2.84Å; S121-E123 PolarHBondContact O-N 2.7Å; S121-L124 PolarHBondContact O-N 3.33Å; S121-L124 VanDerWaalsContact O-N 3.17Å; S121-L124 VanDerWaalsContact OG-CB 3.31Å; S121-L124 WeakPolarHBondContact OG-CB 3.4Å; S121-L124 PolarHBondContact OG-N 3.07Å; S121-L124 VanDerWaalsContact OG-N 3.07Å; S121-L125 WeakPolarHBondContact O-CB 3.31Å; S121-L125 PolarHBondContact O-N 3.07Å
122	A	97.1	Very high	97.2	Very high	88 Å²	88	63.4 Å²	63.4	73%	0.727	34%	0.335	S	S	*	.	H	α-helix	trans	-57.7	-34.8	177.3	0	0	0	0	0	112.1	A126	A122-A126 VanDerWaalsContact O-CB 3.3Å; A122-A126 WeakPolarHBondContact O-CB 3.4Å; A122-A126 PolarHBondContact O-N 3.23Å; A122-A126 VanDerWaalsContact O-N 3.09Å
123	E	97.5	Very high	97.3	Very high	134 Å²	134	62.7 Å²	62.7	63%	0.626	34%	0.335	S	S	*	.	H	α-helix	trans	-67.6	-48.3	176.2	-172.7	179.1	-163.8	0	0	111.8	L106 S121 A126 A127	L106-E123 HydrophobicContact CD2-CG 3.88Å; S121-E123 PolarHBondContact O-N 2.7Å; E123-A126 PolarHBondContact O-N 2.9Å; E123-A127 WeakPolarHBondContact O-CB 3.3Å; E123-A127 PolarHBondContact O-N 3.11Å
124	L	98	Very high	97.4	Very high	9 Å²	9	55.4 Å²	55.4	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-47.8	178	177.4	62.4	0	0	0	111.1	I78 L106 V107 V110 Y120 S121 A126 A127 M128	I78-L124 HydrophobicContact CD1-CD2 4.07Å; L106-L124 HydrophobicContact CG-CD1 4.28Å; V107-L124 HydrophobicContact CG2-CD1 4.05Å; V110-L124 HydrophobicContact CG1-CD2 4.25Å; V110-L124 HydrophobicContact CG2-CD1 4.1Å; V110-L124 HydrophobicContact CG2-CD2 4.1Å; Y120-L124 HydrophobicContact CD1-CD2 4.14Å; S121-L124 PolarHBondContact O-N 3.33Å; S121-L124 VanDerWaalsContact O-N 3.17Å; S121-L124 VanDerWaalsContact OG-CB 3.31Å; S121-L124 WeakPolarHBondContact OG-CB 3.4Å; S121-L124 PolarHBondContact OG-N 3.07Å; S121-L124 VanDerWaalsContact OG-N 3.07Å; L124-A126 VanDerWaalsContact C-N 3.33Å; L124-A126 PolarHBondContact O-N 3.33Å; L124-A127 WeakPolarHBondContact O-CB 3.44Å; L124-A127 PolarHBondContact O-N 2.83Å; L124-M128 HydrophobicContact CD1-CG 4.12Å; L124-M128 HydrophobicContact CD1-SD 4.18Å; L124-M128 HydrophobicContact CD2-SD 4.48Å; L124-M128 HydrophobicContact CG-CG 4.35Å; L124-M128 HydrophobicContact CG-SD 3.92Å; L124-M128 VanDerWaalsContact O-CG 3.26Å; L124-M128 WeakPolarHBondContact O-CG 3.48Å; L124-M128 PolarHBondContact O-N 3.35Å
125	L	98.4	Very high	97.5	Very high	29 Å²	29	52.4 Å²	52.4	15%	0.152	30%	0.3	C	S	.	.	H	α-helix	trans	-58.5	-46.1	178.3	174.9	59	0	0	0	111.2	Y120 S121 A127 M128 K129 L160	Y120-L125 HydrophobicContact CD2-CD1 4.22Å; S121-L125 WeakPolarHBondContact O-CB 3.31Å; S121-L125 PolarHBondContact O-N 3.07Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 2.7Å; L125-M128 PolarHBondContact O-N 2.98Å; L125-K129 HydrophobicContact CD1-CD 4.26Å; L125-K129 HydrophobicContact CD1-CG 4.26Å; L125-K129 HydrophobicContact CG-CD 4.36Å; L125-K129 WeakPolarHBondContact O-CG 3.33Å; L125-K129 PolarHBondContact O-N 3.47Å; L125-L160 HydrophobicContact CD1-CB 4.04Å; L125-L160 VanDerWaalsContact CD1-O 3.31Å; L125-L160 WeakPolarHBondContact CD1-O 3.3Å
126	A	98.3	Very high	97.6	Very high	35 Å²	35	48 Å²	48	29%	0.289	28%	0.28	S	S	.	.	H	α-helix	trans	-63.7	-39.6	178.4	0	0	0	0	0	112	A122 E123 L124 K129 R130	A122-A126 VanDerWaalsContact O-CB 3.3Å; A122-A126 WeakPolarHBondContact O-CB 3.4Å; A122-A126 PolarHBondContact O-N 3.23Å; A122-A126 VanDerWaalsContact O-N 3.09Å; E123-A126 PolarHBondContact O-N 2.9Å; L124-A126 VanDerWaalsContact C-N 3.33Å; L124-A126 PolarHBondContact O-N 3.33Å; A126-K129 PolarHBondContact O-N 2.89Å; A126-R130 WeakPolarHBondContact O-CG 3.45Å; A126-R130 PolarHBondContact O-N 3.31Å; A126-R130 PolarHBondContact O-NH1 2.61Å
127	A	98.4	Very high	97.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.4	-48.8	174.4	0	0	0	0	0	111.8	D103 L106 E123 L124 L125 K129 R130 L131	D103-A127 HydrophobicContact CB-CB 3.8Å; D103-A127 WeakPolarHBondContact OD1-CB 3.45Å; L106-A127 HydrophobicContact CD2-CB 3.93Å; E123-A127 WeakPolarHBondContact O-CB 3.3Å; E123-A127 PolarHBondContact O-N 3.11Å; L124-A127 WeakPolarHBondContact O-CB 3.44Å; L124-A127 PolarHBondContact O-N 2.83Å; L125-A127 VanDerWaalsContact C-N 3.33Å; L125-A127 PolarHBondContact O-N 2.7Å; A127-K129 VanDerWaalsContact C-N 3.3Å; A127-K129 PolarHBondContact O-N 3.47Å; A127-R130 PolarHBondContact O-N 3.31Å; A127-L131 WeakPolarHBondContact O-CB 3.19Å; A127-L131 VanDerWaalsContact O-CG 3.27Å; A127-L131 WeakPolarHBondContact O-CG 3.5Å; A127-L131 PolarHBondContact O-N 2.66Å
128	M	98.7	Very high	97.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-42	177.6	-67.6	174	75.8	0	0	112	T77 I78 L81 V107 Y120 L124 L125 L131 W132 L160	T77-M128 HydrophobicContact CG2-CE 3.79Å; I78-M128 HydrophobicContact CB-CE 4.49Å; I78-M128 HydrophobicContact CG1-CE 3.73Å; I78-M128 HydrophobicContact CG1-SD 4.06Å; L81-M128 HydrophobicContact CD2-CB 3.86Å; L81-M128 HydrophobicContact CD2-CE 4.37Å; L81-M128 HydrophobicContact CD2-CG 3.77Å; V107-M128 HydrophobicContact CG2-CG 3.97Å; Y120-M128 HydrophobicContact CD2-SD 4.39Å; Y120-M128 HydrophobicContact CE2-CE 4.39Å; Y120-M128 HydrophobicContact CE2-SD 4.34Å; L124-M128 HydrophobicContact CD1-CG 4.12Å; L124-M128 HydrophobicContact CD1-SD 4.18Å; L124-M128 HydrophobicContact CD2-SD 4.48Å; L124-M128 HydrophobicContact CG-CG 4.35Å; L124-M128 HydrophobicContact CG-SD 3.92Å; L124-M128 VanDerWaalsContact O-CG 3.26Å; L124-M128 WeakPolarHBondContact O-CG 3.48Å; L124-M128 PolarHBondContact O-N 3.35Å; L125-M128 PolarHBondContact O-N 2.98Å; M128-L131 PolarHBondContact O-N 2.71Å; M128-W132 WeakPolarHBondContact O-CB 3.47Å; M128-W132 PolarHBondContact O-N 2.98Å; M128-L160 HydrophobicContact CB-CD1 3.98Å; M128-L160 HydrophobicContact CB-CD2 4.13Å; M128-L160 HydrophobicContact CE-CD2 3.57Å; M128-L160 HydrophobicContact SD-CD2 4.29Å
129	K	98.6	Very high	98	Very high	81 Å²	81	47.3 Å²	47.3	35%	0.352	27%	0.273	S	S	.	.	H	α-helix	trans	-63.9	-44.9	176.5	-71.9	-179.8	70.5	176.3	0	112.4	L125 A126 A127 L131 W132 A133 L160 D161	L125-K129 HydrophobicContact CD1-CD 4.26Å; L125-K129 HydrophobicContact CD1-CG 4.26Å; L125-K129 HydrophobicContact CG-CD 4.36Å; L125-K129 WeakPolarHBondContact O-CG 3.33Å; L125-K129 PolarHBondContact O-N 3.47Å; A126-K129 PolarHBondContact O-N 2.89Å; A127-K129 VanDerWaalsContact C-N 3.3Å; A127-K129 PolarHBondContact O-N 3.47Å; K129-L131 VanDerWaalsContact C-N 3.35Å; K129-W132 PolarHBondContact O-N 3.02Å; K129-A133 WeakPolarHBondContact O-CB 3.18Å; K129-A133 PolarHBondContact O-N 2.97Å; K129-L160 HydrophobicContact CG-CB 3.96Å; K129-L160 HydrophobicContact CG-CD1 4.03Å; K129-D161 WeakPolarHBondContact CE-OD1 3.27Å; K129-D161 VanDerWaalsContact CE-OD2 3.31Å; K129-D161 WeakPolarHBondContact CE-OD2 3.11Å; K129-D161 IonicContact NZ-OD1 2.81Å; K129-D161 PolarHBondContact NZ-OD1 3.08Å; K129-D161 IonicContact NZ-OD2 3.21Å; K129-D161 PolarHBondContact NZ-OD2 2.95Å
130	R	98.6	Very high	98.1	Very high	93 Å²	93	43.5 Å²	43.5	35%	0.351	25%	0.248	S	C	.	.	H	α-helix	trans	-65.1	-39.4	177.9	-73	-172.9	-60.6	-92.6	2.9	112.1	D103 A126 A127 D134	D103-R130 IonicContact OD1-CZ 2.71Å; D103-R130 IonicContact OD1-NE 3.45Å; D103-R130 IonicContact OD1-NH2 2.59Å; D103-R130 PolarHBondContact OD1-NH2 3.12Å; D103-R130 IonicContact OD2-CZ 2.62Å; D103-R130 IonicContact OD2-NE 2.86Å; D103-R130 PolarHBondContact OD2-NE 3Å; D103-R130 IonicContact OD2-NH2 3.73Å; A126-R130 WeakPolarHBondContact O-CG 3.45Å; A126-R130 PolarHBondContact O-N 3.31Å; A126-R130 PolarHBondContact O-NH1 2.61Å; A127-R130 PolarHBondContact O-N 3.31Å; R130-D134 PolarHBondContact O-N 2.95Å
131	L	98.6	Very high	98.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.6	-48	174.8	-71.5	164.8	0	0	0	111	L81 L85 F95 R100 D103 A104 V107 A127 M128 K129 A133 D134 T137	L81-L131 HydrophobicContact CD1-CB 4.3Å; L81-L131 HydrophobicContact CD2-CB 4.25Å; L81-L131 HydrophobicContact CD2-CD1 4.02Å; L85-L131 HydrophobicContact CD1-CD1 4.18Å; L85-L131 HydrophobicContact CD2-CD2 3.97Å; F95-L131 HydrophobicContact CE1-CD2 3.86Å; F95-L131 HydrophobicContact CZ-CD2 4.35Å; R100-L131 HydrophobicContact CB-CD2 3.97Å; D103-L131 HydrophobicContact CB-CD1 3.88Å; D103-L131 HydrophobicContact CB-CD2 3.95Å; D103-L131 HydrophobicContact CB-CG 3.74Å; A104-L131 HydrophobicContact CB-CD2 4.05Å; V107-L131 HydrophobicContact CB-CD1 4.49Å; V107-L131 HydrophobicContact CG2-CD1 3.6Å; A127-L131 WeakPolarHBondContact O-CB 3.19Å; A127-L131 VanDerWaalsContact O-CG 3.27Å; A127-L131 WeakPolarHBondContact O-CG 3.5Å; A127-L131 PolarHBondContact O-N 2.66Å; M128-L131 PolarHBondContact O-N 2.71Å; K129-L131 VanDerWaalsContact C-N 3.35Å; L131-A133 VanDerWaalsContact C-N 3.26Å; L131-A133 PolarHBondContact O-N 3.42Å; L131-D134 VanDerWaalsContact O-CB 3.25Å; L131-D134 WeakPolarHBondContact O-CB 3.49Å; L131-D134 PolarHBondContact O-N 3.45Å; L131-T137 WeakPolarHBondContact O-CB 3.37Å; L131-T137 WeakPolarHBondContact O-CG2 3.29Å; L131-T137 PolarHBondContact O-OG1 3.43Å
132	W	98.5	Very high	98.1	Very high	21 Å²	21	46 Å²	46	8%	0.08	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-34.5	-179.9	-174.3	-129.3	0	0	0	112.7	I84 M128 K129 D134 T137 Q138 F141 Q154 L157 D158 L160	I84-W132 HydrophobicContact CD1-CZ3 3.99Å; M128-W132 WeakPolarHBondContact O-CB 3.47Å; M128-W132 PolarHBondContact O-N 2.98Å; K129-W132 PolarHBondContact O-N 3.02Å; W132-D134 VanDerWaalsContact C-N 3.27Å; W132-D134 PolarHBondContact O-N 3.43Å; W132-T137 HydrophobicContact CE3-CG2 4.08Å; W132-T137 HydrophobicContact CZ3-CG2 4.49Å; W132-Q138 VanDerWaalsContact CE2-NE2 3.25Å; W132-Q138 VanDerWaalsContact CE3-NE2 3.28Å; W132-Q138 VanDerWaalsContact CZ2-NE2 3.33Å; W132-Q138 VanDerWaalsContact CZ3-NE2 3.33Å; W132-Q138 PolarHBondContact O-NE2 3.33Å; W132-F141 HydrophobicContact CH2-CB 4.13Å; W132-F141 AromaticContact CH2-CD1 3.76Å; W132-F141 HydrophobicContact CH2-CD1 3.76Å; W132-F141 AromaticContact CH2-CD2 3.91Å; W132-F141 HydrophobicContact CH2-CD2 3.91Å; W132-F141 HydrophobicContact CH2-CE1 4.17Å; W132-F141 HydrophobicContact CH2-CE2 4.32Å; W132-F141 AromaticContact CH2-CG 3.62Å; W132-F141 HydrophobicContact CH2-CG 3.62Å; W132-F141 HydrophobicContact CH2-CZ 4.46Å; W132-F141 HydrophobicContact CZ3-CB 3.98Å; W132-F141 HydrophobicContact CZ3-CD1 4.46Å; W132-F141 HydrophobicContact CZ3-CD2 4.19Å; W132-F141 AromaticContact CZ3-CG 3.94Å; W132-F141 HydrophobicContact CZ3-CG 3.94Å; W132-Q154 HydrophobicContact CZ2-CG 4.28Å; W132-L157 VanDerWaalsContact CD1-O 3.3Å; W132-L157 HydrophobicContact CD2-CB 3.63Å; W132-L157 HydrophobicContact CD2-CD1 4.05Å; W132-L157 HydrophobicContact CD2-CG 4.38Å; W132-L157 HydrophobicContact CE3-CB 4.15Å; W132-L157 HydrophobicContact CE3-CD1 3.65Å; W132-L157 HydrophobicContact CE3-CG 4.45Å; W132-L157 HydrophobicContact CG-CB 3.87Å; W132-L157 HydrophobicContact CH2-CD1 4.17Å; W132-L157 HydrophobicContact CZ2-CB 4.08Å; W132-L157 HydrophobicContact CZ3-CD1 3.73Å; W132-D158 PolarHBondContact NE1-OD1 2.97Å; W132-L160 HydrophobicContact CB-CD1 4.27Å
133	A	98.3	Very high	98	Very high	78 Å²	78	45.4 Å²	45.4	65%	0.645	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-10.3	174.3	0	0	0	0	0	114.2	K129 L131	K129-A133 WeakPolarHBondContact O-CB 3.18Å; K129-A133 PolarHBondContact O-N 2.97Å; L131-A133 VanDerWaalsContact C-N 3.26Å; L131-A133 PolarHBondContact O-N 3.42Å
134	D	98.6	Very high	97.9	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.027	21%	0.212	C	C	.	.			trans	-69.7	131.9	-177.6	-176.6	-94.7	0	0	0	111.3	F95 G96 D97 R100 R130 L131 W132 G136 T137 Q138	F95-D134 WeakPolarHBondContact CA-OD1 3.48Å; G96-D134 WeakPolarHBondContact CA-OD2 3.28Å; G96-D134 PolarHBondContact N-OD1 3.39Å; G96-D134 PolarHBondContact N-OD2 3.03Å; D97-D134 PolarHBondContact N-OD2 3.38Å; R100-D134 HydrophobicContact CG-CB 4.31Å; R130-D134 PolarHBondContact O-N 2.95Å; L131-D134 VanDerWaalsContact O-CB 3.25Å; L131-D134 WeakPolarHBondContact O-CB 3.49Å; L131-D134 PolarHBondContact O-N 3.45Å; W132-D134 VanDerWaalsContact C-N 3.27Å; W132-D134 PolarHBondContact O-N 3.43Å; D134-G136 VanDerWaalsContact C-N 3.3Å; D134-G136 PolarHBondContact O-N 2.83Å; D134-G136 WeakPolarHBondContact OD1-CA 3.48Å; D134-G136 PolarHBondContact OD1-N 3.36Å; D134-T137 PolarHBondContact O-N 2.95Å; D134-T137 VanDerWaalsContact O-N 3.14Å; D134-T137 PolarHBondContact OD1-N 3.25Å; D134-Q138 PolarHBondContact O-N 3.21Å
135	P	98.1	Very high	97.6	Very high	90 Å²	90	44.8 Å²	44.8	58%	0.584	23%	0.23	S	C	*	.	H	α-helix	trans	-57.9	-37.1	179.6	-27.1	34.9	0	0	0	114.3	Q138 E139	P135-Q138 PolarHBondContact O-N 2.68Å; P135-E139 WeakPolarHBondContact O-CB 3.11Å; P135-E139 PolarHBondContact O-N 2.94Å
136	G	98.1	Very high	97.4	Very high	4 Å²	4	47.7 Å²	47.7	4%	0.041	24%	0.243	C	C	.	.	H	α-helix	trans	-69.4	-37.3	178	0	0	0	0	0	111.9	I93 E94 D134 E139 C140	I93-G136 WeakPolarHBondContact CG2-O 3.5Å; E94-G136 WeakPolarHBondContact O-CA 3.32Å; D134-G136 VanDerWaalsContact C-N 3.3Å; D134-G136 PolarHBondContact O-N 2.83Å; D134-G136 WeakPolarHBondContact OD1-CA 3.48Å; D134-G136 PolarHBondContact OD1-N 3.36Å; G136-E139 PolarHBondContact O-N 3.39Å; G136-C140 WeakPolarHBondContact O-CB 3.22Å; G136-C140 PolarHBondContact O-N 2.9Å
137	T	98.3	Very high	97.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-42.8	171.7	-62	0	0	0	0	111.5	L81 I84 M88 L131 W132 D134 C140 F141	L81-T137 HydrophobicContact CD1-CG2 4.31Å; I84-T137 HydrophobicContact CG2-CG2 3.89Å; M88-T137 PolarHBondContact SD-OG1 2.93Å; M88-T137 VanDerWaalsContact SD-OG1 3.41Å; L131-T137 WeakPolarHBondContact O-CB 3.37Å; L131-T137 WeakPolarHBondContact O-CG2 3.29Å; L131-T137 PolarHBondContact O-OG1 3.43Å; W132-T137 HydrophobicContact CE3-CG2 4.08Å; W132-T137 HydrophobicContact CZ3-CG2 4.49Å; D134-T137 PolarHBondContact O-N 2.95Å; D134-T137 VanDerWaalsContact O-N 3.14Å; D134-T137 PolarHBondContact OD1-N 3.25Å; T137-C140 PolarHBondContact O-N 3.25Å; T137-F141 WeakPolarHBondContact O-CB 3.46Å; T137-F141 PolarHBondContact O-N 3.4Å
138	Q	98.3	Very high	97.1	Very high	58 Å²	58	49.7 Å²	49.7	27%	0.271	25%	0.245	S	C	.	.	H	α-helix	trans	-64.9	-39.3	175.1	-71.7	-62.1	-43.3	0	0	112.7	W132 D134 P135 F141 N142	W132-Q138 VanDerWaalsContact CE2-NE2 3.25Å; W132-Q138 VanDerWaalsContact CE3-NE2 3.28Å; W132-Q138 VanDerWaalsContact CZ2-NE2 3.33Å; W132-Q138 VanDerWaalsContact CZ3-NE2 3.33Å; W132-Q138 PolarHBondContact O-NE2 3.33Å; D134-Q138 PolarHBondContact O-N 3.21Å; P135-Q138 PolarHBondContact O-N 2.68Å; Q138-F141 PolarHBondContact O-N 3.14Å; Q138-N142 PolarHBondContact O-N 3.08Å; Q138-N142 PolarHBondContact O-ND2 3.25Å
139	E	97.8	Very high	97	Very high	105 Å²	105	50.1 Å²	50.1	49%	0.491	25%	0.247	S	C	.	.	H	α-helix	trans	-60.2	-47.5	173.3	-175.5	-175.3	156.3	0	0	111.1	I93 P135 G136 F141 N142 R143	I93-E139 HydrophobicContact CG2-CB 4.45Å; P135-E139 WeakPolarHBondContact O-CB 3.11Å; P135-E139 PolarHBondContact O-N 2.94Å; G136-E139 PolarHBondContact O-N 3.39Å; E139-F141 VanDerWaalsContact C-N 3.34Å; E139-F141 PolarHBondContact O-N 3.17Å; E139-N142 WeakPolarHBondContact O-CB 3.25Å; E139-N142 PolarHBondContact O-N 3.48Å; E139-R143 PolarHBondContact O-N 3.14Å
140	C	98.3	Very high	96.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-40.5	177.7	-170.8	0	0	0	0	112.3	I84 M88 I93 G136 T137 N142 R143 A144 Y147	I84-C140 HydrophobicContact CG2-CB 3.97Å; I84-C140 PolarHBondContact O-SG 3.4Å; M88-C140 HydrophobicContact CG-CB 3.44Å; M88-C140 VanDerWaalsContact CG-CB 3.44Å; M88-C140 VanDerWaalsContact CG-SG 3.57Å; M88-C140 PolarHBondContact N-SG 3.41Å; M88-C140 HydrophobicContact SD-CB 4.41Å; I93-C140 HydrophobicContact CD1-CB 3.7Å; G136-C140 WeakPolarHBondContact O-CB 3.22Å; G136-C140 PolarHBondContact O-N 2.9Å; T137-C140 PolarHBondContact O-N 3.25Å; C140-N142 VanDerWaalsContact C-N 3.33Å; C140-N142 PolarHBondContact O-N 2.95Å; C140-R143 CarbonylContact O-C 3.5Å; C140-R143 WeakPolarHBondContact O-CA 3.15Å; C140-R143 PolarHBondContact O-N 3.3Å; C140-A144 PolarHBondContact O-N 3.22Å; C140-Y147 WeakPolarHBondContact O-CE1 3.5Å; C140-Y147 PolarHBondContact O-OH 2.81Å
141	F	97.6	Very high	96.4	Very high	35 Å²	35	45.1 Å²	45.1	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-40.2	174.3	176.2	-104.9	0	0	0	112.1	I84 W132 T137 Q138 E139 R143 A144 L149 Q154	I84-F141 HydrophobicContact CD1-CB 4.46Å; I84-F141 HydrophobicContact CD1-CD2 4.01Å; W132-F141 HydrophobicContact CH2-CB 4.13Å; W132-F141 AromaticContact CH2-CD1 3.76Å; W132-F141 HydrophobicContact CH2-CD1 3.76Å; W132-F141 AromaticContact CH2-CD2 3.91Å; W132-F141 HydrophobicContact CH2-CD2 3.91Å; W132-F141 HydrophobicContact CH2-CE1 4.17Å; W132-F141 HydrophobicContact CH2-CE2 4.32Å; W132-F141 AromaticContact CH2-CG 3.62Å; W132-F141 HydrophobicContact CH2-CG 3.62Å; W132-F141 HydrophobicContact CH2-CZ 4.46Å; W132-F141 HydrophobicContact CZ3-CB 3.98Å; W132-F141 HydrophobicContact CZ3-CD1 4.46Å; W132-F141 HydrophobicContact CZ3-CD2 4.19Å; W132-F141 AromaticContact CZ3-CG 3.94Å; W132-F141 HydrophobicContact CZ3-CG 3.94Å; T137-F141 WeakPolarHBondContact O-CB 3.46Å; T137-F141 PolarHBondContact O-N 3.4Å; Q138-F141 PolarHBondContact O-N 3.14Å; E139-F141 VanDerWaalsContact C-N 3.34Å; E139-F141 PolarHBondContact O-N 3.17Å; F141-R143 PolarHBondContact O-N 2.91Å; F141-R143 VanDerWaalsContact O-N 3.13Å; F141-A144 WeakPolarHBondContact O-CB 3.43Å; F141-A144 PolarHBondContact O-N 3.09Å; F141-L149 HydrophobicContact CD2-CD2 3.63Å; F141-L149 HydrophobicContact CE2-CD2 3.7Å; F141-Q154 HydrophobicContact CE1-CB 4.26Å; F141-Q154 HydrophobicContact CE1-CG 4.49Å; F141-Q154 HydrophobicContact CE2-CB 4.22Å; F141-Q154 HydrophobicContact CZ-CB 3.63Å; F141-Q154 HydrophobicContact CZ-CG 4.32Å
142	N	95.8	Very high	96.3	Very high	100 Å²	100	45.7 Å²	45.7	54%	0.535	24%	0.236	S	C	.	.	H	α-helix	trans	-64	-17.9	175.4	-77.5	-60.7	0	0	0	113.5	Q138 E139 C140	Q138-N142 PolarHBondContact O-N 3.08Å; Q138-N142 PolarHBondContact O-ND2 3.25Å; E139-N142 WeakPolarHBondContact O-CB 3.25Å; E139-N142 PolarHBondContact O-N 3.48Å; C140-N142 VanDerWaalsContact C-N 3.33Å; C140-N142 PolarHBondContact O-N 2.95Å
143	R	95.7	Very high	96.3	Very high	77 Å²	77	44.8 Å²	44.8	29%	0.291	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	16.5	174	-66.3	175.6	65.1	-170.2	-3.8	113.2	L91 E139 C140 F141 R145 E146	L91-R143 HydrophobicContact CD1-CB 4.26Å; E139-R143 PolarHBondContact O-N 3.14Å; C140-R143 CarbonylContact O-C 3.5Å; C140-R143 WeakPolarHBondContact O-CA 3.15Å; C140-R143 PolarHBondContact O-N 3.3Å; F141-R143 PolarHBondContact O-N 2.91Å; F141-R143 VanDerWaalsContact O-N 3.13Å; R143-R145 PolarHBondContact O-N 2.99Å; R143-E146 IonicContact CZ-OE1 3.64Å; R143-E146 IonicContact CZ-OE2 3.44Å; R143-E146 IonicContact NE-OE1 2.85Å; R143-E146 PolarHBondContact NE-OE1 3.36Å; R143-E146 IonicContact NE-OE2 3.38Å; R143-E146 PolarHBondContact NE-OE2 2.89Å; R143-E146 IonicContact NH2-OE1 3.54Å; R143-E146 IonicContact NH2-OE2 2.71Å; R143-E146 PolarHBondContact NH2-OE2 3.19Å; R143-E146 WeakPolarHBondContact O-CB 3.39Å; R143-E146 PolarHBondContact O-N 3.04Å
144	A	94.9	Very high	96.2	Very high	18 Å²	18	45.4 Å²	45.4	15%	0.149	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-5.4	-177.3	0	0	0	0	0	116.4	C140 F141 E146 Y147 L149	C140-A144 PolarHBondContact O-N 3.22Å; F141-A144 WeakPolarHBondContact O-CB 3.43Å; F141-A144 PolarHBondContact O-N 3.09Å; A144-E146 VanDerWaalsContact C-N 3.29Å; A144-Y147 HydrophobicContact CB-CE1 4.41Å; A144-Y147 HydrophobicContact CB-CE2 4.45Å; A144-L149 HydrophobicContact CB-CB 4.3Å; A144-L149 HydrophobicContact CB-CD2 3.65Å
145	R	92.1	Very high	96.2	Very high	112 Å²	112	47.7 Å²	47.7	42%	0.423	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-21.8	168.1	71.6	176.4	-177.3	-179	0.9	113.2	R143 Y147 S282	R143-R145 PolarHBondContact O-N 2.99Å; R145-Y147 VanDerWaalsContact C-N 3.32Å; R145-S282 PolarHBondContact NH1-OG 2.86Å
146	E	94.3	Very high	96.2	Very high	89 Å²	89	43.4 Å²	43.4	42%	0.416	20%	0.202	S	C	.	.	S	Bend	trans	-83.5	-7.9	-175.1	-62.3	176	-138.7	0	0	113	L91 R143 A144	L91-E146 HydrophobicContact CD1-CB 4.49Å; L91-E146 HydrophobicContact CD2-CB 4.42Å; L91-E146 WeakPolarHBondContact CD2-OE2 3.37Å; R143-E146 IonicContact CZ-OE1 3.64Å; R143-E146 IonicContact CZ-OE2 3.44Å; R143-E146 IonicContact NE-OE1 2.85Å; R143-E146 PolarHBondContact NE-OE1 3.36Å; R143-E146 IonicContact NE-OE2 3.38Å; R143-E146 PolarHBondContact NE-OE2 2.89Å; R143-E146 IonicContact NH2-OE1 3.54Å; R143-E146 IonicContact NH2-OE2 2.71Å; R143-E146 PolarHBondContact NH2-OE2 3.19Å; R143-E146 WeakPolarHBondContact O-CB 3.39Å; R143-E146 PolarHBondContact O-N 3.04Å; A144-E146 VanDerWaalsContact C-N 3.29Å
147	Y	95.3	Very high	96.3	Very high	34 Å²	34	43.3 Å²	43.3	13%	0.133	20%	0.201	C	C	.	.	S	Bend	trans	-147.6	174.7	179.2	58.7	-87.5	0	0	0	111.1	I84 A87 L91 C140 A144 R145 L149	I84-Y147 HydrophobicContact CG1-CE2 4.4Å; A87-Y147 HydrophobicContact CB-CD1 3.46Å; A87-Y147 VanDerWaalsContact CB-CD1 3.46Å; A87-Y147 HydrophobicContact CB-CD2 3.66Å; A87-Y147 HydrophobicContact CB-CE1 3.55Å; A87-Y147 HydrophobicContact CB-CE2 3.75Å; A87-Y147 HydrophobicContact CB-CG 3.51Å; L91-Y147 HydrophobicContact CD1-CD1 4.12Å; L91-Y147 HydrophobicContact CD1-CE1 4.18Å; C140-Y147 WeakPolarHBondContact O-CE1 3.5Å; C140-Y147 PolarHBondContact O-OH 2.81Å; A144-Y147 HydrophobicContact CB-CE1 4.41Å; A144-Y147 HydrophobicContact CB-CE2 4.45Å; R145-Y147 VanDerWaalsContact C-N 3.32Å; Y147-L149 HydrophobicContact CD2-CB 4.22Å; Y147-L149 HydrophobicContact CE2-CB 3.89Å; Y147-L149 HydrophobicContact CE2-CD1 4.39Å; Y147-L149 HydrophobicContact CE2-CD2 4.21Å; Y147-L149 HydrophobicContact CE2-CG 4.38Å; Y147-L149 PolarHBondContact O-N 2.78Å
148	Q	94.7	Very high	96.3	Very high	43 Å²	43	48 Å²	48	20%	0.201	23%	0.226	C	C	.	.			trans	-87.1	109	-177.9	-57.9	-64.5	-37	0	0	110.1	V234	Q148-V234 PolarHBondContact NE2-O 2.9Å
149	L	95.6	Very high	96.3	Very high	9 Å²	9	46.3 Å²	46.3	5%	0.047	22%	0.221	C	C	.	.			trans	-126.5	148.8	176.4	-171.4	60.9	0	0	0	110.9	A83 I84 F141 A144 Y147 A153	A83-L149 HydrophobicContact CB-CD1 4.1Å; I84-L149 HydrophobicContact CD1-CD1 4.31Å; I84-L149 HydrophobicContact CD1-CD2 4.23Å; I84-L149 HydrophobicContact CG1-CD1 3.84Å; I84-L149 HydrophobicContact CG1-CD2 4.03Å; F141-L149 HydrophobicContact CD2-CD2 3.63Å; F141-L149 HydrophobicContact CE2-CD2 3.7Å; A144-L149 HydrophobicContact CB-CB 4.3Å; A144-L149 HydrophobicContact CB-CD2 3.65Å; Y147-L149 HydrophobicContact CD2-CB 4.22Å; Y147-L149 HydrophobicContact CE2-CB 3.89Å; Y147-L149 HydrophobicContact CE2-CD1 4.39Å; Y147-L149 HydrophobicContact CE2-CD2 4.21Å; Y147-L149 HydrophobicContact CE2-CG 4.38Å; Y147-L149 PolarHBondContact O-N 2.78Å; L149-A153 HydrophobicContact CD1-CB 3.92Å; L149-A153 HydrophobicContact CD2-CB 3.99Å; L149-A153 HydrophobicContact CG-CB 3.87Å
150	N	92.6	Very high	96.3	Very high	24 Å²	24	41.6 Å²	41.6	13%	0.128	20%	0.199	C	C	.	.			trans	-71.5	131.8	172.2	-172.3	5.5	0	0	0	110.5	S152 A153	N150-S152 PolarHBondContact O-N 3.2Å; N150-S152 VanDerWaalsContact O-N 3.13Å; N150-S152 PolarHBondContact OD1-N 2.76Å; N150-A153 WeakPolarHBondContact O-CB 3.37Å; N150-A153 PolarHBondContact O-N 3.46Å
151	D	93.4	Very high	96.3	Very high	45 Å²	45	46.5 Å²	46.5	24%	0.241	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.3	177.9	-73.5	-4.5	0	0	0	113.2	A153 K271 L274	D151-A153 VanDerWaalsContact C-N 3.29Å; D151-A153 PolarHBondContact O-N 3.08Å; D151-K271 VanDerWaalsContact OD2-CD 3.31Å; D151-K271 WeakPolarHBondContact OD2-CD 3.45Å; D151-K271 VanDerWaalsContact OD2-CE 3.22Å; D151-K271 WeakPolarHBondContact OD2-CE 3.46Å; D151-K271 IonicContact OD2-NZ 3.67Å; D151-K271 PolarHBondContact OD2-NZ 3.2Å; D151-L274 HydrophobicContact CB-CD1 3.65Å
152	S	96.6	Very high	96.3	Very high	13 Å²	13	49 Å²	49	9%	0.091	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	2.5	177	-56.9	0	0	0	0	113.9	N150 Q154 Y155 Y156 R177	N150-S152 PolarHBondContact O-N 3.2Å; N150-S152 VanDerWaalsContact O-N 3.13Å; N150-S152 PolarHBondContact OD1-N 2.76Å; S152-Q154 PolarHBondContact O-N 2.87Å; S152-Y155 PolarHBondContact O-N 3.35Å; S152-Y156 WeakPolarHBondContact O-CD2 3.42Å; S152-Y156 PolarHBondContact O-N 3.29Å; S152-R177 WeakPolarHBondContact OG-CB 3.45Å; S152-R177 PolarHBondContact OG-O 2.94Å; S152-R177 VanDerWaalsContact OG-O 3.09Å
153	A	97.6	Very high	96.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-54.2	-52.3	-175	0	0	0	0	0	112.2	L149 N150 D151 Y155 Y156 L157	L149-A153 HydrophobicContact CD1-CB 3.92Å; L149-A153 HydrophobicContact CD2-CB 3.99Å; L149-A153 HydrophobicContact CG-CB 3.87Å; N150-A153 WeakPolarHBondContact O-CB 3.37Å; N150-A153 PolarHBondContact O-N 3.46Å; D151-A153 VanDerWaalsContact C-N 3.29Å; D151-A153 PolarHBondContact O-N 3.08Å; A153-Y155 PolarHBondContact O-N 3.01Å; A153-Y156 PolarHBondContact O-N 3.23Å; A153-L157 WeakPolarHBondContact O-CB 3.47Å; A153-L157 VanDerWaalsContact O-CG 3.24Å; A153-L157 WeakPolarHBondContact O-CG 3.36Å; A153-L157 PolarHBondContact O-N 2.8Å
154	Q	97.6	Very high	96.5	Very high	91 Å²	91	41.3 Å²	41.3	43%	0.425	20%	0.202	S	C	.	.	H	α-helix	trans	-59.4	-46	179.9	179.4	170.5	12.9	0	0	112.3	W132 F141 S152 Y156 L157 D158	W132-Q154 HydrophobicContact CZ2-CG 4.28Å; F141-Q154 HydrophobicContact CE1-CB 4.26Å; F141-Q154 HydrophobicContact CE1-CG 4.49Å; F141-Q154 HydrophobicContact CE2-CB 4.22Å; F141-Q154 HydrophobicContact CZ-CB 3.63Å; F141-Q154 HydrophobicContact CZ-CG 4.32Å; S152-Q154 PolarHBondContact O-N 2.87Å; Q154-Y156 VanDerWaalsContact C-N 3.27Å; Q154-Y156 PolarHBondContact O-N 3.09Å; Q154-L157 PolarHBondContact O-N 3.09Å; Q154-D158 WeakPolarHBondContact CG-OD2 3.34Å; Q154-D158 PolarHBondContact NE2-OD2 3.27Å; Q154-D158 VanDerWaalsContact O-CB 3.29Å; Q154-D158 WeakPolarHBondContact O-CB 3.36Å; Q154-D158 VanDerWaalsContact O-CG 3.22Å; Q154-D158 PolarHBondContact O-N 3.33Å
155	Y	98.1	Very high	96.6	Very high	53 Å²	53	42 Å²	42	21%	0.208	21%	0.208	C	C	.	.	H	α-helix	trans	-54.2	-44.4	179.4	167.8	-92.1	0	0	0	112.5	S152 A153 S159 R162 D174 R177	S152-Y155 PolarHBondContact O-N 3.35Å; A153-Y155 PolarHBondContact O-N 3.01Å; Y155-S159 WeakPolarHBondContact O-CB 3.29Å; Y155-S159 PolarHBondContact O-N 3.39Å; Y155-S159 PolarHBondContact O-OG 3.44Å; Y155-R162 PolarHBondContact OH-NH2 3.44Å; Y155-D174 WeakPolarHBondContact CE1-OD1 3.27Å; Y155-D174 VanDerWaalsContact CZ-OD1 3.26Å; Y155-D174 PolarHBondContact OH-OD1 3.25Å; Y155-R177 HydrophobicContact CD1-CB 4.4Å; Y155-R177 HydrophobicContact CD1-CG 4.46Å; Y155-R177 HydrophobicContact CE1-CB 4.49Å
156	Y	98.5	Very high	96.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.1	-42.4	179.2	-68.1	-56.3	0	0	0	112.6	V73 N76 T77 S152 A153 Q154 D158 S159 L160 I163 D174 R177 T178	V73-Y156 HydrophobicContact CB-CE1 4.45Å; V73-Y156 HydrophobicContact CG1-CD1 3.9Å; V73-Y156 HydrophobicContact CG1-CE1 3.6Å; V73-Y156 HydrophobicContact CG2-CE1 4.32Å; N76-Y156 HydrophobicContact CB-CE2 4.1Å; T77-Y156 WeakPolarHBondContact OG1-CB 3.39Å; S152-Y156 WeakPolarHBondContact O-CD2 3.42Å; S152-Y156 PolarHBondContact O-N 3.29Å; A153-Y156 PolarHBondContact O-N 3.23Å; Q154-Y156 VanDerWaalsContact C-N 3.27Å; Q154-Y156 PolarHBondContact O-N 3.09Å; Y156-D158 VanDerWaalsContact C-N 3.35Å; Y156-D158 PolarHBondContact O-N 3.01Å; Y156-S159 CarbonylContact O-C 3.52Å; Y156-S159 WeakPolarHBondContact O-CA 3.41Å; Y156-S159 PolarHBondContact O-N 3.47Å; Y156-L160 PolarHBondContact O-N 3.17Å; Y156-I163 HydrophobicContact CD1-CD1 3.71Å; Y156-I163 HydrophobicContact CG-CD1 4.42Å; Y156-D174 HydrophobicContact CE1-CB 4.45Å; Y156-D174 PolarHBondContact OH-O 3.01Å; Y156-R177 HydrophobicContact CE2-CB 4.41Å; Y156-R177 PolarHBondContact OH-O 3.05Å; Y156-T178 WeakPolarHBondContact OH-CA 3.35Å; Y156-T178 PolarHBondContact OH-N 3.41Å
157	L	98.6	Very high	96.8	Very high	3 Å²	3	44 Å²	44	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-69.5	-32.9	-177.9	-64.9	171	0	0	0	112.4	T77 L81 I84 W132 A153 Q154 S159 L160	T77-L157 HydrophobicContact CG2-CD2 4.04Å; L81-L157 HydrophobicContact CB-CD2 3.94Å; L81-L157 HydrophobicContact CD1-CD2 4.42Å; I84-L157 HydrophobicContact CD1-CD1 3.86Å; W132-L157 VanDerWaalsContact CD1-O 3.3Å; W132-L157 HydrophobicContact CD2-CB 3.63Å; W132-L157 HydrophobicContact CD2-CD1 4.05Å; W132-L157 HydrophobicContact CD2-CG 4.38Å; W132-L157 HydrophobicContact CE3-CB 4.15Å; W132-L157 HydrophobicContact CE3-CD1 3.65Å; W132-L157 HydrophobicContact CE3-CG 4.45Å; W132-L157 HydrophobicContact CG-CB 3.87Å; W132-L157 HydrophobicContact CH2-CD1 4.17Å; W132-L157 HydrophobicContact CZ2-CB 4.08Å; W132-L157 HydrophobicContact CZ3-CD1 3.73Å; A153-L157 WeakPolarHBondContact O-CB 3.47Å; A153-L157 VanDerWaalsContact O-CG 3.24Å; A153-L157 WeakPolarHBondContact O-CG 3.36Å; A153-L157 PolarHBondContact O-N 2.8Å; Q154-L157 PolarHBondContact O-N 3.09Å; L157-S159 PolarHBondContact O-N 3.01Å; L157-L160 HydrophobicContact CD2-CD1 4.43Å; L157-L160 WeakPolarHBondContact O-CD1 3.18Å; L157-L160 VanDerWaalsContact O-CG 3.23Å; L157-L160 WeakPolarHBondContact O-CG 3.39Å
158	D	98.6	Very high	96.9	Very high	97 Å²	97	42.8 Å²	42.8	52%	0.519	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.3	170.7	-68.5	-13.6	0	0	0	112	W132 Q154 Y156	W132-D158 PolarHBondContact NE1-OD1 2.97Å; Q154-D158 WeakPolarHBondContact CG-OD2 3.34Å; Q154-D158 PolarHBondContact NE2-OD2 3.27Å; Q154-D158 VanDerWaalsContact O-CB 3.29Å; Q154-D158 WeakPolarHBondContact O-CB 3.36Å; Q154-D158 VanDerWaalsContact O-CG 3.22Å; Q154-D158 PolarHBondContact O-N 3.33Å; Y156-D158 VanDerWaalsContact C-N 3.35Å; Y156-D158 PolarHBondContact O-N 3.01Å
159	S	98.4	Very high	97	Very high	24 Å²	24	47.5 Å²	47.5	17%	0.168	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	13.9	-177.5	-64.4	0	0	0	0	114.2	Y155 Y156 L157 D161 R162 I163	Y155-S159 WeakPolarHBondContact O-CB 3.29Å; Y155-S159 PolarHBondContact O-N 3.39Å; Y155-S159 PolarHBondContact O-OG 3.44Å; Y156-S159 CarbonylContact O-C 3.52Å; Y156-S159 WeakPolarHBondContact O-CA 3.41Å; Y156-S159 PolarHBondContact O-N 3.47Å; L157-S159 PolarHBondContact O-N 3.01Å; S159-D161 VanDerWaalsContact C-N 3.25Å; S159-D161 PolarHBondContact O-N 2.96Å; S159-D161 VanDerWaalsContact O-N 3.16Å; S159-R162 PolarHBondContact O-N 3.09Å; S159-R162 PolarHBondContact OG-NH2 3.16Å; S159-I163 WeakPolarHBondContact O-CG1 3.31Å; S159-I163 PolarHBondContact O-N 2.73Å
160	L	98.4	Very high	97	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-54.1	-39.1	-173.2	-77.8	168.9	0	0	0	113.7	T77 Y120 L125 M128 K129 W132 Y156 L157 R162 I163 G164	T77-L160 HydrophobicContact CG2-CD2 3.78Å; Y120-L160 HydrophobicContact CE2-CD2 4.4Å; L125-L160 HydrophobicContact CD1-CB 4.04Å; L125-L160 VanDerWaalsContact CD1-O 3.31Å; L125-L160 WeakPolarHBondContact CD1-O 3.3Å; M128-L160 HydrophobicContact CB-CD1 3.98Å; M128-L160 HydrophobicContact CB-CD2 4.13Å; M128-L160 HydrophobicContact CE-CD2 3.57Å; M128-L160 HydrophobicContact SD-CD2 4.29Å; K129-L160 HydrophobicContact CG-CB 3.96Å; K129-L160 HydrophobicContact CG-CD1 4.03Å; W132-L160 HydrophobicContact CB-CD1 4.27Å; Y156-L160 PolarHBondContact O-N 3.17Å; L157-L160 HydrophobicContact CD2-CD1 4.43Å; L157-L160 WeakPolarHBondContact O-CD1 3.18Å; L157-L160 VanDerWaalsContact O-CG 3.23Å; L157-L160 WeakPolarHBondContact O-CG 3.39Å; L160-R162 PolarHBondContact O-N 3.03Å; L160-I163 PolarHBondContact O-N 2.84Å; L160-G164 WeakPolarHBondContact O-CA 3.38Å; L160-G164 PolarHBondContact O-N 3.47Å
161	D	97.9	Very high	97.2	Very high	103 Å²	103	49.2 Å²	49.2	55%	0.551	27%	0.274	S	S	*	.	H	α-helix	trans	-61.3	-42.8	177.7	-81.1	-52.1	0	0	0	112.8	K129 S159 A165	K129-D161 WeakPolarHBondContact CE-OD1 3.27Å; K129-D161 VanDerWaalsContact CE-OD2 3.31Å; K129-D161 WeakPolarHBondContact CE-OD2 3.11Å; K129-D161 IonicContact NZ-OD1 2.81Å; K129-D161 PolarHBondContact NZ-OD1 3.08Å; K129-D161 IonicContact NZ-OD2 3.21Å; K129-D161 PolarHBondContact NZ-OD2 2.95Å; S159-D161 VanDerWaalsContact C-N 3.25Å; S159-D161 PolarHBondContact O-N 2.96Å; S159-D161 VanDerWaalsContact O-N 3.16Å; D161-A165 PolarHBondContact O-N 3.42Å
162	R	98.1	Very high	97.3	Very high	88 Å²	88	51.5 Å²	51.5	33%	0.332	28%	0.283	S	S	.	.	H	α-helix	trans	-71.8	-44.9	178.5	179.1	-178.6	60.5	115.9	7.5	111.3	Y155 S159 L160 A165 Y168 T171 D174	Y155-R162 PolarHBondContact OH-NH2 3.44Å; S159-R162 PolarHBondContact O-N 3.09Å; S159-R162 PolarHBondContact OG-NH2 3.16Å; L160-R162 PolarHBondContact O-N 3.03Å; R162-A165 WeakPolarHBondContact O-CB 3.5Å; R162-A165 PolarHBondContact O-N 3.18Å; R162-Y168 HydrophobicContact CG-CD2 4.41Å; R162-Y168 VanDerWaalsContact O-CD2 3.26Å; R162-Y168 WeakPolarHBondContact O-CD2 3.48Å; R162-T171 PolarHBondContact NH1-OG1 3.41Å; R162-D174 IonicContact CZ-OD1 2.76Å; R162-D174 IonicContact CZ-OD2 2.79Å; R162-D174 IonicContact NH1-OD1 2.82Å; R162-D174 PolarHBondContact NH1-OD1 3.16Å; R162-D174 IonicContact NH1-OD2 2.93Å; R162-D174 PolarHBondContact NH1-OD2 3.24Å; R162-D174 IonicContact NH2-OD1 3.42Å; R162-D174 PolarHBondContact NH2-OD1 3.18Å; R162-D174 IonicContact NH2-OD2 3Å
163	I	98.1	Very high	97.3	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-69.7	-38.3	-176.4	-64.8	169.8	0	0	0	110.8	V73 Y74 Y120 Y156 S159 L160 A165 Y168	V73-I163 HydrophobicContact CG1-CD1 4.26Å; V73-I163 HydrophobicContact CG1-CG2 4.2Å; Y74-I163 HydrophobicContact CD1-CG2 3.77Å; Y74-I163 HydrophobicContact CE1-CG2 3.74Å; Y74-I163 WeakPolarHBondContact CE1-O 3.17Å; Y120-I163 HydrophobicContact CE2-CB 4.5Å; Y120-I163 HydrophobicContact CE2-CG2 3.74Å; Y156-I163 HydrophobicContact CD1-CD1 3.71Å; Y156-I163 HydrophobicContact CG-CD1 4.42Å; S159-I163 WeakPolarHBondContact O-CG1 3.31Å; S159-I163 PolarHBondContact O-N 2.73Å; L160-I163 PolarHBondContact O-N 2.84Å; I163-A165 VanDerWaalsContact C-N 3.28Å; I163-A165 PolarHBondContact O-N 3Å; I163-Y168 HydrophobicContact CG1-CE2 4.13Å; I163-Y168 HydrophobicContact CG2-CD1 4.41Å; I163-Y168 HydrophobicContact CG2-CE1 4.06Å; I163-Y168 WeakPolarHBondContact O-CB 3.35Å; I163-Y168 WeakPolarHBondContact O-CD1 3.27Å
164	G	97.3	Very high	97.3	Very high	15 Å²	15	54 Å²	54	16%	0.155	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-1.8	178.9	0	0	0	0	0	115.2	L160	L160-G164 WeakPolarHBondContact O-CA 3.38Å; L160-G164 PolarHBondContact O-N 3.47Å
165	A	97.5	Very high	97.2	Very high	33 Å²	33	49.7 Å²	49.7	27%	0.273	27%	0.273	S	S	.	.	S	Bend	trans	-66.6	145.3	177.3	0	0	0	0	0	111.7	D161 R162 I163 D167 Y168	D161-A165 PolarHBondContact O-N 3.42Å; R162-A165 WeakPolarHBondContact O-CB 3.5Å; R162-A165 PolarHBondContact O-N 3.18Å; I163-A165 VanDerWaalsContact C-N 3.28Å; I163-A165 PolarHBondContact O-N 3Å; A165-D167 VanDerWaalsContact C-N 3.27Å; A165-D167 PolarHBondContact O-N 2.72Å; A165-Y168 WeakPolarHBondContact O-CB 3.43Å; A165-Y168 PolarHBondContact O-N 2.63Å; A165-Y168 VanDerWaalsContact O-N 3.11Å
166	A	94.8	Very high	97.1	Very high	109 Å²	109	47.2 Å²	47.2	90%	0.901	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.3	-176.1	0	0	0	0	0	113.1
167	D	95.5	Very high	97.1	Very high	134 Å²	134	49.6 Å²	49.6	72%	0.717	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	8.7	179.4	64.7	-28.9	0	0	0	113.3	A165 Q169	A165-D167 VanDerWaalsContact C-N 3.27Å; A165-D167 PolarHBondContact O-N 2.72Å; D167-Q169 PolarHBondContact O-N 3.25Å
168	Y	97.4	Very high	97	Very high	9 Å²	9	49.9 Å²	49.9	4%	0.035	27%	0.274	C	S	.	.			trans	-51.8	131.2	-177.5	170.6	-115.6	0	0	0	112.4	K70 V73 Y74 R162 I163 A165 P170 D174	K70-Y168 VanDerWaalsContact CE-O 3.28Å; K70-Y168 WeakPolarHBondContact CE-O 3.16Å; K70-Y168 HydrophobicContact CG-CD1 4.42Å; K70-Y168 HydrophobicContact CG-CE1 4.38Å; K70-Y168 PolarHBondContact NZ-O 2.88Å; V73-Y168 HydrophobicContact CG1-CE1 4.39Å; V73-Y168 WeakPolarHBondContact CG1-OH 3.42Å; Y74-Y168 AromaticContact CE1-CD1 3.69Å; Y74-Y168 HydrophobicContact CE1-CD1 3.69Å; Y74-Y168 AromaticContact CE1-CE1 3.9Å; Y74-Y168 HydrophobicContact CE1-CE1 3.9Å; Y74-Y168 AromaticContact CZ-CD1 3.88Å; R162-Y168 HydrophobicContact CG-CD2 4.41Å; R162-Y168 VanDerWaalsContact O-CD2 3.26Å; R162-Y168 WeakPolarHBondContact O-CD2 3.48Å; I163-Y168 HydrophobicContact CG1-CE2 4.13Å; I163-Y168 HydrophobicContact CG2-CD1 4.41Å; I163-Y168 HydrophobicContact CG2-CE1 4.06Å; I163-Y168 WeakPolarHBondContact O-CB 3.35Å; I163-Y168 WeakPolarHBondContact O-CD1 3.27Å; A165-Y168 WeakPolarHBondContact O-CB 3.43Å; A165-Y168 PolarHBondContact O-N 2.63Å; A165-Y168 VanDerWaalsContact O-N 3.11Å; Y168-P170 HydrophobicContact CE1-CG 4.02Å; Y168-P170 WeakPolarHBondContact OH-CA 3.34Å; Y168-D174 PolarHBondContact OH-OD2 3.14Å
169	Q	95.9	Very high	96.8	Very high	142 Å²	142	49.2 Å²	49.2	66%	0.664	26%	0.264	S	S	*	.			trans	-126.5	129.7	167	-63.1	-170.1	25.1	0	0	108.9	V66 D167 T171	V66-Q169 HydrophobicContact CG1-CB 4.21Å; D167-Q169 PolarHBondContact O-N 3.25Å; Q169-T171 PolarHBondContact O-N 3.29Å
170	P	97.1	Very high	96.5	Very high	8 Å²	8	52.2 Å²	52.2	5%	0.052	28%	0.282	C	S	.	.			trans	-52.3	128.4	172.9	-27.4	30.7	0	0	0	112.2	V66 K70 V73 Y168 D174 I175	V66-P170 HydrophobicContact CG1-CG 4.29Å; K70-P170 HydrophobicContact CB-CG 3.6Å; K70-P170 HydrophobicContact CG-CG 4.14Å; V73-P170 HydrophobicContact CG2-CB 4.45Å; V73-P170 HydrophobicContact CG2-CG 4.4Å; Y168-P170 HydrophobicContact CE1-CG 4.02Å; Y168-P170 WeakPolarHBondContact OH-CA 3.34Å; P170-D174 HydrophobicContact CB-CB 4.13Å; P170-I175 HydrophobicContact CB-CD1 4.41Å; P170-I175 HydrophobicContact CB-CG1 3.98Å
171	T	96.1	Very high	96.1	Very high	60 Å²	60	57.4 Å²	57.4	37%	0.368	30%	0.304	S	S	.	.			trans	-77.9	166.3	166.9	65.8	0	0	0	0	110.2	R162 Q169 Q173 D174 I175	R162-T171 PolarHBondContact NH1-OG1 3.41Å; Q169-T171 PolarHBondContact O-N 3.29Å; T171-Q173 PolarHBondContact O-N 3.04Å; T171-D174 WeakPolarHBondContact CB-OD2 3.46Å; T171-D174 PolarHBondContact N-OD2 3.3Å; T171-D174 WeakPolarHBondContact O-CB 3.31Å; T171-D174 PolarHBondContact O-N 2.96Å; T171-D174 PolarHBondContact OG1-N 2.91Å; T171-D174 PolarHBondContact OG1-OD2 2.95Å; T171-I175 WeakPolarHBondContact O-CG1 3.31Å; T171-I175 PolarHBondContact O-N 2.61Å
172	E	95.3	Very high	95.6	Very high	94 Å²	94	54.1 Å²	54.1	44%	0.439	29%	0.287	S	S	.	.	H	α-helix	trans	-55.8	-36.3	173.5	-58.2	-172.9	144	0	0	112.2	I55 F61 I175 L176	I55-E172 HydrophobicContact CD1-CB 4.45Å; F61-E172 HydrophobicContact CD2-CB 4.42Å; F61-E172 HydrophobicContact CD2-CG 4.23Å; E172-I175 PolarHBondContact O-N 3.42Å; E172-L176 WeakPolarHBondContact O-CB 3.4Å; E172-L176 VanDerWaalsContact O-CG 3.31Å; E172-L176 WeakPolarHBondContact O-CG 3.22Å; E172-L176 PolarHBondContact O-N 3.23Å
173	Q	96.1	Very high	95.2	Very high	66 Å²	66	54.4 Å²	54.4	31%	0.308	30%	0.299	S	S	.	.	H	α-helix	trans	-66.7	-36.4	176.3	-77.7	-64.2	-33.8	0	0	112.7	T171 R177 T327	T171-Q173 PolarHBondContact O-N 3.04Å; Q173-R177 WeakPolarHBondContact O-CB 3.26Å; Q173-R177 VanDerWaalsContact O-CG 3.27Å; Q173-R177 WeakPolarHBondContact O-CG 3.43Å; Q173-R177 PolarHBondContact O-N 2.87Å; Q173-T327 PolarHBondContact NE2-O 3.21Å
174	D	97.7	Very high	94.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.7	-47.9	172.1	-56.4	-46.6	0	0	0	109.8	V73 Y155 Y156 R162 Y168 P170 T171 L176 R177 T178	V73-D174 HydrophobicContact CG2-CB 4.03Å; Y155-D174 WeakPolarHBondContact CE1-OD1 3.27Å; Y155-D174 VanDerWaalsContact CZ-OD1 3.26Å; Y155-D174 PolarHBondContact OH-OD1 3.25Å; Y156-D174 HydrophobicContact CE1-CB 4.45Å; Y156-D174 PolarHBondContact OH-O 3.01Å; R162-D174 IonicContact CZ-OD1 2.76Å; R162-D174 IonicContact CZ-OD2 2.79Å; R162-D174 IonicContact NH1-OD1 2.82Å; R162-D174 PolarHBondContact NH1-OD1 3.16Å; R162-D174 IonicContact NH1-OD2 2.93Å; R162-D174 PolarHBondContact NH1-OD2 3.24Å; R162-D174 IonicContact NH2-OD1 3.42Å; R162-D174 PolarHBondContact NH2-OD1 3.18Å; R162-D174 IonicContact NH2-OD2 3Å; Y168-D174 PolarHBondContact OH-OD2 3.14Å; P170-D174 HydrophobicContact CB-CB 4.13Å; T171-D174 WeakPolarHBondContact CB-OD2 3.46Å; T171-D174 PolarHBondContact N-OD2 3.3Å; T171-D174 WeakPolarHBondContact O-CB 3.31Å; T171-D174 PolarHBondContact O-N 2.96Å; T171-D174 PolarHBondContact OG1-N 2.91Å; T171-D174 PolarHBondContact OG1-OD2 2.95Å; D174-L176 PolarHBondContact O-N 3.18Å; D174-R177 PolarHBondContact O-N 3.01Å; D174-T178 WeakPolarHBondContact O-CG2 3.5Å; D174-T178 PolarHBondContact O-N 3Å; D174-T178 VanDerWaalsContact O-N 3.09Å
175	I	97	Very high	94.6	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-45	-179.3	-62.5	172.7	0	0	0	111.4	K51 F61 V66 Y69 P170 T171 E172 R177 T178	K51-I175 PolarHBondContact NZ-O 3.16Å; F61-I175 HydrophobicContact CB-CD1 3.85Å; F61-I175 HydrophobicContact CD1-CD1 4.35Å; F61-I175 HydrophobicContact CD1-CG2 3.96Å; F61-I175 HydrophobicContact CD2-CB 4.21Å; F61-I175 HydrophobicContact CD2-CD1 3.81Å; F61-I175 HydrophobicContact CD2-CG2 4Å; F61-I175 HydrophobicContact CE1-CG2 3.6Å; F61-I175 HydrophobicContact CE2-CB 4Å; F61-I175 HydrophobicContact CE2-CD1 4.46Å; F61-I175 HydrophobicContact CE2-CG2 3.62Å; F61-I175 HydrophobicContact CG-CD1 3.74Å; F61-I175 HydrophobicContact CG-CG2 4.16Å; F61-I175 HydrophobicContact CZ-CB 4.31Å; F61-I175 HydrophobicContact CZ-CG2 3.43Å; F61-I175 VanDerWaalsContact CZ-CG2 3.43Å; V66-I175 HydrophobicContact CG2-CD1 4.3Å; Y69-I175 HydrophobicContact CD1-CG2 4.02Å; Y69-I175 HydrophobicContact CD2-CB 4.46Å; Y69-I175 HydrophobicContact CD2-CD1 4.2Å; Y69-I175 HydrophobicContact CD2-CG1 4.14Å; Y69-I175 HydrophobicContact CD2-CG2 3.54Å; Y69-I175 HydrophobicContact CE1-CG2 4.11Å; Y69-I175 HydrophobicContact CE2-CG2 3.67Å; Y69-I175 HydrophobicContact CG-CB 4.41Å; Y69-I175 HydrophobicContact CG-CG1 4.08Å; Y69-I175 HydrophobicContact CG-CG2 3.74Å; P170-I175 HydrophobicContact CB-CD1 4.41Å; P170-I175 HydrophobicContact CB-CG1 3.98Å; T171-I175 WeakPolarHBondContact O-CG1 3.31Å; T171-I175 PolarHBondContact O-N 2.61Å; E172-I175 PolarHBondContact O-N 3.42Å; I175-R177 PolarHBondContact O-N 3.32Å; I175-T178 PolarHBondContact O-N 2.78Å; I175-T178 PolarHBondContact O-OG1 3.28Å
176	L	96	Very high	94.3	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-57.5	-38.2	176.6	-79.6	170.2	0	0	0	112.4	T48 K51 Q52 I55 E172 D174	T48-L176 HydrophobicContact CG2-CD2 4.14Å; K51-L176 HydrophobicContact CB-CD2 3.76Å; Q52-L176 HydrophobicContact CG-CD2 3.8Å; I55-L176 HydrophobicContact CD1-CD1 3.66Å; I55-L176 HydrophobicContact CD1-CD2 3.76Å; I55-L176 HydrophobicContact CD1-CG 3.75Å; E172-L176 WeakPolarHBondContact O-CB 3.4Å; E172-L176 VanDerWaalsContact O-CG 3.31Å; E172-L176 WeakPolarHBondContact O-CG 3.22Å; E172-L176 PolarHBondContact O-N 3.23Å; D174-L176 PolarHBondContact O-N 3.18Å
177	R	96.9	Very high	94.2	Very high	50 Å²	50	57.9 Å²	57.9	19%	0.189	30%	0.298	C	S	.	.	H	α-helix	trans	-84.7	-7.1	-177.5	-72.9	177.3	-177.8	-84.3	-3.2	113.8	S152 Y155 Y156 Q173 D174 I175 T327	S152-R177 WeakPolarHBondContact OG-CB 3.45Å; S152-R177 PolarHBondContact OG-O 2.94Å; S152-R177 VanDerWaalsContact OG-O 3.09Å; Y155-R177 HydrophobicContact CD1-CB 4.4Å; Y155-R177 HydrophobicContact CD1-CG 4.46Å; Y155-R177 HydrophobicContact CE1-CB 4.49Å; Y156-R177 HydrophobicContact CE2-CB 4.41Å; Y156-R177 PolarHBondContact OH-O 3.05Å; Q173-R177 WeakPolarHBondContact O-CB 3.26Å; Q173-R177 VanDerWaalsContact O-CG 3.27Å; Q173-R177 WeakPolarHBondContact O-CG 3.43Å; Q173-R177 PolarHBondContact O-N 2.87Å; D174-R177 PolarHBondContact O-N 3.01Å; I175-R177 PolarHBondContact O-N 3.32Å; R177-T327 HydrophobicContact CG-CG2 4.06Å; R177-T327 PolarHBondContact NH2-OG1 2.92Å
178	T	96.9	Very high	94.1	Very high	8 Å²	8	52.7 Å²	52.7	5%	0.049	27%	0.271	C	S	.	.			trans	-66.4	136.7	175.1	57.8	0	0	0	0	110.8	K51 Y69 V72 V73 N76 Y156 D174 I175	K51-T178 PolarHBondContact NZ-O 3.45Å; K51-T178 PolarHBondContact NZ-OG1 2.89Å; Y69-T178 HydrophobicContact CD1-CG2 4.24Å; Y69-T178 WeakPolarHBondContact CD1-OG1 3.24Å; V72-T178 HydrophobicContact CB-CG2 4.27Å; V72-T178 HydrophobicContact CG1-CG2 3.94Å; V73-T178 HydrophobicContact CG2-CG2 3.48Å; V73-T178 VanDerWaalsContact CG2-CG2 3.48Å; N76-T178 WeakPolarHBondContact OD1-CA 3.41Å; Y156-T178 WeakPolarHBondContact OH-CA 3.35Å; Y156-T178 PolarHBondContact OH-N 3.41Å; D174-T178 WeakPolarHBondContact O-CG2 3.5Å; D174-T178 PolarHBondContact O-N 3Å; D174-T178 VanDerWaalsContact O-N 3.09Å; I175-T178 PolarHBondContact O-N 2.78Å; I175-T178 PolarHBondContact O-OG1 3.28Å
179	R	93.9	Very high	93.8	Very high	84 Å²	84	57.5 Å²	57.5	32%	0.317	29%	0.293	S	S	.	.			trans	-109.4	110.1	178.2	177.4	-179.6	162.9	154.6	1.3	108.5	E43 N76	E43-R179 IonicContact OE1-CZ 3.34Å; E43-R179 IonicContact OE1-NH1 3.66Å; E43-R179 PolarHBondContact OE1-NH1 2.96Å; E43-R179 IonicContact OE1-NH2 3.51Å; E43-R179 PolarHBondContact OE1-NH2 3.34Å; E43-R179 IonicContact OE2-NH1 3.25Å; E43-R179 PolarHBondContact OE2-NH1 3.39Å; N76-R179 PolarHBondContact ND2-O 3.01Å; N76-R179 PolarHBondContact OD1-N 3.18Å; N76-R179 PolarHBondContact OD1-O 3.03Å
180	V	92.1	Very high	93.6	Very high	87 Å²	87	51.2 Å²	51.2	53%	0.527	26%	0.264	S	S	.	.			trans	-120.8	132	168.2	-177.4	0	0	0	0	106.7	V72 T182	V72-V180 HydrophobicContact CG1-CG2 3.6Å; V72-V180 HydrophobicContact CG2-CG2 4.38Å; V180-T182 PolarHBondContact O-N 3.27Å; V180-T182 VanDerWaalsContact O-N 3.12Å
181	K	90.3	Very high	93.2	Very high	114 Å²	114	54.6 Å²	54.6	50%	0.496	28%	0.284	S	S	.	.			trans	-68.8	110.8	176.2	175.1	177.1	164.2	165.8	0	108.5	T183	K181-T183 PolarHBondContact O-N 3.03Å
182	T	88.3	Confident	92.8	Very high	33 Å²	33	53.4 Å²	53.4	20%	0.202	27%	0.274	C	S	.	.			trans	-67.2	123.3	175.2	-46.6	0	0	0	0	110.3	S47 V180 V186	S47-T182 PolarHBondContact OG-OG1 3.01Å; V180-T182 PolarHBondContact O-N 3.27Å; V180-T182 VanDerWaalsContact O-N 3.12Å; T182-V186 HydrophobicContact CG2-CG2 4.45Å
183	T	89	Confident	92.3	Very high	95 Å²	95	53.2 Å²	53.2	58%	0.583	27%	0.272	S	S	*	.			trans	-115.8	131.3	174.9	56.1	0	0	0	0	109.4	K181	K181-T183 PolarHBondContact O-N 3.03Å
184	G	89.9	Confident	91.7	Very high	17 Å²	17	56.6 Å²	56.6	18%	0.175	29%	0.292	C	S	.	.	S	Bend	trans	80.4	-147.8	-177.8	0	0	0	0	0	113.7	G203 E208	G184-G203 PolarHBondContact O-N 3.4Å; G184-E208 PolarHBondContact N-OE2 3.37Å
185	I	92.3	Very high	91.2	Very high	63 Å²	63	57.7 Å²	57.7	32%	0.323	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.3	-174.9	-52.7	-178.8	0	0	0	107	F200 D201 V202 H214	I185-F200 HydrophobicContact CG2-CD1 3.85Å; I185-D201 WeakPolarHBondContact CA-O 3.43Å; I185-V202 HydrophobicContact CB-CG1 4.38Å; I185-V202 HydrophobicContact CG1-CG1 3.98Å; I185-V202 HydrophobicContact CG2-CG1 4.06Å; I185-H214 HydrophobicContact CD1-CB 4.09Å
186	V	92	Very high	90.9	Very high	67 Å²	67	61.2 Å²	61.2	41%	0.406	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.4	174.8	-179.5	0	0	0	0	107.7	T182 F200 D201	T182-V186 HydrophobicContact CG2-CG2 4.45Å; V186-F200 WeakPolarHBondContact O-CA 3.39Å; V186-D201 HydrophobicContact CB-CB 4.49Å; V186-D201 PolarHBondContact N-O 3.45Å; V186-D201 PolarHBondContact O-N 2.77Å
187	E	93.7	Very high	90.7	Very high	83 Å²	83	61.2 Å²	61.2	39%	0.388	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.2	174.9	-171.4	176.4	-179.2	0	0	109.2	H189 R198 L199 F200	E187-H189 WeakPolarHBondContact CG-NE2 3.4Å; E187-H189 IonicContact OE1-CE1 2.66Å; E187-H189 PolarHBondContact OE1-CE1 2.96Å; E187-H189 IonicContact OE1-NE2 3.76Å; E187-H189 PolarHBondContact OE1-NE2 2.8Å; E187-H189 VanDerWaalsContact OE1-NE2 3.14Å; E187-H189 IonicContact OE2-NE2 3.97Å; E187-R198 WeakPolarHBondContact OE1-CD 2.98Å; E187-L199 CarbonylContact C-O 3.47Å; E187-L199 WeakPolarHBondContact CA-O 3.33Å; E187-F200 HydrophobicContact CB-CD1 4.21Å; E187-F200 HydrophobicContact CB-CE1 3.98Å; E187-F200 HydrophobicContact CB-CZ 4.41Å; E187-F200 HydrophobicContact CG-CD1 4.24Å; E187-F200 HydrophobicContact CG-CE1 3.76Å; E187-F200 HydrophobicContact CG-CE2 4.08Å; E187-F200 HydrophobicContact CG-CZ 3.68Å; E187-F200 VanDerWaalsContact OE1-CZ 3.26Å; E187-F200 WeakPolarHBondContact OE1-CZ 3.47Å; E187-F200 WeakPolarHBondContact OE2-CE1 3.36Å; E187-F200 WeakPolarHBondContact OE2-CZ 3.48Å
188	T	91.9	Very high	90.6	Very high	25 Å²	25	62.7 Å²	62.7	15%	0.153	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.9	176.5	-56.9	0	0	0	0	109.3	V50 L199	V50-T188 HydrophobicContact CG1-CG2 4.48Å; V50-T188 WeakPolarHBondContact CG1-OG1 3.35Å; T188-L199 PolarHBondContact N-O 3.44Å; T188-L199 PolarHBondContact O-N 2.79Å
189	H	92.6	Very high	90.5	Very high	110 Å²	110	62.4 Å²	62.4	51%	0.509	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.1	-174.5	-65.2	-121.6	0	0	0	109.5	E187 F197	E187-H189 WeakPolarHBondContact CG-NE2 3.4Å; E187-H189 IonicContact OE1-CE1 2.66Å; E187-H189 PolarHBondContact OE1-CE1 2.96Å; E187-H189 IonicContact OE1-NE2 3.76Å; E187-H189 PolarHBondContact OE1-NE2 2.8Å; E187-H189 VanDerWaalsContact OE1-NE2 3.14Å; E187-H189 IonicContact OE2-NE2 3.97Å; H189-F197 WeakPolarHBondContact CA-O 3.43Å
190	F	91.3	Very high	90.5	Very high	10 Å²	10	59.4 Å²	59.4	4%	0.044	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160.5	173.3	59.8	-86.1	0	0	0	110.4	M53 H57 F192 F197 L199 F336	M53-F190 HydrophobicContact CB-CD1 4.13Å; M53-F190 HydrophobicContact CB-CE1 3.99Å; M53-F190 HydrophobicContact CB-CZ 4.42Å; M53-F190 HydrophobicContact CG-CD1 4.46Å; M53-F190 HydrophobicContact CG-CE1 3.82Å; M53-F190 HydrophobicContact CG-CZ 4.01Å; M53-F190 HydrophobicContact SD-CE1 4.13Å; M53-F190 HydrophobicContact SD-CE2 4.16Å; M53-F190 HydrophobicContact SD-CZ 3.67Å; H57-F190 HydrophobicContact CB-CB 4.05Å; H57-F190 HydrophobicContact CB-CD2 3.83Å; H57-F190 HydrophobicContact CB-CG 4.19Å; H57-F190 AromaticContact CD2-CD2 3.67Å; H57-F190 AromaticContact CD2-CE2 3.64Å; H57-F190 AromaticContact CG-CD2 3.87Å; F190-F192 HydrophobicContact CD2-CB 4.32Å; F190-F192 HydrophobicContact CE2-CB 4.39Å; F190-F197 HydrophobicContact CD1-CB 4.06Å; F190-F197 HydrophobicContact CD2-CB 3.9Å; F190-F197 HydrophobicContact CD2-CD2 4.15Å; F190-F197 HydrophobicContact CD2-CG 4.25Å; F190-F197 HydrophobicContact CE1-CB 3.7Å; F190-F197 HydrophobicContact CE2-CB 3.52Å; F190-F197 HydrophobicContact CE2-CD1 4.33Å; F190-F197 AromaticContact CE2-CD2 3.71Å; F190-F197 HydrophobicContact CE2-CD2 3.71Å; F190-F197 AromaticContact CE2-CG 3.59Å; F190-F197 HydrophobicContact CE2-CG 3.59Å; F190-F197 HydrophobicContact CG-CB 4.16Å; F190-F197 HydrophobicContact CZ-CB 3.41Å; F190-F197 VanDerWaalsContact CZ-CB 3.41Å; F190-F197 HydrophobicContact CZ-CD1 4.2Å; F190-F197 HydrophobicContact CZ-CD2 4.34Å; F190-F197 AromaticContact CZ-CG 3.75Å; F190-F197 HydrophobicContact CZ-CG 3.75Å; F190-F197 PolarHBondContact N-O 3.06Å; F190-F197 VanDerWaalsContact N-O 3.15Å; F190-F197 PolarHBondContact O-N 2.95Å; F190-L199 HydrophobicContact CE1-CB 4.02Å; F190-L199 HydrophobicContact CE1-CD2 4.23Å; F190-F336 AromaticContact CE2-CE1 3.74Å; F190-F336 HydrophobicContact CE2-CE1 3.74Å; F190-F336 AromaticContact CE2-CZ 3.78Å; F190-F336 HydrophobicContact CE2-CZ 3.78Å; F190-F336 HydrophobicContact CZ-CE1 4.01Å; F190-F336 HydrophobicContact CZ-CE2 4.34Å; F190-F336 AromaticContact CZ-CZ 3.55Å; F190-F336 HydrophobicContact CZ-CZ 3.55Å
191	T	88.7	Confident	90.7	Very high	78 Å²	78	55.5 Å²	55.5	48%	0.479	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130	178	-61.9	0	0	0	0	109.6	L195 H196	T191-L195 WeakPolarHBondContact CA-O 3.42Å; T191-H196 PolarHBondContact OG1-ND1 2.86Å
192	F	86.6	Confident	90.8	Very high	35 Å²	35	50.1 Å²	50.1	15%	0.154	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	134.2	179	-178.4	-118.4	0	0	0	110.9	H57 F190 N194 L195 F197 F336 D337 T340	H57-F192 AromaticContact CE1-CD2 3.28Å; H57-F192 WeakPolarHBondContact CE1-CD2 3.27Å; H57-F192 AromaticContact CE1-CE2 3.64Å; H57-F192 AromaticContact CE1-CG 3.56Å; H57-F192 AromaticContact ND1-CD2 3.45Å; H57-F192 WeakPolarHBondContact ND1-CD2 3.46Å; H57-F192 AromaticContact ND1-CG 3.9Å; F190-F192 HydrophobicContact CD2-CB 4.32Å; F190-F192 HydrophobicContact CE2-CB 4.39Å; F192-N194 PolarHBondContact O-N 3.48Å; F192-N194 VanDerWaalsContact O-N 3.15Å; F192-L195 PolarHBondContact N-O 3.1Å; F192-L195 WeakPolarHBondContact O-CB 3.07Å; F192-L195 PolarHBondContact O-N 3.5Å; F192-F197 HydrophobicContact CB-CD2 4.05Å; F192-F197 HydrophobicContact CB-CE2 3.83Å; F192-F197 HydrophobicContact CD1-CE2 4.29Å; F192-F336 HydrophobicContact CD1-CD1 4.28Å; F192-F336 HydrophobicContact CD1-CE1 4.14Å; F192-F336 HydrophobicContact CE1-CD1 4.46Å; F192-D337 WeakPolarHBondContact CZ-OD1 3.39Å; F192-T340 HydrophobicContact CD1-CG2 3.89Å; F192-T340 HydrophobicContact CE1-CG2 3.9Å
193	K	85.1	Confident	91.1	Very high	91 Å²	91	48.6 Å²	48.6	40%	0.396	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	40.5	-175.8	-69.4	178.1	173.4	173.4	0	113.9	L195 T340 D341 I344	K193-L195 PolarHBondContact O-N 3.31Å; K193-T340 HydrophobicContact CD-CG2 3.91Å; K193-D341 IonicContact NZ-OD1 2.8Å; K193-D341 PolarHBondContact NZ-OD1 3.1Å; K193-D341 IonicContact NZ-OD2 3.55Å; K193-D341 PolarHBondContact NZ-OD2 2.91Å; K193-I344 HydrophobicContact CD-CD1 4.48Å
194	N	83.9	Confident	91.1	Very high	137 Å²	137	44.4 Å²	44.4	73%	0.733	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.2	17.8	-175.8	-59.6	-29	0	0	0	115.6	F192	F192-N194 PolarHBondContact O-N 3.48Å; F192-N194 VanDerWaalsContact O-N 3.15Å
195	L	87.2	Confident	91	Very high	22 Å²	22	45 Å²	45	12%	0.115	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	148.1	169.3	-62.5	174.2	0	0	0	110.2	K32 V34 T191 F192 K193 F197 T340 I344	K32-L195 HydrophobicContact CB-CD2 4.23Å; V34-L195 HydrophobicContact CG2-CB 4.36Å; V34-L195 HydrophobicContact CG2-CD1 4.06Å; T191-L195 WeakPolarHBondContact CA-O 3.42Å; F192-L195 PolarHBondContact N-O 3.1Å; F192-L195 WeakPolarHBondContact O-CB 3.07Å; F192-L195 PolarHBondContact O-N 3.5Å; K193-L195 PolarHBondContact O-N 3.31Å; L195-F197 HydrophobicContact CB-CD2 4.25Å; L195-F197 HydrophobicContact CB-CE2 3.72Å; L195-F197 HydrophobicContact CB-CZ 4.33Å; L195-F197 HydrophobicContact CD1-CE2 4.3Å; L195-F197 HydrophobicContact CD1-CZ 4.17Å; L195-T340 HydrophobicContact CD1-CG2 4.44Å; L195-I344 HydrophobicContact CD1-CD1 3.88Å; L195-I344 HydrophobicContact CD1-CG1 3.55Å
196	H	90.3	Very high	91	Very high	76 Å²	76	46.6 Å²	46.6	35%	0.352	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.7	176.4	-58.5	-57.2	0	0	0	108.9	K32 D33 V34 T191	K32-H196 PolarHBondContact O-N 2.66Å; D33-H196 WeakPolarHBondContact CA-O 3.47Å; D33-H196 WeakPolarHBondContact OD1-CB 3.36Å; D33-H196 IonicContact OD1-CD2 3.48Å; D33-H196 IonicContact OD1-CG 3.74Å; V34-H196 PolarHBondContact N-O 3.48Å; T191-H196 PolarHBondContact OG1-ND1 2.86Å
197	F	92.3	Very high	90.8	Very high	1 Å²	1	46.7 Å²	46.7	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	132.8	-179.6	-73.3	-93.2	0	0	0	110.5	V34 L36 H189 F190 F192 L195 F336 T340 I343	V34-F197 HydrophobicContact CB-CD1 3.8Å; V34-F197 HydrophobicContact CB-CE1 3.88Å; V34-F197 HydrophobicContact CB-CG 4.4Å; V34-F197 HydrophobicContact CB-CZ 4.5Å; V34-F197 HydrophobicContact CG1-CD1 3.73Å; V34-F197 HydrophobicContact CG1-CE1 3.61Å; V34-F197 HydrophobicContact CG2-CE1 4.34Å; V34-F197 WeakPolarHBondContact O-CA 3.18Å; L36-F197 HydrophobicContact CD1-CD1 3.58Å; L36-F197 HydrophobicContact CD1-CE1 3.88Å; L36-F197 HydrophobicContact CG-CD1 4.05Å; L36-F197 HydrophobicContact CG-CE1 4.45Å; H189-F197 WeakPolarHBondContact CA-O 3.43Å; F190-F197 HydrophobicContact CD1-CB 4.06Å; F190-F197 HydrophobicContact CD2-CB 3.9Å; F190-F197 HydrophobicContact CD2-CD2 4.15Å; F190-F197 HydrophobicContact CD2-CG 4.25Å; F190-F197 HydrophobicContact CE1-CB 3.7Å; F190-F197 HydrophobicContact CE2-CB 3.52Å; F190-F197 HydrophobicContact CE2-CD1 4.33Å; F190-F197 AromaticContact CE2-CD2 3.71Å; F190-F197 HydrophobicContact CE2-CD2 3.71Å; F190-F197 AromaticContact CE2-CG 3.59Å; F190-F197 HydrophobicContact CE2-CG 3.59Å; F190-F197 HydrophobicContact CG-CB 4.16Å; F190-F197 HydrophobicContact CZ-CB 3.41Å; F190-F197 VanDerWaalsContact CZ-CB 3.41Å; F190-F197 HydrophobicContact CZ-CD1 4.2Å; F190-F197 HydrophobicContact CZ-CD2 4.34Å; F190-F197 AromaticContact CZ-CG 3.75Å; F190-F197 HydrophobicContact CZ-CG 3.75Å; F190-F197 PolarHBondContact N-O 3.06Å; F190-F197 VanDerWaalsContact N-O 3.15Å; F190-F197 PolarHBondContact O-N 2.95Å; F192-F197 HydrophobicContact CB-CD2 4.05Å; F192-F197 HydrophobicContact CB-CE2 3.83Å; F192-F197 HydrophobicContact CD1-CE2 4.29Å; L195-F197 HydrophobicContact CB-CD2 4.25Å; L195-F197 HydrophobicContact CB-CE2 3.72Å; L195-F197 HydrophobicContact CB-CZ 4.33Å; L195-F197 HydrophobicContact CD1-CE2 4.3Å; L195-F197 HydrophobicContact CD1-CZ 4.17Å; F197-F336 HydrophobicContact CD1-CZ 4.18Å; F197-F336 HydrophobicContact CE1-CE1 4.4Å; F197-F336 HydrophobicContact CE1-CZ 4.07Å; F197-F336 HydrophobicContact CZ-CE1 4.38Å; F197-F336 HydrophobicContact CZ-CZ 4.5Å; F197-T340 HydrophobicContact CZ-CG2 3.94Å; F197-I343 HydrophobicContact CE1-CD1 4.43Å
198	R	93.7	Very high	90.8	Very high	81 Å²	81	43.6 Å²	43.6	31%	0.306	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	104.2	166.9	-66.6	-178.8	-71.5	172.1	-4.5	108.4	V34 L36 E187 F200	V34-R198 PolarHBondContact O-N 3.33Å; L36-R198 PolarHBondContact N-O 3.26Å; E187-R198 WeakPolarHBondContact OE1-CD 2.98Å; R198-F200 HydrophobicContact CB-CE2 3.86Å
199	L	94.6	Very high	90.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.4	-177.2	-174.9	66.1	0	0	0	110	L36 L38 V50 M53 E187 T188 F190	L36-L199 HydrophobicContact CB-CD1 3.57Å; L36-L199 HydrophobicContact CD1-CD1 4.31Å; L36-L199 WeakPolarHBondContact O-CA 3.45Å; L38-L199 HydrophobicContact CD1-CD1 3.69Å; L38-L199 HydrophobicContact CD1-CD2 3.77Å; L38-L199 HydrophobicContact CD1-CG 3.73Å; L38-L199 HydrophobicContact CG-CD1 3.67Å; L38-L199 HydrophobicContact CG-CG 4.26Å; V50-L199 HydrophobicContact CG2-CD2 4.07Å; M53-L199 HydrophobicContact CG-CD2 3.7Å; E187-L199 CarbonylContact C-O 3.47Å; E187-L199 WeakPolarHBondContact CA-O 3.33Å; T188-L199 PolarHBondContact N-O 3.44Å; T188-L199 PolarHBondContact O-N 2.79Å; F190-L199 HydrophobicContact CE1-CB 4.02Å; F190-L199 HydrophobicContact CE1-CD2 4.23Å
200	F	95.3	Very high	90.7	Very high	21 Å²	21	48.4 Å²	48.4	9%	0.092	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.5	179.4	-69.7	-96.9	0	0	0	110.1	K35 L36 L37 L38 I185 V186 E187 R198 C215	K35-F200 HydrophobicContact CD-CD2 4.43Å; K35-F200 HydrophobicContact CD-CE2 3.96Å; K35-F200 HydrophobicContact CG-CD2 3.96Å; K35-F200 HydrophobicContact CG-CE2 3.75Å; L36-F200 PolarHBondContact O-N 3.27Å; L37-F200 HydrophobicContact CD1-CB 3.74Å; L38-F200 WeakPolarHBondContact CB-O 3.39Å; L38-F200 PolarHBondContact N-O 3.45Å; I185-F200 HydrophobicContact CG2-CD1 3.85Å; V186-F200 WeakPolarHBondContact O-CA 3.39Å; E187-F200 HydrophobicContact CB-CD1 4.21Å; E187-F200 HydrophobicContact CB-CE1 3.98Å; E187-F200 HydrophobicContact CB-CZ 4.41Å; E187-F200 HydrophobicContact CG-CD1 4.24Å; E187-F200 HydrophobicContact CG-CE1 3.76Å; E187-F200 HydrophobicContact CG-CE2 4.08Å; E187-F200 HydrophobicContact CG-CZ 3.68Å; E187-F200 VanDerWaalsContact OE1-CZ 3.26Å; E187-F200 WeakPolarHBondContact OE1-CZ 3.47Å; E187-F200 WeakPolarHBondContact OE2-CE1 3.36Å; E187-F200 WeakPolarHBondContact OE2-CZ 3.48Å; R198-F200 HydrophobicContact CB-CE2 3.86Å; F200-C215 HydrophobicContact CD1-CB 4.13Å; F200-C215 HydrophobicContact CG-CB 4.43Å
201	D	94.9	Very high	90.7	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.032	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.4	169.4	-173.6	23.9	0	0	0	110.1	K46 S47 V50 I185 V186	K46-D201 VanDerWaalsContact CB-OD1 3.27Å; K46-D201 WeakPolarHBondContact CB-OD1 2.94Å; S47-D201 WeakPolarHBondContact CA-OD2 3.41Å; S47-D201 WeakPolarHBondContact CB-OD2 3.42Å; S47-D201 PolarHBondContact OG-OD2 3.29Å; V50-D201 HydrophobicContact CG2-CB 3.64Å; I185-D201 WeakPolarHBondContact CA-O 3.43Å; V186-D201 HydrophobicContact CB-CB 4.49Å; V186-D201 PolarHBondContact N-O 3.45Å; V186-D201 PolarHBondContact O-N 2.77Å
202	V	94.3	Very high	90.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	145.3	179.5	-60.8	0	0	0	0	110.9	L37 L38 L39 K46 I185 G204 W212	L37-V202 HydrophobicContact CD1-CG1 4.2Å; L38-V202 WeakPolarHBondContact O-CG2 3.45Å; L39-V202 HydrophobicContact CD2-CG2 3.51Å; K46-V202 WeakPolarHBondContact CE-O 3.39Å; I185-V202 HydrophobicContact CB-CG1 4.38Å; I185-V202 HydrophobicContact CG1-CG1 3.98Å; I185-V202 HydrophobicContact CG2-CG1 4.06Å; V202-G204 PolarHBondContact O-N 3.48Å; V202-W212 HydrophobicContact CB-CG 4.41Å; V202-W212 HydrophobicContact CG2-CD2 4.01Å; V202-W212 HydrophobicContact CG2-CG 4Å; V202-W212 HydrophobicContact CG2-CZ2 4.12Å; V202-W212 VanDerWaalsContact CG2-NE1 3.28Å
203	G	92.6	Very high	91	Very high	2 Å²	2	50.2 Å²	50.2	2%	0.021	24%	0.236	C	C	.	.			trans	-54.3	126.4	175.8	0	0	0	0	0	112.3	G184 E208 W212	G184-G203 PolarHBondContact O-N 3.4Å; G203-E208 WeakPolarHBondContact O-CB 3.49Å; G203-W212 WeakPolarHBondContact O-CZ2 3.46Å; G203-W212 PolarHBondContact O-NE1 3.42Å
204	G	89.5	Confident	91.2	Very high	7 Å²	7	53 Å²	53	7%	0.072	25%	0.25	C	C	.	.			trans	-81.9	-16.8	-174.9	0	0	0	0	0	116.1	G40 G42 V202 R209	G40-G204 WeakPolarHBondContact O-CA 3.5Å; G42-G204 PolarHBondContact N-O 3.48Å; V202-G204 PolarHBondContact O-N 3.48Å; G204-R209 PolarHBondContact O-NE 2.6Å; G204-R209 PolarHBondContact O-NH2 3.23Å
205	Q	88.9	Confident	91.6	Very high	30 Å²	30	46.6 Å²	46.6	14%	0.14	22%	0.216	C	C	.	.	S	Bend	trans	-73.4	152	-177.2	-66.2	-174.1	6.6	0	0	111	S207 E208 R209	Q205-S207 PolarHBondContact O-N 2.67Å; Q205-S207 VanDerWaalsContact O-N 3.16Å; Q205-E208 PolarHBondContact O-N 3.26Å; Q205-R209 WeakPolarHBondContact O-CG 3.45Å; Q205-R209 PolarHBondContact O-N 3.28Å
206	R	91.3	Very high	91.7	Very high	95 Å²	95	46.3 Å²	46.3	36%	0.358	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-56	-36.7	-174.5	-69	179.9	173.3	164.7	3.7	112.5	E208 R209 L235 E237 D238 E246	R206-E208 PolarHBondContact O-N 2.91Å; R206-R209 PolarHBondContact O-N 3.5Å; R206-L235 VanDerWaalsContact NH2-CD1 3.3Å; R206-E237 WeakPolarHBondContact CB-OE1 3.21Å; R206-E237 PolarHBondContact N-OE1 2.9Å; R206-E237 PolarHBondContact N-OE2 3.49Å; R206-D238 IonicContact CZ-OD2 2.71Å; R206-D238 VanDerWaalsContact CZ-OD2 3.32Å; R206-D238 IonicContact NH1-OD2 3.61Å; R206-D238 PolarHBondContact NH1-OD2 3.14Å; R206-D238 IonicContact NH2-OD2 2.86Å; R206-D238 PolarHBondContact NH2-OD2 3.38Å; R206-E246 IonicContact NE-OE1 3.57Å
207	S	89.2	Confident	91.6	Very high	69 Å²	69	49.8 Å²	49.8	48%	0.483	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-61.1	-28.9	177.2	68.4	0	0	0	0	114	Q205	Q205-S207 PolarHBondContact O-N 2.67Å; Q205-S207 VanDerWaalsContact O-N 3.16Å
208	E	92.8	Very high	91.3	Very high	18 Å²	18	56.8 Å²	56.8	8%	0.084	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-89.7	-19.6	-174.6	-62.5	-57.2	115.3	0	0	112.9	G184 G203 Q205 R206 K210 K211	G184-E208 PolarHBondContact N-OE2 3.37Å; G203-E208 WeakPolarHBondContact O-CB 3.49Å; Q205-E208 PolarHBondContact O-N 3.26Å; R206-E208 PolarHBondContact O-N 2.91Å; E208-K210 PolarHBondContact O-N 3.15Å; E208-K210 VanDerWaalsContact O-N 3.16Å; E208-K211 WeakPolarHBondContact O-CB 3.49Å; E208-K211 PolarHBondContact O-N 2.91Å; E208-K211 IonicContact OE1-NZ 3.51Å; E208-K211 PolarHBondContact OE1-NZ 3.29Å; E208-K211 IonicContact OE2-NZ 3.41Å; E208-K211 PolarHBondContact OE2-NZ 3Å
209	R	92.2	Very high	91.2	Very high	49 Å²	49	53.6 Å²	53.6	19%	0.185	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-64	-25.4	-171.3	-57.9	-174.6	-172.1	171	-5.5	114.6	G204 Q205 R206 K211 W212 E246	G204-R209 PolarHBondContact O-NE 2.6Å; G204-R209 PolarHBondContact O-NH2 3.23Å; Q205-R209 WeakPolarHBondContact O-CG 3.45Å; Q205-R209 PolarHBondContact O-N 3.28Å; R206-R209 PolarHBondContact O-N 3.5Å; R209-K211 PolarHBondContact O-N 3.07Å; R209-W212 HydrophobicContact CB-CD2 4.21Å; R209-W212 HydrophobicContact CB-CZ2 4.46Å; R209-W212 HydrophobicContact CG-CD2 4.34Å; R209-W212 HydrophobicContact CG-CH2 4.11Å; R209-W212 HydrophobicContact CG-CZ2 3.72Å; R209-W212 WeakPolarHBondContact O-CB 3.48Å; R209-W212 PolarHBondContact O-N 3.34Å; R209-W212 VanDerWaalsContact O-N 3.12Å; R209-E246 IonicContact CZ-OE1 3.19Å; R209-E246 IonicContact CZ-OE2 2.74Å; R209-E246 IonicContact NH1-OE1 3.61Å; R209-E246 PolarHBondContact NH1-OE1 3.01Å; R209-E246 IonicContact NH1-OE2 3.32Å; R209-E246 PolarHBondContact NH1-OE2 2.91Å; R209-E246 IonicContact NH2-OE1 2.71Å; R209-E246 PolarHBondContact NH2-OE1 2.77Å; R209-E246 IonicContact NH2-OE2 2.72Å; R209-E246 PolarHBondContact NH2-OE2 3.25Å
210	K	89.7	Confident	91	Very high	188 Å²	188	55.2 Å²	55.2	82%	0.817	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-60.6	-24.8	175.2	-67.4	-177.1	-179.6	178.3	0	112.5	E208	E208-K210 PolarHBondContact O-N 3.15Å; E208-K210 VanDerWaalsContact O-N 3.16Å
211	K	92	Very high	90.8	Very high	78 Å²	78	54.3 Å²	54.3	34%	0.339	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-81	-17.4	-179.5	-57.5	172.5	-169.1	168.3	0	112.5	E208 R209 I213 H214	E208-K211 WeakPolarHBondContact O-CB 3.49Å; E208-K211 PolarHBondContact O-N 2.91Å; E208-K211 IonicContact OE1-NZ 3.51Å; E208-K211 PolarHBondContact OE1-NZ 3.29Å; E208-K211 IonicContact OE2-NZ 3.41Å; E208-K211 PolarHBondContact OE2-NZ 3Å; R209-K211 PolarHBondContact O-N 3.07Å; K211-I213 VanDerWaalsContact C-N 3.26Å; K211-I213 PolarHBondContact O-N 2.62Å; K211-H214 WeakPolarHBondContact O-CB 3.49Å; K211-H214 PolarHBondContact O-CD2 2.84Å; K211-H214 PolarHBondContact O-N 3.5Å
212	W	92.8	Very high	90.8	Very high	8 Å²	8	54 Å²	54	3%	0.03	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-61.3	-34.6	-172.6	-66.7	6.8	0	0	0	112.8	L39 V202 G203 R209 H214 C215 F216 L250 I254	L39-W212 HydrophobicContact CB-CZ3 4.36Å; L39-W212 HydrophobicContact CD1-CE3 4.49Å; L39-W212 HydrophobicContact CD1-CZ3 4.44Å; L39-W212 HydrophobicContact CD2-CD2 3.91Å; L39-W212 HydrophobicContact CD2-CE3 3.67Å; L39-W212 HydrophobicContact CD2-CH2 4.25Å; L39-W212 HydrophobicContact CD2-CZ2 4.46Å; L39-W212 HydrophobicContact CD2-CZ3 3.84Å; L39-W212 HydrophobicContact CG-CZ3 4.44Å; V202-W212 HydrophobicContact CB-CG 4.41Å; V202-W212 HydrophobicContact CG2-CD2 4.01Å; V202-W212 HydrophobicContact CG2-CG 4Å; V202-W212 HydrophobicContact CG2-CZ2 4.12Å; V202-W212 VanDerWaalsContact CG2-NE1 3.28Å; G203-W212 WeakPolarHBondContact O-CZ2 3.46Å; G203-W212 PolarHBondContact O-NE1 3.42Å; R209-W212 HydrophobicContact CB-CD2 4.21Å; R209-W212 HydrophobicContact CB-CZ2 4.46Å; R209-W212 HydrophobicContact CG-CD2 4.34Å; R209-W212 HydrophobicContact CG-CH2 4.11Å; R209-W212 HydrophobicContact CG-CZ2 3.72Å; R209-W212 WeakPolarHBondContact O-CB 3.48Å; R209-W212 PolarHBondContact O-N 3.34Å; R209-W212 VanDerWaalsContact O-N 3.12Å; W212-H214 PolarHBondContact O-N 3.22Å; W212-C215 PolarHBondContact O-N 2.97Å; W212-C215 PolarHBondContact O-SG 2.93Å; W212-F216 HydrophobicContact CB-CE1 3.64Å; W212-F216 HydrophobicContact CB-CZ 3.84Å; W212-F216 WeakPolarHBondContact O-CD1 3.11Å; W212-F216 WeakPolarHBondContact O-CE1 3.27Å; W212-L250 HydrophobicContact CH2-CD1 3.93Å; W212-L250 HydrophobicContact CH2-CD2 3.9Å; W212-L250 HydrophobicContact CH2-CG 4.39Å; W212-L250 HydrophobicContact CZ3-CD1 3.74Å; W212-L250 HydrophobicContact CZ3-CD2 4.44Å; W212-L250 HydrophobicContact CZ3-CG 4.46Å; W212-I254 HydrophobicContact CE3-CD1 4.14Å; W212-I254 HydrophobicContact CZ3-CD1 4.03Å; W212-I254 HydrophobicContact CZ3-CG1 4.37Å
213	I	88.9	Confident	90.9	Very high	75 Å²	75	54 Å²	54	39%	0.385	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-55.4	-27.2	-179.9	-168.5	60.1	0	0	0	113.2	K211 C215 F216 F259	K211-I213 VanDerWaalsContact C-N 3.26Å; K211-I213 PolarHBondContact O-N 2.62Å; I213-C215 PolarHBondContact O-N 3.26Å; I213-C215 VanDerWaalsContact O-N 3.14Å; I213-F216 HydrophobicContact CD1-CB 4.35Å; I213-F216 HydrophobicContact CD1-CD2 3.6Å; I213-F216 HydrophobicContact CD1-CE2 4.23Å; I213-F216 HydrophobicContact CD1-CG 4.18Å; I213-F216 PolarHBondContact O-N 3.13Å; I213-F259 HydrophobicContact CD1-CD2 3.79Å; I213-F259 HydrophobicContact CD1-CE1 4.38Å; I213-F259 HydrophobicContact CD1-CE2 3.41Å; I213-F259 VanDerWaalsContact CD1-CE2 3.41Å; I213-F259 HydrophobicContact CD1-CG 4.46Å; I213-F259 HydrophobicContact CD1-CZ 3.74Å
214	H	88.6	Confident	91.1	Very high	150 Å²	150	54 Å²	54	69%	0.694	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-69.1	-7.8	179.5	-59.1	-58	0	0	0	114.4	I185 K211 W212	I185-H214 HydrophobicContact CD1-CB 4.09Å; K211-H214 WeakPolarHBondContact O-CB 3.49Å; K211-H214 PolarHBondContact O-CD2 2.84Å; K211-H214 PolarHBondContact O-N 3.5Å; W212-H214 PolarHBondContact O-N 3.22Å
215	C	92.1	Very high	91.6	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.014	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-121	8	178.7	59.3	0	0	0	0	113.8	K35 L37 F200 W212 I213 V219	K35-C215 VanDerWaalsContact CE-O 3.24Å; K35-C215 WeakPolarHBondContact CE-O 3.28Å; K35-C215 PolarHBondContact NZ-O 3.4Å; L37-C215 HydrophobicContact CD1-CB 4.27Å; L37-C215 WeakPolarHBondContact CD1-SG 3.39Å; F200-C215 HydrophobicContact CD1-CB 4.13Å; F200-C215 HydrophobicContact CG-CB 4.43Å; W212-C215 PolarHBondContact O-N 2.97Å; W212-C215 PolarHBondContact O-SG 2.93Å; I213-C215 PolarHBondContact O-N 3.26Å; I213-C215 VanDerWaalsContact O-N 3.14Å; C215-V219 VanDerWaalsContact O-CG2 3.27Å; C215-V219 WeakPolarHBondContact O-CG2 3.31Å
216	F	91	Very high	92	Very high	15 Å²	15	52.2 Å²	52.2	7%	0.066	25%	0.251	C	S	.	.			trans	-80.2	-17.5	-173	-76.1	12.5	0	0	0	114.8	L37 W212 I213 I254 F259 F260	L37-F216 HydrophobicContact CD2-CD1 3.69Å; L37-F216 HydrophobicContact CD2-CE1 3.71Å; W212-F216 HydrophobicContact CB-CE1 3.64Å; W212-F216 HydrophobicContact CB-CZ 3.84Å; W212-F216 WeakPolarHBondContact O-CD1 3.11Å; W212-F216 WeakPolarHBondContact O-CE1 3.27Å; I213-F216 HydrophobicContact CD1-CB 4.35Å; I213-F216 HydrophobicContact CD1-CD2 3.6Å; I213-F216 HydrophobicContact CD1-CE2 4.23Å; I213-F216 HydrophobicContact CD1-CG 4.18Å; I213-F216 PolarHBondContact O-N 3.13Å; F216-I254 HydrophobicContact CZ-CD1 4.29Å; F216-F259 HydrophobicContact CB-CB 4.34Å; F216-F259 HydrophobicContact CB-CG 4.46Å; F216-F259 HydrophobicContact CD2-CB 4.03Å; F216-F259 AromaticContact CD2-CD2 3.99Å; F216-F259 HydrophobicContact CD2-CD2 3.99Å; F216-F259 HydrophobicContact CD2-CG 4.12Å; F216-F260 HydrophobicContact CB-CE1 4.08Å; F216-F260 HydrophobicContact CB-CZ 4.01Å; F216-F260 HydrophobicContact CD1-CE1 4.2Å; F216-F260 HydrophobicContact CD1-CE2 4.21Å; F216-F260 AromaticContact CD1-CZ 3.39Å; F216-F260 HydrophobicContact CD1-CZ 3.39Å; F216-F260 HydrophobicContact CD2-CE1 4.24Å; F216-F260 AromaticContact CD2-CE2 3.79Å; F216-F260 HydrophobicContact CD2-CE2 3.79Å; F216-F260 AromaticContact CD2-CZ 3.49Å; F216-F260 HydrophobicContact CD2-CZ 3.49Å; F216-F260 VanDerWaalsContact CD2-CZ 3.49Å; F216-F260 AromaticContact CE1-CE2 3.96Å; F216-F260 HydrophobicContact CE1-CE2 3.96Å; F216-F260 AromaticContact CE1-CZ 3.53Å; F216-F260 HydrophobicContact CE1-CZ 3.53Å; F216-F260 AromaticContact CE2-CE2 3.55Å; F216-F260 HydrophobicContact CE2-CE2 3.55Å; F216-F260 AromaticContact CE2-CZ 3.66Å; F216-F260 HydrophobicContact CE2-CZ 3.66Å; F216-F260 AromaticContact CG-CE1 3.94Å; F216-F260 HydrophobicContact CG-CE1 3.94Å; F216-F260 HydrophobicContact CG-CE2 4.13Å; F216-F260 AromaticContact CG-CZ 3.35Å; F216-F260 HydrophobicContact CG-CZ 3.35Å; F216-F260 AromaticContact CZ-CE2 3.63Å; F216-F260 HydrophobicContact CZ-CE2 3.63Å; F216-F260 AromaticContact CZ-CZ 3.68Å; F216-F260 HydrophobicContact CZ-CZ 3.68Å
217	E	86.8	Confident	92.3	Very high	150 Å²	150	48.5 Å²	48.5	70%	0.701	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	139.8	178.6	-66.9	-179.6	172	0	0	111.5	K35 V219	K35-E217 PolarHBondContact NZ-O 3.4Å; E217-V219 PolarHBondContact O-N 3.06Å; E217-V219 VanDerWaalsContact O-N 3.15Å
218	D	85.7	Confident	92.8	Very high	147 Å²	147	45.2 Å²	45.2	79%	0.786	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	35.9	174.4	-54.3	-34.7	0	0	0	115.1	K35 T220	K35-D218 WeakPolarHBondContact CB-O 3.26Å; D218-T220 PolarHBondContact O-N 3.35Å
219	V	91.4	Very high	93	Very high	15 Å²	15	44.4 Å²	44.4	9%	0.091	21%	0.214	C	C	.	.			trans	-76.4	120.3	175.4	177.4	0	0	0	0	109.8	K35 L37 C215 E217 A221 I222 F260 T263	K35-V219 HydrophobicContact CD-CG2 4.3Å; K35-V219 HydrophobicContact CG-CG2 4.49Å; L37-V219 HydrophobicContact CB-CG1 3.94Å; L37-V219 HydrophobicContact CB-CG2 4.31Å; L37-V219 HydrophobicContact CD2-CG2 4.31Å; C215-V219 VanDerWaalsContact O-CG2 3.27Å; C215-V219 WeakPolarHBondContact O-CG2 3.31Å; E217-V219 PolarHBondContact O-N 3.06Å; E217-V219 VanDerWaalsContact O-N 3.15Å; V219-A221 VanDerWaalsContact CG1-O 3.28Å; V219-A221 WeakPolarHBondContact CG1-O 3.39Å; V219-I222 HydrophobicContact CG1-CG1 4.09Å; V219-F260 HydrophobicContact CB-CE1 4.46Å; V219-F260 HydrophobicContact CG2-CE1 4.35Å; V219-T263 HydrophobicContact CG1-CG2 4.08Å
220	T	90.3	Very high	93.2	Very high	35 Å²	35	42.1 Å²	42.1	22%	0.215	21%	0.205	C	C	.	.	S	Bend	trans	-69.3	-47.3	176.8	-46	0	0	0	0	111.1	V34 K35 D218 I343 N347	V34-T220 HydrophobicContact CG1-CG2 4.07Å; K35-T220 PolarHBondContact N-OG1 3.27Å; K35-T220 WeakPolarHBondContact O-CB 3.46Å; K35-T220 PolarHBondContact O-N 2.95Å; D218-T220 PolarHBondContact O-N 3.35Å; T220-I343 HydrophobicContact CG2-CG2 3.86Å; T220-N347 WeakPolarHBondContact CG2-OD1 3.42Å
221	A	92	Very high	93.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.008	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	153.4	177.1	0	0	0	0	0	111.8	K35 L36 L37 V219 I266 I343	K35-A221 PolarHBondContact O-N 3.36Å; L36-A221 WeakPolarHBondContact CA-O 3.47Å; L36-A221 HydrophobicContact CD2-CB 3.89Å; L37-A221 PolarHBondContact N-O 2.78Å; V219-A221 VanDerWaalsContact CG1-O 3.28Å; V219-A221 WeakPolarHBondContact CG1-O 3.39Å; A221-I266 HydrophobicContact CB-CD1 4Å; A221-I343 HydrophobicContact CB-CD1 4.45Å; A221-I343 HydrophobicContact CB-CG1 4.2Å
222	I	94.9	Very high	93.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.4	174.4	-65.2	167.2	0	0	0	108.8	L39 V219 F224 I254 F260 T263 S264 I265 I266	L39-I222 HydrophobicContact CB-CG2 4.33Å; L39-I222 HydrophobicContact CD1-CD1 4.48Å; L39-I222 HydrophobicContact CD1-CG2 3.91Å; L39-I222 HydrophobicContact CG-CG2 4.16Å; V219-I222 HydrophobicContact CG1-CG1 4.09Å; I222-F224 HydrophobicContact CG2-CB 4.41Å; I222-I254 HydrophobicContact CD1-CG2 3.99Å; I222-F260 HydrophobicContact CD1-CB 4.06Å; I222-F260 HydrophobicContact CD1-CD1 3.66Å; I222-F260 HydrophobicContact CD1-CD2 3.57Å; I222-F260 HydrophobicContact CD1-CE1 3.85Å; I222-F260 HydrophobicContact CD1-CE2 3.77Å; I222-F260 HydrophobicContact CD1-CG 3.5Å; I222-F260 HydrophobicContact CD1-CZ 3.87Å; I222-F260 HydrophobicContact CG1-CE1 4.47Å; I222-T263 HydrophobicContact CD1-CG2 4.15Å; I222-T263 HydrophobicContact CG1-CG2 3.98Å; I222-S264 PolarHBondContact N-O 3.08Å; I222-I265 HydrophobicContact CB-CG1 4.37Å; I222-I266 PolarHBondContact O-N 3.06Å
223	I	96.4	Very high	93.9	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	107.7	164.8	-61.2	172.9	0	0	0	107.5	L36 L37 L38 L39 I266 F268 F336	L36-I223 HydrophobicContact CD1-CD1 4.07Å; L37-I223 PolarHBondContact O-N 2.88Å; L38-I223 WeakPolarHBondContact CA-O 3.4Å; L38-I223 HydrophobicContact CD2-CB 3.64Å; L38-I223 HydrophobicContact CD2-CD1 4.32Å; L38-I223 HydrophobicContact CD2-CG2 3.54Å; L39-I223 PolarHBondContact N-O 2.73Å; I223-I266 CarbonylContact C-O 3.59Å; I223-I266 WeakPolarHBondContact CA-O 3.5Å; I223-I266 HydrophobicContact CG1-CB 4.25Å; I223-I266 HydrophobicContact CG1-CD1 4.03Å; I223-F268 HydrophobicContact CG2-CD1 4.38Å; I223-F268 HydrophobicContact CG2-CD2 3.53Å; I223-F268 HydrophobicContact CG2-CE1 4.41Å; I223-F268 HydrophobicContact CG2-CE2 3.57Å; I223-F268 HydrophobicContact CG2-CG 3.96Å; I223-F268 HydrophobicContact CG2-CZ 4.02Å; I223-F336 HydrophobicContact CD1-CE2 4.43Å
224	F	97.9	Very high	94.1	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	115.4	177.9	-164.9	-82.1	0	0	0	110.6	L39 I222 V226 L250 F251 I254 I265 I266 L267 F268 F308	L39-F224 HydrophobicContact CB-CD2 3.84Å; L39-F224 HydrophobicContact CB-CE2 4.3Å; L39-F224 WeakPolarHBondContact O-CA 3.36Å; I222-F224 HydrophobicContact CG2-CB 4.41Å; F224-V226 HydrophobicContact CD1-CG2 3.82Å; F224-V226 HydrophobicContact CE1-CG2 3.85Å; F224-L250 HydrophobicContact CE2-CD2 4.19Å; F224-L250 HydrophobicContact CE2-CG 3.99Å; F224-L250 HydrophobicContact CZ-CB 4.29Å; F224-L250 HydrophobicContact CZ-CD2 3.93Å; F224-L250 HydrophobicContact CZ-CG 3.9Å; F224-F251 HydrophobicContact CB-CD2 4.16Å; F224-F251 HydrophobicContact CB-CE2 4.19Å; F224-F251 HydrophobicContact CD1-CB 4.48Å; F224-F251 AromaticContact CD1-CD2 3.57Å; F224-F251 HydrophobicContact CD1-CD2 3.57Å; F224-F251 HydrophobicContact CD1-CE2 4.3Å; F224-F251 HydrophobicContact CD1-CG 4.47Å; F224-F251 AromaticContact CD2-CD2 3.88Å; F224-F251 HydrophobicContact CD2-CD2 3.88Å; F224-F251 HydrophobicContact CE1-CB 3.86Å; F224-F251 AromaticContact CE1-CD2 3.83Å; F224-F251 HydrophobicContact CE1-CD2 3.83Å; F224-F251 HydrophobicContact CE1-CG 4.32Å; F224-F251 HydrophobicContact CE2-CB 4.23Å; F224-F251 HydrophobicContact CE2-CD2 4.11Å; F224-F251 AromaticContact CG-CD2 3.59Å; F224-F251 HydrophobicContact CG-CD2 3.59Å; F224-F251 HydrophobicContact CG-CE2 4.12Å; F224-F251 HydrophobicContact CZ-CB 3.71Å; F224-F251 HydrophobicContact CZ-CD2 4.09Å; F224-F251 HydrophobicContact CZ-CG 4.43Å; F224-I254 HydrophobicContact CE2-CB 4.47Å; F224-I254 HydrophobicContact CE2-CG1 4.23Å; F224-I265 HydrophobicContact CB-CG2 4.3Å; F224-I266 PolarHBondContact N-O 2.99Å; F224-L267 HydrophobicContact CB-CD1 4.39Å; F224-L267 HydrophobicContact CD1-CD1 3.98Å; F224-F268 PolarHBondContact O-N 2.9Å; F224-F308 HydrophobicContact CE1-CE1 4.29Å
225	C	98	Very high	94.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.3	-177.1	-59.9	0	0	0	0	111.6	L39 G40 S44 K46 I49	L39-C225 PolarHBondContact O-N 3.25Å; G40-C225 WeakPolarHBondContact CA-O 3.48Å; S44-C225 WeakPolarHBondContact CB-O 3.15Å; S44-C225 WeakPolarHBondContact OG-CB 3.37Å; S44-C225 PolarHBondContact OG-O 3.03Å; S44-C225 VanDerWaalsContact OG-O 3.08Å; K46-C225 HydrophobicContact CG-CB 4.04Å; I49-C225 WeakPolarHBondContact CD1-SG 3.22Å
226	V	98.4	Very high	94.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.4	175.7	-179.4	0	0	0	0	109.3	F224 L228 M244 L267 F268 L269 N270 F308	F224-V226 HydrophobicContact CD1-CG2 3.82Å; F224-V226 HydrophobicContact CE1-CG2 3.85Å; V226-L228 PolarHBondContact O-N 3.23Å; V226-M244 HydrophobicContact CG1-CE 4.08Å; V226-M244 HydrophobicContact CG1-SD 3.94Å; V226-L267 HydrophobicContact CG2-CD1 3.65Å; V226-F268 PolarHBondContact N-O 3.2Å; V226-L269 HydrophobicContact CB-CD2 3.93Å; V226-L269 HydrophobicContact CG1-CD2 4.17Å; V226-L269 HydrophobicContact CG2-CD2 4.15Å; V226-N270 WeakPolarHBondContact O-CA 3.48Å; V226-N270 VanDerWaalsContact O-CB 3.3Å; V226-N270 WeakPolarHBondContact O-CB 3.31Å; V226-N270 PolarHBondContact O-N 3.05Å; V226-F308 HydrophobicContact CB-CE2 4.46Å; V226-F308 HydrophobicContact CB-CZ 4.18Å; V226-F308 HydrophobicContact CG1-CE1 4.44Å; V226-F308 HydrophobicContact CG1-CE2 3.68Å; V226-F308 HydrophobicContact CG1-CZ 3.54Å; V226-F308 HydrophobicContact CG2-CD1 4.11Å; V226-F308 HydrophobicContact CG2-CE1 3.52Å; V226-F308 HydrophobicContact CG2-CE2 4Å; V226-F308 HydrophobicContact CG2-CZ 3.48Å; V226-F308 VanDerWaalsContact CG2-CZ 3.48Å
227	A	97.9	Very high	94	Very high	17 Å²	17	30.3 Å²	30.3	14%	0.14	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	104.4	168.7	0	0	0	0	0	109.9	S229 G230 M244 K271	A227-S229 PolarHBondContact O-N 2.62Å; A227-G230 PolarHBondContact O-N 3.06Å; A227-G230 VanDerWaalsContact O-N 3.1Å; A227-M244 WeakPolarHBondContact O-CE 3.24Å; A227-K271 HydrophobicContact CB-CD 3.88Å
228	L	98.3	Very high	94	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-57.1	-39.5	175	-72.8	176.2	0	0	0	111.7	V226 G230 Y231 L269 N270 K272 F275 I304 L323	V226-L228 PolarHBondContact O-N 3.23Å; L228-G230 PolarHBondContact O-N 2.86Å; L228-Y231 WeakPolarHBondContact O-CD1 3.31Å; L228-Y231 PolarHBondContact O-N 3.46Å; L228-L269 HydrophobicContact CD1-CB 3.99Å; L228-L269 HydrophobicContact CD2-CB 4.03Å; L228-L269 HydrophobicContact CD2-CD1 4.41Å; L228-L269 HydrophobicContact CD2-CD2 4.23Å; L228-L269 HydrophobicContact CD2-CG 4.45Å; L228-L269 HydrophobicContact CG-CB 4Å; L228-N270 WeakPolarHBondContact CB-O 3.49Å; L228-N270 PolarHBondContact N-O 2.88Å; L228-K272 HydrophobicContact CD1-CB 4.19Å; L228-F275 HydrophobicContact CB-CB 3.66Å; L228-F275 HydrophobicContact CB-CD1 4.34Å; L228-F275 HydrophobicContact CB-CD2 4.02Å; L228-F275 HydrophobicContact CB-CG 3.75Å; L228-F275 HydrophobicContact CD1-CB 4.43Å; L228-F275 HydrophobicContact CD1-CD1 4.3Å; L228-F275 HydrophobicContact CD1-CG 4.46Å; L228-F275 WeakPolarHBondContact O-CD2 3.36Å; L228-I304 HydrophobicContact CD2-CB 4.3Å; L228-I304 HydrophobicContact CD2-CD1 3.89Å; L228-I304 HydrophobicContact CD2-CG2 3.78Å; L228-L323 HydrophobicContact CD1-CD2 3.83Å
229	S	96.9	Very high	94	Very high	1 Å²	1	25 Å²	25	1%	0.007	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-64.4	-8.9	179	63.2	0	0	0	0	115	A227 K271 K278	A227-S229 PolarHBondContact O-N 2.62Å; S229-K271 WeakPolarHBondContact OG-CD 3.4Å; S229-K278 PolarHBondContact O-NZ 3Å
230	G	96.6	Very high	94	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.01	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-84.3	-1.9	-178.5	0	0	0	0	0	115.4	A227 L228 D232 Q233	A227-G230 PolarHBondContact O-N 3.06Å; A227-G230 VanDerWaalsContact O-N 3.1Å; L228-G230 PolarHBondContact O-N 2.86Å; G230-D232 VanDerWaalsContact C-N 3.26Å; G230-D232 PolarHBondContact O-N 3.5Å; G230-Q233 PolarHBondContact O-N 3.27Å
231	Y	97.4	Very high	94.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.9	-175	76.7	-78.7	0	0	0	114.5	L228 N242 F275 K278 I279 S282 L284 C287	L228-Y231 WeakPolarHBondContact O-CD1 3.31Å; L228-Y231 PolarHBondContact O-N 3.46Å; Y231-N242 PolarHBondContact O-ND2 3.22Å; Y231-F275 AromaticContact CD1-CD2 3.78Å; Y231-F275 HydrophobicContact CD1-CD2 3.78Å; Y231-F275 AromaticContact CD1-CE2 3.64Å; Y231-F275 HydrophobicContact CD1-CE2 3.64Å; Y231-F275 AromaticContact CE1-CD2 3.73Å; Y231-F275 HydrophobicContact CE1-CD2 3.73Å; Y231-F275 AromaticContact CE1-CE2 3.68Å; Y231-F275 HydrophobicContact CE1-CE2 3.68Å; Y231-F275 HydrophobicContact CG-CE2 4.28Å; Y231-K278 HydrophobicContact CE1-CB 4.09Å; Y231-K278 VanDerWaalsContact OH-C 3.3Å; Y231-K278 PolarHBondContact OH-O 3.48Å; Y231-I279 HydrophobicContact CE2-CD1 4.38Å; Y231-I279 WeakPolarHBondContact OH-CA 3.33Å; Y231-I279 PolarHBondContact OH-N 3.36Å; Y231-S282 WeakPolarHBondContact CE2-O 3.48Å; Y231-S282 WeakPolarHBondContact OH-CB 3.46Å; Y231-S282 PolarHBondContact OH-O 3.11Å; Y231-L284 HydrophobicContact CD2-CD1 4.06Å; Y231-L284 HydrophobicContact CG-CD1 4.34Å; Y231-C287 HydrophobicContact CD2-CB 4.43Å; Y231-C287 VanDerWaalsContact O-CB 3.27Å; Y231-C287 WeakPolarHBondContact O-CB 3.44Å
232	D	96.2	Very high	94.4	Very high	14 Å²	14	30.9 Å²	30.9	8%	0.075	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	23.3	-179.5	67.9	-12.1	0	0	0	112.6	G230 K278 S282 I286	G230-D232 VanDerWaalsContact C-N 3.26Å; G230-D232 PolarHBondContact O-N 3.5Å; D232-K278 WeakPolarHBondContact OD1-CE 3.4Å; D232-K278 IonicContact OD1-NZ 3.49Å; D232-K278 PolarHBondContact OD1-NZ 3.35Å; D232-K278 VanDerWaalsContact OD2-CE 3.32Å; D232-K278 WeakPolarHBondContact OD2-CE 3.31Å; D232-K278 IonicContact OD2-NZ 3.54Å; D232-S282 WeakPolarHBondContact CB-OG 3.08Å; D232-S282 VanDerWaalsContact OD2-CB 3.31Å; D232-S282 WeakPolarHBondContact OD2-CB 3.41Å; D232-S282 PolarHBondContact OD2-OG 3.4Å; D232-I286 HydrophobicContact CB-CD1 4.47Å; D232-I286 HydrophobicContact CB-CG2 4.21Å
233	Q	95.4	Very high	94.5	Very high	13 Å²	13	32.1 Å²	32.1	6%	0.061	17%	0.169	C	C	.	.			trans	-126.2	153.7	-179.1	-73.7	179	-28.6	0	0	111.6	G230 N242 R243	G230-Q233 PolarHBondContact O-N 3.27Å; Q233-N242 CarbonylContact O-C 3.56Å; Q233-N242 WeakPolarHBondContact O-CA 3.38Å; Q233-R243 HydrophobicContact CB-CG 4.14Å; Q233-R243 WeakPolarHBondContact O-CG 3.37Å; Q233-R243 PolarHBondContact O-N 3.18Å
234	V	94.8	Very high	94.5	Very high	48 Å²	48	32.1 Å²	32.1	29%	0.291	17%	0.169	S	C	.	.	B	Isolated β-bridge	trans	-98.5	157.5	171.5	-63.4	0	0	0	0	111.7	Q148 T241 R243	Q148-V234 PolarHBondContact NE2-O 2.9Å; V234-T241 CarbonylContact C-O 3.56Å; V234-T241 VanDerWaalsContact CA-O 3.25Å; V234-T241 WeakPolarHBondContact CA-O 3.44Å; V234-R243 VanDerWaalsContact C-CG 3.49Å; V234-R243 WeakPolarHBondContact O-CG 3.37Å; V234-R243 PolarHBondContact O-NE 3.16Å
235	L	92.6	Very high	94.5	Very high	15 Å²	15	35.7 Å²	35.7	8%	0.079	19%	0.185	C	C	.	.			trans	-61.9	145	176.2	-66.6	173.1	0	0	0	111	R206 E237 E239 T241 R243 E246	R206-L235 VanDerWaalsContact NH2-CD1 3.3Å; L235-E237 PolarHBondContact O-N 2.98Å; L235-E239 WeakPolarHBondContact O-CA 3.09Å; L235-E239 PolarHBondContact O-N 3.43Å; L235-T241 HydrophobicContact CD1-CG2 3.95Å; L235-T241 PolarHBondContact N-O 3.12Å; L235-R243 HydrophobicContact CD2-CB 4.42Å; L235-R243 HydrophobicContact CD2-CG 4.09Å; L235-E246 HydrophobicContact CD1-CB 3.87Å; L235-E246 HydrophobicContact CD1-CG 3.76Å; L235-E246 HydrophobicContact CD2-CB 4.24Å; L235-E246 HydrophobicContact CD2-CG 3.75Å; L235-E246 HydrophobicContact CG-CB 4.34Å; L235-E246 HydrophobicContact CG-CG 4.26Å
236	H	87.9	Confident	94.5	Very high	105 Å²	105	36.1 Å²	36.1	49%	0.486	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.8	170.8	-176.4	72.7	0	0	0	112.6
237	E	87.3	Confident	94.4	Very high	74 Å²	74	36.5 Å²	36.5	35%	0.346	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-23	-173.3	-63.4	176.2	96.9	0	0	114.1	R206 L235	R206-E237 WeakPolarHBondContact CB-OE1 3.21Å; R206-E237 PolarHBondContact N-OE1 2.9Å; R206-E237 PolarHBondContact N-OE2 3.49Å; L235-E237 PolarHBondContact O-N 2.98Å
238	D	87.6	Confident	94.5	Very high	42 Å²	42	36.2 Å²	36.2	23%	0.225	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142	1.6	-175	71.3	16.3	0	0	0	116	R206 T240 T241	R206-D238 IonicContact CZ-OD2 2.71Å; R206-D238 VanDerWaalsContact CZ-OD2 3.32Å; R206-D238 IonicContact NH1-OD2 3.61Å; R206-D238 PolarHBondContact NH1-OD2 3.14Å; R206-D238 IonicContact NH2-OD2 2.86Å; R206-D238 PolarHBondContact NH2-OD2 3.38Å; D238-T240 WeakPolarHBondContact O-CB 3.31Å; D238-T240 WeakPolarHBondContact O-CG2 3.45Å; D238-T240 PolarHBondContact O-N 3.44Å; D238-T240 PolarHBondContact O-OG1 3.2Å; D238-T240 PolarHBondContact OD1-N 3.32Å; D238-T241 VanDerWaalsContact CG-OG1 3.29Å; D238-T241 VanDerWaalsContact OD1-CB 3.24Å; D238-T241 WeakPolarHBondContact OD1-CB 3.39Å; D238-T241 PolarHBondContact OD1-N 2.85Å; D238-T241 PolarHBondContact OD1-OG1 3.35Å; D238-T241 VanDerWaalsContact OD2-CB 3.3Å; D238-T241 WeakPolarHBondContact OD2-CB 3.46Å; D238-T241 PolarHBondContact OD2-OG1 2.71Å
239	E	86	Confident	94.4	Very high	143 Å²	143	42.3 Å²	42.3	67%	0.668	22%	0.216	S	C	*	.	S	Bend	trans	46.6	11.6	175.6	-62.6	-171.3	165.6	0	0	116.7	L235	L235-E239 WeakPolarHBondContact O-CA 3.09Å; L235-E239 PolarHBondContact O-N 3.43Å
240	T	91.1	Very high	94.4	Very high	114 Å²	114	42.8 Å²	42.8	70%	0.699	22%	0.218	S	C	*	.	S	Bend	trans	-133.1	-36.5	-170.5	50.6	0	0	0	0	111	D238	D238-T240 WeakPolarHBondContact O-CB 3.31Å; D238-T240 WeakPolarHBondContact O-CG2 3.45Å; D238-T240 PolarHBondContact O-N 3.44Å; D238-T240 PolarHBondContact O-OG1 3.2Å; D238-T240 PolarHBondContact OD1-N 3.32Å
241	T	94.1	Very high	94.5	Very high	37 Å²	37	42.8 Å²	42.8	23%	0.227	22%	0.218	C	C	.	.	S	Bend	trans	-80.2	125.3	177.5	-55.5	0	0	0	0	109.7	V234 L235 D238 E246	V234-T241 CarbonylContact C-O 3.56Å; V234-T241 VanDerWaalsContact CA-O 3.25Å; V234-T241 WeakPolarHBondContact CA-O 3.44Å; L235-T241 HydrophobicContact CD1-CG2 3.95Å; L235-T241 PolarHBondContact N-O 3.12Å; D238-T241 VanDerWaalsContact CG-OG1 3.29Å; D238-T241 VanDerWaalsContact OD1-CB 3.24Å; D238-T241 WeakPolarHBondContact OD1-CB 3.39Å; D238-T241 PolarHBondContact OD1-N 2.85Å; D238-T241 PolarHBondContact OD1-OG1 3.35Å; D238-T241 VanDerWaalsContact OD2-CB 3.3Å; D238-T241 WeakPolarHBondContact OD2-CB 3.46Å; D238-T241 PolarHBondContact OD2-OG1 2.71Å; T241-E246 HydrophobicContact CG2-CB 3.88Å
242	N	96.5	Very high	94.5	Very high	23 Å²	23	44.7 Å²	44.7	12%	0.123	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-61.9	135.6	171.8	-178.3	-76.1	0	0	0	111.3	Y231 Q233 M244 H245 E246	Y231-N242 PolarHBondContact O-ND2 3.22Å; Q233-N242 CarbonylContact O-C 3.56Å; Q233-N242 WeakPolarHBondContact O-CA 3.38Å; N242-M244 VanDerWaalsContact C-N 3.34Å; N242-M244 PolarHBondContact O-N 3.25Å; N242-M244 WeakPolarHBondContact OD1-CB 3.23Å; N242-M244 PolarHBondContact OD1-N 2.84Å; N242-H245 HydrophobicContact CB-CB 4.22Å; N242-H245 PolarHBondContact O-N 2.98Å; N242-H245 PolarHBondContact OD1-N 3.12Å; N242-E246 PolarHBondContact O-N 2.89Å
243	R	96.5	Very high	94.5	Very high	27 Å²	27	47.4 Å²	47.4	10%	0.102	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-38.1	-175.5	-62	-176.7	172.2	-153.8	-14.3	112.7	E43 Q233 V234 L235 S247	E43-R243 IonicContact OE1-NH2 3.4Å; E43-R243 IonicContact OE2-CZ 2.77Å; E43-R243 IonicContact OE2-NH1 2.68Å; E43-R243 PolarHBondContact OE2-NH1 3.43Å; E43-R243 IonicContact OE2-NH2 2.73Å; E43-R243 PolarHBondContact OE2-NH2 3.36Å; E43-R243 VanDerWaalsContact OE2-NH2 3.16Å; Q233-R243 HydrophobicContact CB-CG 4.14Å; Q233-R243 WeakPolarHBondContact O-CG 3.37Å; Q233-R243 PolarHBondContact O-N 3.18Å; V234-R243 VanDerWaalsContact C-CG 3.49Å; V234-R243 WeakPolarHBondContact O-CG 3.37Å; V234-R243 PolarHBondContact O-NE 3.16Å; L235-R243 HydrophobicContact CD2-CB 4.42Å; L235-R243 HydrophobicContact CD2-CG 4.09Å; R243-S247 WeakPolarHBondContact O-CB 3.32Å; R243-S247 PolarHBondContact O-N 3.02Å
244	M	97.7	Very high	94.5	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-70.7	-41.4	179.5	-177.3	63	71.8	0	0	111.6	V226 A227 N242 S247 L248 F288 I304 F308	V226-M244 HydrophobicContact CG1-CE 4.08Å; V226-M244 HydrophobicContact CG1-SD 3.94Å; A227-M244 WeakPolarHBondContact O-CE 3.24Å; N242-M244 VanDerWaalsContact C-N 3.34Å; N242-M244 PolarHBondContact O-N 3.25Å; N242-M244 WeakPolarHBondContact OD1-CB 3.23Å; N242-M244 PolarHBondContact OD1-N 2.84Å; M244-S247 WeakPolarHBondContact O-CB 3.46Å; M244-S247 PolarHBondContact O-N 3.29Å; M244-L248 PolarHBondContact O-N 2.92Å; M244-F288 HydrophobicContact CG-CE2 4.07Å; M244-F288 HydrophobicContact CG-CZ 3.77Å; M244-I304 HydrophobicContact CE-CD1 4.29Å; M244-I304 HydrophobicContact CE-CG2 4.2Å; M244-I304 HydrophobicContact SD-CG2 4.23Å; M244-F308 HydrophobicContact SD-CE2 3.63Å; M244-F308 HydrophobicContact SD-CZ 3.9Å
245	H	97.6	Very high	94.6	Very high	75 Å²	75	45 Å²	45	35%	0.347	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-44.1	174.1	-73.5	140.9	0	0	0	112.7	N242 S247 L248 M249 C287	N242-H245 HydrophobicContact CB-CB 4.22Å; N242-H245 PolarHBondContact O-N 2.98Å; N242-H245 PolarHBondContact OD1-N 3.12Å; H245-S247 VanDerWaalsContact C-N 3.34Å; H245-S247 PolarHBondContact O-N 3.15Å; H245-L248 PolarHBondContact O-N 3.02Å; H245-M249 WeakPolarHBondContact O-CG 3.21Å; H245-M249 PolarHBondContact O-N 3.05Å; H245-C287 PolarHBondContact CE1-O 3.48Å; H245-C287 PolarHBondContact NE2-O 3.02Å; H245-C287 VanDerWaalsContact NE2-O 3.14Å
246	E	96.8	Very high	94.7	Very high	9 Å²	9	46.6 Å²	46.6	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-46.5	173.3	144.4	49.4	80	0	0	110.3	R206 R209 L235 T241 N242 L248 M249 L250	R206-E246 IonicContact NE-OE1 3.57Å; R209-E246 IonicContact CZ-OE1 3.19Å; R209-E246 IonicContact CZ-OE2 2.74Å; R209-E246 IonicContact NH1-OE1 3.61Å; R209-E246 PolarHBondContact NH1-OE1 3.01Å; R209-E246 IonicContact NH1-OE2 3.32Å; R209-E246 PolarHBondContact NH1-OE2 2.91Å; R209-E246 IonicContact NH2-OE1 2.71Å; R209-E246 PolarHBondContact NH2-OE1 2.77Å; R209-E246 IonicContact NH2-OE2 2.72Å; R209-E246 PolarHBondContact NH2-OE2 3.25Å; L235-E246 HydrophobicContact CD1-CB 3.87Å; L235-E246 HydrophobicContact CD1-CG 3.76Å; L235-E246 HydrophobicContact CD2-CB 4.24Å; L235-E246 HydrophobicContact CD2-CG 3.75Å; L235-E246 HydrophobicContact CG-CB 4.34Å; L235-E246 HydrophobicContact CG-CG 4.26Å; T241-E246 HydrophobicContact CG2-CB 3.88Å; N242-E246 PolarHBondContact O-N 2.89Å; E246-L248 VanDerWaalsContact C-N 3.27Å; E246-L248 PolarHBondContact O-N 2.93Å; E246-M249 WeakPolarHBondContact O-CB 3.11Å; E246-M249 PolarHBondContact O-N 3.08Å; E246-M249 VanDerWaalsContact O-N 3.08Å; E246-L250 WeakPolarHBondContact O-CB 3.46Å; E246-L250 PolarHBondContact O-N 3.48Å; E246-L250 VanDerWaalsContact OE2-CB 3.24Å; E246-L250 WeakPolarHBondContact OE2-CB 3.39Å
247	S	98.1	Very high	94.9	Very high	8 Å²	8	43.7 Å²	43.7	6%	0.056	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-38.5	177.4	-167.9	0	0	0	0	112.9	R243 M244 H245 F251	R243-S247 WeakPolarHBondContact O-CB 3.32Å; R243-S247 PolarHBondContact O-N 3.02Å; M244-S247 WeakPolarHBondContact O-CB 3.46Å; M244-S247 PolarHBondContact O-N 3.29Å; H245-S247 VanDerWaalsContact C-N 3.34Å; H245-S247 PolarHBondContact O-N 3.15Å; S247-F251 VanDerWaalsContact O-CB 3.31Å; S247-F251 WeakPolarHBondContact O-CB 3.24Å; S247-F251 PolarHBondContact O-N 2.57Å
248	L	98.4	Very high	95.2	Very high	11 Å²	11	48.9 Å²	48.9	6%	0.058	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-43.6	174.5	-78.4	166.1	0	0	0	112.2	M244 H245 E246 L250 F251 D252 F288 Q307 F308	M244-L248 PolarHBondContact O-N 2.92Å; H245-L248 PolarHBondContact O-N 3.02Å; E246-L248 VanDerWaalsContact C-N 3.27Å; E246-L248 PolarHBondContact O-N 2.93Å; L248-L250 VanDerWaalsContact C-N 3.35Å; L248-F251 PolarHBondContact O-N 2.83Å; L248-D252 WeakPolarHBondContact O-CB 3.33Å; L248-D252 PolarHBondContact O-N 3.33Å; L248-F288 HydrophobicContact CD1-CE1 3.73Å; L248-F288 HydrophobicContact CD1-CZ 3.82Å; L248-Q307 HydrophobicContact CD1-CB 4.49Å; L248-Q307 HydrophobicContact CD2-CB 4.01Å; L248-F308 HydrophobicContact CD2-CD1 3.86Å; L248-F308 HydrophobicContact CD2-CD2 3.75Å; L248-F308 HydrophobicContact CD2-CE1 3.84Å; L248-F308 HydrophobicContact CD2-CE2 3.73Å; L248-F308 HydrophobicContact CD2-CG 3.8Å; L248-F308 HydrophobicContact CD2-CZ 3.77Å; L248-F308 HydrophobicContact CG-CE1 4.21Å; L248-F308 HydrophobicContact CG-CE2 4.08Å; L248-F308 HydrophobicContact CG-CZ 3.86Å
249	M	97.3	Very high	95.3	Very high	127 Å²	127	52.7 Å²	52.7	63%	0.626	27%	0.267	S	S	*	.	H	α-helix	trans	-63.2	-42.1	176.5	-70.7	178.1	66.2	0	0	111.9	H245 E246 D252 S253	H245-M249 WeakPolarHBondContact O-CG 3.21Å; H245-M249 PolarHBondContact O-N 3.05Å; E246-M249 WeakPolarHBondContact O-CB 3.11Å; E246-M249 PolarHBondContact O-N 3.08Å; E246-M249 VanDerWaalsContact O-N 3.08Å; M249-D252 PolarHBondContact O-N 2.76Å; M249-S253 PolarHBondContact O-N 3.2Å; M249-S253 PolarHBondContact O-OG 3.08Å
250	L	97.1	Very high	95.6	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.063	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-44.6	176.1	177.5	64.9	0	0	0	111.1	W212 F224 E246 L248 S253 I254	W212-L250 HydrophobicContact CH2-CD1 3.93Å; W212-L250 HydrophobicContact CH2-CD2 3.9Å; W212-L250 HydrophobicContact CH2-CG 4.39Å; W212-L250 HydrophobicContact CZ3-CD1 3.74Å; W212-L250 HydrophobicContact CZ3-CD2 4.44Å; W212-L250 HydrophobicContact CZ3-CG 4.46Å; F224-L250 HydrophobicContact CE2-CD2 4.19Å; F224-L250 HydrophobicContact CE2-CG 3.99Å; F224-L250 HydrophobicContact CZ-CB 4.29Å; F224-L250 HydrophobicContact CZ-CD2 3.93Å; F224-L250 HydrophobicContact CZ-CG 3.9Å; E246-L250 WeakPolarHBondContact O-CB 3.46Å; E246-L250 PolarHBondContact O-N 3.48Å; E246-L250 VanDerWaalsContact OE2-CB 3.24Å; E246-L250 WeakPolarHBondContact OE2-CB 3.39Å; L248-L250 VanDerWaalsContact C-N 3.35Å; L250-S253 WeakPolarHBondContact O-CB 3.17Å; L250-S253 PolarHBondContact O-N 2.83Å; L250-I254 HydrophobicContact CD1-CG1 4.4Å; L250-I254 WeakPolarHBondContact O-CG1 3.47Å; L250-I254 PolarHBondContact O-N 2.59Å
251	F	98.1	Very high	95.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.2	-46.1	176.5	-175.9	-100.3	0	0	0	111.8	F224 S247 L248 S253 I254 C255 I265 L267 F308 K311 I319	F224-F251 HydrophobicContact CB-CD2 4.16Å; F224-F251 HydrophobicContact CB-CE2 4.19Å; F224-F251 HydrophobicContact CD1-CB 4.48Å; F224-F251 AromaticContact CD1-CD2 3.57Å; F224-F251 HydrophobicContact CD1-CD2 3.57Å; F224-F251 HydrophobicContact CD1-CE2 4.3Å; F224-F251 HydrophobicContact CD1-CG 4.47Å; F224-F251 AromaticContact CD2-CD2 3.88Å; F224-F251 HydrophobicContact CD2-CD2 3.88Å; F224-F251 HydrophobicContact CE1-CB 3.86Å; F224-F251 AromaticContact CE1-CD2 3.83Å; F224-F251 HydrophobicContact CE1-CD2 3.83Å; F224-F251 HydrophobicContact CE1-CG 4.32Å; F224-F251 HydrophobicContact CE2-CB 4.23Å; F224-F251 HydrophobicContact CE2-CD2 4.11Å; F224-F251 AromaticContact CG-CD2 3.59Å; F224-F251 HydrophobicContact CG-CD2 3.59Å; F224-F251 HydrophobicContact CG-CE2 4.12Å; F224-F251 HydrophobicContact CZ-CB 3.71Å; F224-F251 HydrophobicContact CZ-CD2 4.09Å; F224-F251 HydrophobicContact CZ-CG 4.43Å; S247-F251 VanDerWaalsContact O-CB 3.31Å; S247-F251 WeakPolarHBondContact O-CB 3.24Å; S247-F251 PolarHBondContact O-N 2.57Å; L248-F251 PolarHBondContact O-N 2.83Å; F251-S253 PolarHBondContact O-N 3.24Å; F251-I254 PolarHBondContact O-N 2.88Å; F251-I254 VanDerWaalsContact O-N 3.15Å; F251-C255 HydrophobicContact CD1-CB 4.27Å; F251-C255 HydrophobicContact CE1-CB 3.97Å; F251-C255 HydrophobicContact CZ-CB 4.23Å; F251-C255 WeakPolarHBondContact O-CB 3.24Å; F251-C255 PolarHBondContact O-N 2.86Å; F251-I265 HydrophobicContact CE2-CG2 3.83Å; F251-I265 HydrophobicContact CZ-CG2 4.28Å; F251-L267 HydrophobicContact CD2-CD1 4.26Å; F251-L267 HydrophobicContact CE2-CD1 3.96Å; F251-F308 HydrophobicContact CB-CD1 3.71Å; F251-F308 HydrophobicContact CB-CE1 3.73Å; F251-F308 HydrophobicContact CD1-CB 4.44Å; F251-F308 AromaticContact CD1-CD1 3.76Å; F251-F308 HydrophobicContact CD1-CD1 3.76Å; F251-F308 HydrophobicContact CD2-CD1 4.08Å; F251-F308 HydrophobicContact CE1-CB 4.4Å; F251-F308 HydrophobicContact CE1-CD1 4.41Å; F251-F308 WeakPolarHBondContact CE1-O 3.41Å; F251-F308 AromaticContact CG-CD1 3.57Å; F251-F308 HydrophobicContact CG-CD1 3.57Å; F251-F308 HydrophobicContact CG-CE1 4.09Å; F251-K311 HydrophobicContact CD1-CB 3.82Å; F251-K311 HydrophobicContact CD1-CG 4.16Å; F251-K311 HydrophobicContact CE1-CB 4.12Å; F251-I319 HydrophobicContact CE1-CD1 3.97Å; F251-I319 HydrophobicContact CZ-CD1 3.67Å; F251-I319 HydrophobicContact CZ-CG1 4.36Å
252	D	97.7	Very high	95	Very high	40 Å²	40	50 Å²	50	21%	0.214	25%	0.251	C	S	.	.	H	α-helix	trans	-56.1	-40.8	175.3	-177.9	60.5	0	0	0	111.8	L248 M249 N256 K311 R313	L248-D252 WeakPolarHBondContact O-CB 3.33Å; L248-D252 PolarHBondContact O-N 3.33Å; M249-D252 PolarHBondContact O-N 2.76Å; D252-N256 WeakPolarHBondContact O-CB 3.24Å; D252-N256 PolarHBondContact O-N 3.03Å; D252-N256 PolarHBondContact O-ND2 2.76Å; D252-N256 PolarHBondContact OD1-ND2 3.23Å; D252-K311 HydrophobicContact CB-CB 4.13Å; D252-K311 HydrophobicContact CB-CD 4.28Å; D252-K311 HydrophobicContact CB-CG 4.21Å; D252-R313 IonicContact OD1-CZ 3.22Å; D252-R313 IonicContact OD1-NE 2.75Å; D252-R313 IonicContact OD1-NH2 3.44Å; D252-R313 PolarHBondContact OD1-NH2 3.33Å; D252-R313 IonicContact OD2-NH2 3.56Å; D252-R313 PolarHBondContact OD2-NH2 2.74Å
253	S	96.3	Very high	94.7	Very high	71 Å²	71	49.8 Å²	49.8	50%	0.497	25%	0.25	S	S	.	.	H	α-helix	trans	-67.9	-37.2	178.2	-59.4	0	0	0	0	113.2	M249 L250 F251 N257	M249-S253 PolarHBondContact O-N 3.2Å; M249-S253 PolarHBondContact O-OG 3.08Å; L250-S253 WeakPolarHBondContact O-CB 3.17Å; L250-S253 PolarHBondContact O-N 2.83Å; F251-S253 PolarHBondContact O-N 3.24Å; S253-N257 WeakPolarHBondContact O-CB 3.4Å; S253-N257 PolarHBondContact O-N 3.43Å
254	I	95.6	Very high	94.3	Very high	9 Å²	9	49.6 Å²	49.6	5%	0.046	25%	0.253	C	S	.	.	H	α-helix	trans	-78.2	-48.1	178.6	-66.6	-58	0	0	0	110.9	L39 W212 F216 I222 F224 L250 F251 N256 N257 F260	L39-I254 HydrophobicContact CD1-CD1 3.83Å; L39-I254 HydrophobicContact CD1-CG1 4.04Å; L39-I254 HydrophobicContact CD1-CG2 3.72Å; W212-I254 HydrophobicContact CE3-CD1 4.14Å; W212-I254 HydrophobicContact CZ3-CD1 4.03Å; W212-I254 HydrophobicContact CZ3-CG1 4.37Å; F216-I254 HydrophobicContact CZ-CD1 4.29Å; I222-I254 HydrophobicContact CD1-CG2 3.99Å; F224-I254 HydrophobicContact CE2-CB 4.47Å; F224-I254 HydrophobicContact CE2-CG1 4.23Å; L250-I254 HydrophobicContact CD1-CG1 4.4Å; L250-I254 WeakPolarHBondContact O-CG1 3.47Å; L250-I254 PolarHBondContact O-N 2.59Å; F251-I254 PolarHBondContact O-N 2.88Å; F251-I254 VanDerWaalsContact O-N 3.15Å; I254-N256 PolarHBondContact O-N 3.31Å; I254-N257 VanDerWaalsContact O-CB 3.31Å; I254-N257 WeakPolarHBondContact O-CB 3.32Å; I254-N257 PolarHBondContact O-N 2.9Å; I254-N257 VanDerWaalsContact O-N 3.09Å; I254-F260 HydrophobicContact CD1-CE2 4.32Å; I254-F260 HydrophobicContact CG2-CD2 4.06Å; I254-F260 HydrophobicContact CG2-CE2 4.19Å
255	C	95.6	Very high	94.2	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-33.2	-177.8	-170.7	0	0	0	0	112	F251 I265 K317	F251-C255 HydrophobicContact CD1-CB 4.27Å; F251-C255 HydrophobicContact CE1-CB 3.97Å; F251-C255 HydrophobicContact CZ-CB 4.23Å; F251-C255 WeakPolarHBondContact O-CB 3.24Å; F251-C255 PolarHBondContact O-N 2.86Å; C255-I265 HydrophobicContact CB-CD1 4Å; C255-K317 PolarHBondContact O-NZ 2.95Å
256	N	95.1	Very high	94.1	Very high	50 Å²	50	46.1 Å²	46.1	27%	0.267	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	14.8	-179.1	-57	-60.1	0	0	0	113.1	D252 I254 K311 R313	D252-N256 WeakPolarHBondContact O-CB 3.24Å; D252-N256 PolarHBondContact O-N 3.03Å; D252-N256 PolarHBondContact O-ND2 2.76Å; D252-N256 PolarHBondContact OD1-ND2 3.23Å; I254-N256 PolarHBondContact O-N 3.31Å; N256-K311 PolarHBondContact ND2-O 3.44Å; N256-R313 PolarHBondContact ND2-NE 3.34Å; N256-R313 WeakPolarHBondContact OD1-CB 3.24Å; N256-R313 WeakPolarHBondContact OD1-CG 3.45Å; N256-R313 PolarHBondContact OD1-N 2.66Å
257	N	93.4	Very high	94.1	Very high	44 Å²	44	45.7 Å²	45.7	24%	0.235	24%	0.235	C	C	.	.			trans	-72.7	139.4	177.7	-161.8	-56.6	0	0	0	111.5	S253 I254 F259 F260 I261	S253-N257 WeakPolarHBondContact O-CB 3.4Å; S253-N257 PolarHBondContact O-N 3.43Å; I254-N257 VanDerWaalsContact O-CB 3.31Å; I254-N257 WeakPolarHBondContact O-CB 3.32Å; I254-N257 PolarHBondContact O-N 2.9Å; I254-N257 VanDerWaalsContact O-N 3.09Å; N257-F259 PolarHBondContact O-N 2.99Å; N257-F259 WeakPolarHBondContact OD1-CD2 3.48Å; N257-F259 PolarHBondContact OD1-N 2.93Å; N257-F260 HydrophobicContact CB-CD2 3.81Å; N257-F260 PolarHBondContact O-N 3.37Å; N257-I261 PolarHBondContact O-N 2.86Å
258	K	92	Very high	94.1	Very high	182 Å²	182	45.4 Å²	45.4	79%	0.791	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-59.7	-31.2	177.4	-65.9	-175.2	179.3	-177.8	0	113.8	F260 I261	K258-F260 PolarHBondContact O-N 2.98Å; K258-I261 HydrophobicContact CB-CD1 4.46Å
259	F	91.4	Very high	94.1	Very high	123 Å²	123	44.9 Å²	44.9	54%	0.539	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-69.2	-17.3	176.6	-68.9	-73.9	0	0	0	113.1	I213 F216 N257	I213-F259 HydrophobicContact CD1-CD2 3.79Å; I213-F259 HydrophobicContact CD1-CE1 4.38Å; I213-F259 HydrophobicContact CD1-CE2 3.41Å; I213-F259 VanDerWaalsContact CD1-CE2 3.41Å; I213-F259 HydrophobicContact CD1-CG 4.46Å; I213-F259 HydrophobicContact CD1-CZ 3.74Å; F216-F259 HydrophobicContact CB-CB 4.34Å; F216-F259 HydrophobicContact CB-CG 4.46Å; F216-F259 HydrophobicContact CD2-CB 4.03Å; F216-F259 AromaticContact CD2-CD2 3.99Å; F216-F259 HydrophobicContact CD2-CD2 3.99Å; F216-F259 HydrophobicContact CD2-CG 4.12Å; N257-F259 PolarHBondContact O-N 2.99Å; N257-F259 WeakPolarHBondContact OD1-CD2 3.48Å; N257-F259 PolarHBondContact OD1-N 2.93Å
260	F	91.8	Very high	94.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-122.6	17.6	-170.7	-57.6	-45.1	0	0	0	113.5	L37 L39 F216 V219 I222 I254 N257 K258 D262 T263 K317	L37-F260 HydrophobicContact CD2-CZ 3.97Å; L39-F260 HydrophobicContact CD1-CE2 4.47Å; F216-F260 HydrophobicContact CB-CE1 4.08Å; F216-F260 HydrophobicContact CB-CZ 4.01Å; F216-F260 HydrophobicContact CD1-CE1 4.2Å; F216-F260 HydrophobicContact CD1-CE2 4.21Å; F216-F260 AromaticContact CD1-CZ 3.39Å; F216-F260 HydrophobicContact CD1-CZ 3.39Å; F216-F260 HydrophobicContact CD2-CE1 4.24Å; F216-F260 AromaticContact CD2-CE2 3.79Å; F216-F260 HydrophobicContact CD2-CE2 3.79Å; F216-F260 AromaticContact CD2-CZ 3.49Å; F216-F260 HydrophobicContact CD2-CZ 3.49Å; F216-F260 VanDerWaalsContact CD2-CZ 3.49Å; F216-F260 AromaticContact CE1-CE2 3.96Å; F216-F260 HydrophobicContact CE1-CE2 3.96Å; F216-F260 AromaticContact CE1-CZ 3.53Å; F216-F260 HydrophobicContact CE1-CZ 3.53Å; F216-F260 AromaticContact CE2-CE2 3.55Å; F216-F260 HydrophobicContact CE2-CE2 3.55Å; F216-F260 AromaticContact CE2-CZ 3.66Å; F216-F260 HydrophobicContact CE2-CZ 3.66Å; F216-F260 AromaticContact CG-CE1 3.94Å; F216-F260 HydrophobicContact CG-CE1 3.94Å; F216-F260 HydrophobicContact CG-CE2 4.13Å; F216-F260 AromaticContact CG-CZ 3.35Å; F216-F260 HydrophobicContact CG-CZ 3.35Å; F216-F260 AromaticContact CZ-CE2 3.63Å; F216-F260 HydrophobicContact CZ-CE2 3.63Å; F216-F260 AromaticContact CZ-CZ 3.68Å; F216-F260 HydrophobicContact CZ-CZ 3.68Å; V219-F260 HydrophobicContact CB-CE1 4.46Å; V219-F260 HydrophobicContact CG2-CE1 4.35Å; I222-F260 HydrophobicContact CD1-CB 4.06Å; I222-F260 HydrophobicContact CD1-CD1 3.66Å; I222-F260 HydrophobicContact CD1-CD2 3.57Å; I222-F260 HydrophobicContact CD1-CE1 3.85Å; I222-F260 HydrophobicContact CD1-CE2 3.77Å; I222-F260 HydrophobicContact CD1-CG 3.5Å; I222-F260 HydrophobicContact CD1-CZ 3.87Å; I222-F260 HydrophobicContact CG1-CE1 4.47Å; I254-F260 HydrophobicContact CD1-CE2 4.32Å; I254-F260 HydrophobicContact CG2-CD2 4.06Å; I254-F260 HydrophobicContact CG2-CE2 4.19Å; N257-F260 HydrophobicContact CB-CD2 3.81Å; N257-F260 PolarHBondContact O-N 3.37Å; K258-F260 PolarHBondContact O-N 2.98Å; F260-D262 VanDerWaalsContact C-N 3.25Å; F260-D262 PolarHBondContact O-N 3.5Å; F260-T263 WeakPolarHBondContact CA-OG1 3.39Å; F260-T263 HydrophobicContact CD1-CG2 4.46Å; F260-T263 PolarHBondContact O-N 2.86Å; F260-T263 VanDerWaalsContact O-N 3.09Å; F260-K317 VanDerWaalsContact O-CE 3.22Å; F260-K317 WeakPolarHBondContact O-CE 3.39Å; F260-K317 PolarHBondContact O-NZ 3.08Å
261	I	87.8	Confident	94.2	Very high	89 Å²	89	39.4 Å²	39.4	46%	0.456	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-46.2	-172.8	-68.2	169.3	0	0	0	111.5	N257 K258 K317	N257-I261 PolarHBondContact O-N 2.86Å; K258-I261 HydrophobicContact CB-CD1 4.46Å; I261-K317 WeakPolarHBondContact O-CE 3.46Å
262	D	84.3	Confident	94.2	Very high	148 Å²	148	42 Å²	42	79%	0.791	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	4	-178.4	-55.4	-49.8	0	0	0	113.1	F260	F260-D262 VanDerWaalsContact C-N 3.25Å; F260-D262 PolarHBondContact O-N 3.5Å
263	T	89.4	Confident	94.1	Very high	18 Å²	18	42.8 Å²	42.8	11%	0.11	22%	0.218	C	C	.	.			trans	-81.2	125.4	178.9	-51	0	0	0	0	110.1	V219 I222 F260 K317	V219-T263 HydrophobicContact CG1-CG2 4.08Å; I222-T263 HydrophobicContact CD1-CG2 4.15Å; I222-T263 HydrophobicContact CG1-CG2 3.98Å; F260-T263 WeakPolarHBondContact CA-OG1 3.39Å; F260-T263 HydrophobicContact CD1-CG2 4.46Å; F260-T263 PolarHBondContact O-N 2.86Å; F260-T263 VanDerWaalsContact O-N 3.09Å; T263-K317 WeakPolarHBondContact O-CE 3.48Å
264	S	89	Confident	94.1	Very high	24 Å²	24	41.8 Å²	41.8	17%	0.168	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	143.8	174.6	-65.2	0	0	0	0	111.2	I222 N346	I222-S264 PolarHBondContact N-O 3.08Å; S264-N346 PolarHBondContact OG-ND2 3.06Å
265	I	94.7	Very high	94.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.7	178.9	-59.1	-179	0	0	0	109.8	I222 F224 F251 C255 K317 E318 I319 Y320	I222-I265 HydrophobicContact CB-CG1 4.37Å; F224-I265 HydrophobicContact CB-CG2 4.3Å; F251-I265 HydrophobicContact CE2-CG2 3.83Å; F251-I265 HydrophobicContact CZ-CG2 4.28Å; C255-I265 HydrophobicContact CB-CD1 4Å; I265-K317 HydrophobicContact CD1-CD 3.97Å; I265-K317 HydrophobicContact CG1-CD 4.27Å; I265-E318 PolarHBondContact N-O 3.01Å; I265-I319 HydrophobicContact CB-CG1 4.44Å; I265-I319 CarbonylContact O-C 3.48Å; I265-I319 WeakPolarHBondContact O-CA 3.4Å; I265-Y320 PolarHBondContact O-N 3.47Å
266	I	96	Very high	94.4	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.5	169.9	-62.1	139.2	0	0	0	106.8	A221 I222 I223 F224 F268 Y320 V339 I343	A221-I266 HydrophobicContact CB-CD1 4Å; I222-I266 PolarHBondContact O-N 3.06Å; I223-I266 CarbonylContact C-O 3.59Å; I223-I266 WeakPolarHBondContact CA-O 3.5Å; I223-I266 HydrophobicContact CG1-CB 4.25Å; I223-I266 HydrophobicContact CG1-CD1 4.03Å; F224-I266 PolarHBondContact N-O 2.99Å; I266-F268 HydrophobicContact CG2-CD1 3.71Å; I266-F268 HydrophobicContact CG2-CE1 3.32Å; I266-F268 HydrophobicContact CG2-CZ 4.15Å; I266-Y320 CarbonylContact C-O 3.44Å; I266-Y320 WeakPolarHBondContact CA-O 3.48Å; I266-Y320 HydrophobicContact CG1-CD2 4.4Å; I266-V339 HydrophobicContact CB-CG2 4.48Å; I266-V339 HydrophobicContact CD1-CB 4.39Å; I266-V339 HydrophobicContact CD1-CG1 3.44Å; I266-V339 VanDerWaalsContact CD1-CG1 3.44Å; I266-V339 HydrophobicContact CD1-CG2 4.23Å; I266-V339 HydrophobicContact CG1-CG1 4.26Å; I266-V339 HydrophobicContact CG1-CG2 4.18Å; I266-V339 HydrophobicContact CG2-CG2 3.54Å; I266-I343 HydrophobicContact CD1-CD1 4.36Å
267	L	97.6	Very high	94.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	111.2	-178.9	179.6	66.4	0	0	0	109.9	F224 V226 F251 L269 F308 I319 Y320 C321 H322	F224-L267 HydrophobicContact CB-CD1 4.39Å; F224-L267 HydrophobicContact CD1-CD1 3.98Å; V226-L267 HydrophobicContact CG2-CD1 3.65Å; F251-L267 HydrophobicContact CD2-CD1 4.26Å; F251-L267 HydrophobicContact CE2-CD1 3.96Å; L267-L269 HydrophobicContact CD1-CD2 4.48Å; L267-L269 HydrophobicContact CD2-CD2 4.14Å; L267-L269 HydrophobicContact CG-CD2 4.13Å; L267-L269 HydrophobicContact CG-CG 4.45Å; L267-F308 HydrophobicContact CD1-CD1 4.15Å; L267-F308 HydrophobicContact CD1-CG 4.37Å; L267-F308 HydrophobicContact CD2-CB 3.51Å; L267-F308 HydrophobicContact CD2-CG 4.04Å; L267-I319 HydrophobicContact CB-CG2 3.77Å; L267-I319 HydrophobicContact CD2-CG2 4.31Å; L267-Y320 PolarHBondContact N-O 3.06Å; L267-C321 HydrophobicContact CB-CB 4.49Å; L267-C321 HydrophobicContact CD2-CB 4.49Å; L267-C321 CarbonylContact O-C 3.58Å; L267-C321 WeakPolarHBondContact O-CA 3.45Å; L267-H322 PolarHBondContact O-N 2.71Å
268	F	98.3	Very high	94.5	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.009	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	108.6	172.9	-76.2	0.9	0	0	0	110.4	I49 I223 F224 V226 I266 N270 H322 T324 V335 V339	I49-F268 HydrophobicContact CD1-CD2 3.64Å; I49-F268 HydrophobicContact CD1-CE2 4.05Å; I223-F268 HydrophobicContact CG2-CD1 4.38Å; I223-F268 HydrophobicContact CG2-CD2 3.53Å; I223-F268 HydrophobicContact CG2-CE1 4.41Å; I223-F268 HydrophobicContact CG2-CE2 3.57Å; I223-F268 HydrophobicContact CG2-CG 3.96Å; I223-F268 HydrophobicContact CG2-CZ 4.02Å; F224-F268 PolarHBondContact O-N 2.9Å; V226-F268 PolarHBondContact N-O 3.2Å; I266-F268 HydrophobicContact CG2-CD1 3.71Å; I266-F268 HydrophobicContact CG2-CE1 3.32Å; I266-F268 HydrophobicContact CG2-CZ 4.15Å; F268-N270 PolarHBondContact O-N 3.42Å; F268-H322 WeakPolarHBondContact CA-O 3.41Å; F268-H322 HydrophobicContact CD1-CB 4.05Å; F268-H322 HydrophobicContact CE1-CB 4.19Å; F268-T324 HydrophobicContact CB-CG2 4.25Å; F268-T324 HydrophobicContact CD1-CG2 3.98Å; F268-T324 HydrophobicContact CD2-CG2 4.14Å; F268-T324 HydrophobicContact CE1-CG2 4.35Å; F268-T324 HydrophobicContact CG-CG2 3.87Å; F268-V335 HydrophobicContact CD1-CG1 4.21Å; F268-V335 HydrophobicContact CE1-CG1 3.33Å; F268-V335 HydrophobicContact CE2-CG1 4.47Å; F268-V335 HydrophobicContact CZ-CG1 3.51Å; F268-V339 HydrophobicContact CE1-CG2 4.04Å; F268-V339 HydrophobicContact CZ-CG2 4.25Å
269	L	98.4	Very high	94.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	84.9	167.4	-63.1	-174.1	0	0	0	108.3	V226 L228 L267 I304 Q305 F308 C321 H322 L323 T324	V226-L269 HydrophobicContact CB-CD2 3.93Å; V226-L269 HydrophobicContact CG1-CD2 4.17Å; V226-L269 HydrophobicContact CG2-CD2 4.15Å; L228-L269 HydrophobicContact CD1-CB 3.99Å; L228-L269 HydrophobicContact CD2-CB 4.03Å; L228-L269 HydrophobicContact CD2-CD1 4.41Å; L228-L269 HydrophobicContact CD2-CD2 4.23Å; L228-L269 HydrophobicContact CD2-CG 4.45Å; L228-L269 HydrophobicContact CG-CB 4Å; L267-L269 HydrophobicContact CD1-CD2 4.48Å; L267-L269 HydrophobicContact CD2-CD2 4.14Å; L267-L269 HydrophobicContact CG-CD2 4.13Å; L267-L269 HydrophobicContact CG-CG 4.45Å; L269-I304 HydrophobicContact CD2-CG2 4.4Å; L269-Q305 HydrophobicContact CD1-CB 3.84Å; L269-Q305 HydrophobicContact CD1-CG 4.43Å; L269-F308 HydrophobicContact CD2-CD2 4.33Å; L269-C321 WeakPolarHBondContact CD1-SG 3.46Å; L269-H322 PolarHBondContact N-O 2.71Å; L269-L323 HydrophobicContact CB-CD2 3.67Å; L269-L323 HydrophobicContact CD1-CD2 4.1Å; L269-T324 PolarHBondContact O-N 2.86Å
270	N	98.4	Very high	95	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	166.9	-170.9	-168.3	26.3	0	0	0	112.6	S44 V226 L228 F268 K272 T324 A326	S44-N270 PolarHBondContact O-ND2 3.46Å; V226-N270 WeakPolarHBondContact O-CA 3.48Å; V226-N270 VanDerWaalsContact O-CB 3.3Å; V226-N270 WeakPolarHBondContact O-CB 3.31Å; V226-N270 PolarHBondContact O-N 3.05Å; L228-N270 WeakPolarHBondContact CB-O 3.49Å; L228-N270 PolarHBondContact N-O 2.88Å; F268-N270 PolarHBondContact O-N 3.42Å; N270-K272 VanDerWaalsContact C-N 3.29Å; N270-T324 CarbonylContact C-O 3.6Å; N270-T324 VanDerWaalsContact CA-O 3.31Å; N270-T324 WeakPolarHBondContact CA-O 3.47Å; N270-T324 WeakPolarHBondContact CA-OG1 3.32Å; N270-T324 VanDerWaalsContact CB-OG1 3.31Å; N270-T324 WeakPolarHBondContact CB-OG1 3.33Å; N270-T324 PolarHBondContact OD1-O 3.43Å; N270-T324 PolarHBondContact OD1-OG1 3.19Å; N270-A326 WeakPolarHBondContact OD1-CB 3.07Å; N270-A326 PolarHBondContact OD1-N 3.49Å
271	K	97.7	Very high	95	Very high	22 Å²	22	45.1 Å²	45.1	10%	0.096	22%	0.222	C	C	.	.			trans	62	37.1	-178	-52.7	-179.6	179.3	-179.2	0	112.2	E43 D151 A227 S229 D273 L274 F275 T324	E43-K271 WeakPolarHBondContact O-CE 3.17Å; E43-K271 PolarHBondContact O-NZ 3.37Å; D151-K271 VanDerWaalsContact OD2-CD 3.31Å; D151-K271 WeakPolarHBondContact OD2-CD 3.45Å; D151-K271 VanDerWaalsContact OD2-CE 3.22Å; D151-K271 WeakPolarHBondContact OD2-CE 3.46Å; D151-K271 IonicContact OD2-NZ 3.67Å; D151-K271 PolarHBondContact OD2-NZ 3.2Å; A227-K271 HydrophobicContact CB-CD 3.88Å; S229-K271 WeakPolarHBondContact OG-CD 3.4Å; K271-D273 VanDerWaalsContact C-OD1 3.24Å; K271-D273 WeakPolarHBondContact CA-OD1 3.28Å; K271-D273 PolarHBondContact O-N 3.16Å; K271-L274 HydrophobicContact CB-CB 4.37Å; K271-L274 HydrophobicContact CB-CD1 4.28Å; K271-L274 HydrophobicContact CD-CD1 4.25Å; K271-L274 HydrophobicContact CG-CD1 4.49Å; K271-L274 PolarHBondContact O-N 2.8Å; K271-F275 WeakPolarHBondContact O-CB 3.18Å; K271-F275 PolarHBondContact O-N 3.25Å; K271-T324 PolarHBondContact N-O 3.19Å; K271-T324 VanDerWaalsContact N-O 3.1Å
272	K	97.4	Very high	95.4	Very high	55 Å²	55	41 Å²	41	24%	0.239	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-31.6	179.7	75.3	180	-177.3	-179.5	0	112.7	L228 N270 A276 Y297 L323 T324 C325 N331	L228-K272 HydrophobicContact CD1-CB 4.19Å; N270-K272 VanDerWaalsContact C-N 3.29Å; K272-A276 WeakPolarHBondContact O-CB 3.46Å; K272-A276 PolarHBondContact O-N 2.93Å; K272-Y297 HydrophobicContact CB-CE2 4.47Å; K272-L323 HydrophobicContact CD-CB 4.08Å; K272-T324 WeakPolarHBondContact CG-O 3.43Å; K272-T324 PolarHBondContact N-O 3.11Å; K272-C325 HydrophobicContact CG-CB 4.26Å; K272-N331 PolarHBondContact NZ-ND2 3.35Å
273	D	96.7	Very high	96	Very high	56 Å²	56	36.5 Å²	36.5	30%	0.299	18%	0.18	S	C	.	.	H	α-helix	trans	-63.6	-50.8	175.3	58.9	-42.2	0	0	0	111.4	K271 F275 A276 E277	K271-D273 VanDerWaalsContact C-OD1 3.24Å; K271-D273 WeakPolarHBondContact CA-OD1 3.28Å; K271-D273 PolarHBondContact O-N 3.16Å; D273-F275 VanDerWaalsContact C-N 3.33Å; D273-F275 PolarHBondContact O-N 2.59Å; D273-A276 PolarHBondContact O-N 2.82Å; D273-E277 PolarHBondContact O-N 3.21Å
274	L	96.6	Very high	96.4	Very high	50 Å²	50	35.6 Å²	35.6	26%	0.262	18%	0.175	S	C	.	.	H	α-helix	trans	-67.2	-37.8	177.5	-60	-179.4	0	0	0	111.5	D151 K271 E277 K278	D151-L274 HydrophobicContact CB-CD1 3.65Å; K271-L274 HydrophobicContact CB-CB 4.37Å; K271-L274 HydrophobicContact CB-CD1 4.28Å; K271-L274 HydrophobicContact CD-CD1 4.25Å; K271-L274 HydrophobicContact CG-CD1 4.49Å; K271-L274 PolarHBondContact O-N 2.8Å; L274-E277 PolarHBondContact O-N 3.22Å; L274-K278 WeakPolarHBondContact O-CG 3.22Å; L274-K278 PolarHBondContact O-N 3.29Å
275	F	98.1	Very high	96.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-43.1	176.1	-177.8	-110.1	0	0	0	112.1	L228 Y231 K271 D273 E277 K278 I279 Y297 A300 T301 I304	L228-F275 HydrophobicContact CB-CB 3.66Å; L228-F275 HydrophobicContact CB-CD1 4.34Å; L228-F275 HydrophobicContact CB-CD2 4.02Å; L228-F275 HydrophobicContact CB-CG 3.75Å; L228-F275 HydrophobicContact CD1-CB 4.43Å; L228-F275 HydrophobicContact CD1-CD1 4.3Å; L228-F275 HydrophobicContact CD1-CG 4.46Å; L228-F275 WeakPolarHBondContact O-CD2 3.36Å; Y231-F275 AromaticContact CD1-CD2 3.78Å; Y231-F275 HydrophobicContact CD1-CD2 3.78Å; Y231-F275 AromaticContact CD1-CE2 3.64Å; Y231-F275 HydrophobicContact CD1-CE2 3.64Å; Y231-F275 AromaticContact CE1-CD2 3.73Å; Y231-F275 HydrophobicContact CE1-CD2 3.73Å; Y231-F275 AromaticContact CE1-CE2 3.68Å; Y231-F275 HydrophobicContact CE1-CE2 3.68Å; Y231-F275 HydrophobicContact CG-CE2 4.28Å; K271-F275 WeakPolarHBondContact O-CB 3.18Å; K271-F275 PolarHBondContact O-N 3.25Å; D273-F275 VanDerWaalsContact C-N 3.33Å; D273-F275 PolarHBondContact O-N 2.59Å; F275-E277 PolarHBondContact O-N 2.75Å; F275-K278 PolarHBondContact O-N 3.48Å; F275-I279 HydrophobicContact CE2-CB 4.43Å; F275-I279 HydrophobicContact CE2-CD1 4.14Å; F275-I279 HydrophobicContact CZ-CB 4.28Å; F275-I279 HydrophobicContact CZ-CD1 3.95Å; F275-I279 HydrophobicContact CZ-CG1 4.15Å; F275-I279 WeakPolarHBondContact O-CB 3.42Å; F275-I279 WeakPolarHBondContact O-CG2 3.27Å; F275-I279 PolarHBondContact O-N 2.86Å; F275-Y297 AromaticContact CD1-CD2 3.71Å; F275-Y297 HydrophobicContact CD1-CD2 3.71Å; F275-Y297 AromaticContact CD1-CE2 3.83Å; F275-Y297 HydrophobicContact CD1-CE2 3.83Å; F275-Y297 HydrophobicContact CE1-CD2 4.11Å; F275-Y297 HydrophobicContact CE1-CE2 4.5Å; F275-A300 HydrophobicContact CE1-CB 4.16Å; F275-A300 HydrophobicContact CZ-CB 3.76Å; F275-T301 WeakPolarHBondContact CE1-OG1 3.49Å; F275-I304 HydrophobicContact CE2-CD1 4.03Å; F275-I304 HydrophobicContact CZ-CD1 3.86Å
276	A	97.6	Very high	96.8	Very high	25 Å²	25	41.3 Å²	41.3	21%	0.207	21%	0.205	C	C	.	.	H	α-helix	trans	-57.9	-35.7	178.4	0	0	0	0	0	112.9	K272 D273 K280 Y297	K272-A276 WeakPolarHBondContact O-CB 3.46Å; K272-A276 PolarHBondContact O-N 2.93Å; D273-A276 PolarHBondContact O-N 2.82Å; A276-K280 VanDerWaalsContact O-CE 3.25Å; A276-K280 WeakPolarHBondContact O-CE 3.34Å; A276-K280 WeakPolarHBondContact O-CG 3.07Å; A276-Y297 HydrophobicContact CB-CD2 3.79Å; A276-Y297 HydrophobicContact CB-CE2 4.08Å; A276-Y297 HydrophobicContact CB-CG 4.45Å
277	E	95.6	Very high	96.8	Very high	108 Å²	108	41.2 Å²	41.2	51%	0.505	21%	0.205	S	C	.	.	H	α-helix	trans	-80	-38.5	175.2	-65	-50.1	127.9	0	0	113.1	D273 L274 F275 K280	D273-E277 PolarHBondContact O-N 3.21Å; L274-E277 PolarHBondContact O-N 3.22Å; F275-E277 PolarHBondContact O-N 2.75Å; E277-K280 IonicContact OE1-NZ 3.99Å; E277-K280 PolarHBondContact OE1-NZ 3.41Å; E277-K280 IonicContact OE2-NZ 3.14Å; E277-K280 PolarHBondContact OE2-NZ 3.34Å
278	K	95.8	Very high	96.8	Very high	47 Å²	47	41.4 Å²	41.4	20%	0.204	21%	0.206	C	C	.	.	H	α-helix	trans	-69.5	-39.5	-178.2	-72.9	-177.4	76.4	177.8	0	112.9	S229 Y231 D232 L274 F275 K280 K281 S282	S229-K278 PolarHBondContact O-NZ 3Å; Y231-K278 HydrophobicContact CE1-CB 4.09Å; Y231-K278 VanDerWaalsContact OH-C 3.3Å; Y231-K278 PolarHBondContact OH-O 3.48Å; D232-K278 WeakPolarHBondContact OD1-CE 3.4Å; D232-K278 IonicContact OD1-NZ 3.49Å; D232-K278 PolarHBondContact OD1-NZ 3.35Å; D232-K278 VanDerWaalsContact OD2-CE 3.32Å; D232-K278 WeakPolarHBondContact OD2-CE 3.31Å; D232-K278 IonicContact OD2-NZ 3.54Å; L274-K278 WeakPolarHBondContact O-CG 3.22Å; L274-K278 PolarHBondContact O-N 3.29Å; F275-K278 PolarHBondContact O-N 3.48Å; K278-K280 PolarHBondContact O-N 2.93Å; K278-K280 VanDerWaalsContact O-N 3.16Å; K278-K281 PolarHBondContact O-N 3.09Å; K278-S282 PolarHBondContact O-N 3.23Å
279	I	97.2	Very high	96.8	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-62.3	-27.4	-176.7	-161.7	61.7	0	0	0	112.4	Y231 F275 K281 L284 N295 A300	Y231-I279 HydrophobicContact CE2-CD1 4.38Å; Y231-I279 WeakPolarHBondContact OH-CA 3.33Å; Y231-I279 PolarHBondContact OH-N 3.36Å; F275-I279 HydrophobicContact CE2-CB 4.43Å; F275-I279 HydrophobicContact CE2-CD1 4.14Å; F275-I279 HydrophobicContact CZ-CB 4.28Å; F275-I279 HydrophobicContact CZ-CD1 3.95Å; F275-I279 HydrophobicContact CZ-CG1 4.15Å; F275-I279 WeakPolarHBondContact O-CB 3.42Å; F275-I279 WeakPolarHBondContact O-CG2 3.27Å; F275-I279 PolarHBondContact O-N 2.86Å; I279-K281 PolarHBondContact O-N 3.45Å; I279-L284 HydrophobicContact CD1-CB 4.03Å; I279-N295 VanDerWaalsContact CD1-OD1 3.27Å; I279-N295 WeakPolarHBondContact CD1-OD1 3.32Å; I279-N295 PolarHBondContact O-ND2 3.19Å; I279-A300 HydrophobicContact CD1-CB 4.01Å; I279-A300 HydrophobicContact CG1-CB 4.12Å
280	K	95.8	Very high	96.7	Very high	140 Å²	140	51.6 Å²	51.6	61%	0.609	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.3	174.1	-60.2	172.4	-168.9	166.4	0	113.2	A276 E277 K278	A276-K280 VanDerWaalsContact O-CE 3.25Å; A276-K280 WeakPolarHBondContact O-CE 3.34Å; A276-K280 WeakPolarHBondContact O-CG 3.07Å; E277-K280 IonicContact OE1-NZ 3.99Å; E277-K280 PolarHBondContact OE1-NZ 3.41Å; E277-K280 IonicContact OE2-NZ 3.14Å; E277-K280 PolarHBondContact OE2-NZ 3.34Å; K278-K280 PolarHBondContact O-N 2.93Å; K278-K280 VanDerWaalsContact O-N 3.16Å
281	K	93.6	Very high	96.7	Very high	155 Å²	155	52.2 Å²	52.2	67%	0.674	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-33.5	-173.1	-60.4	-179.5	-178.7	179.5	0	113.2	K278 I279	K278-K281 PolarHBondContact O-N 3.09Å; I279-K281 PolarHBondContact O-N 3.45Å
282	S	94.8	Very high	96.6	Very high	4 Å²	4	57.8 Å²	57.8	3%	0.028	30%	0.301	C	S	.	.	S	Bend	trans	-126.2	112.7	-168.8	-175.9	0	0	0	0	108	R145 Y231 D232 K278 I286	R145-S282 PolarHBondContact NH1-OG 2.86Å; Y231-S282 WeakPolarHBondContact CE2-O 3.48Å; Y231-S282 WeakPolarHBondContact OH-CB 3.46Å; Y231-S282 PolarHBondContact OH-O 3.11Å; D232-S282 WeakPolarHBondContact CB-OG 3.08Å; D232-S282 VanDerWaalsContact OD2-CB 3.31Å; D232-S282 WeakPolarHBondContact OD2-CB 3.41Å; D232-S282 PolarHBondContact OD2-OG 3.4Å; K278-S282 PolarHBondContact O-N 3.23Å; S282-I286 WeakPolarHBondContact OG-CD1 3.49Å
283	P	96.6	Very high	96.5	Very high	52 Å²	52	57 Å²	57	34%	0.338	31%	0.308	S	S	.	.			trans	-71.9	147.8	-171.8	28.2	-35.3	0	0	0	112.2	T285 I286 N295	P283-T285 PolarHBondContact O-N 2.9Å; P283-T285 VanDerWaalsContact O-N 3.08Å; P283-I286 HydrophobicContact CG-CD1 4.23Å; P283-I286 HydrophobicContact CG-CG1 4.28Å; P283-I286 PolarHBondContact O-N 3.06Å; P283-I286 VanDerWaalsContact O-N 3.15Å; P283-N295 VanDerWaalsContact CA-OD1 3.28Å; P283-N295 WeakPolarHBondContact CA-OD1 3.26Å
284	L	97.8	Very high	96.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-58.2	-25.8	178.8	-175	61.9	0	0	0	112.8	Y231 I279 I286 C287 F288 Y291 N295 A300 Y303 I304	Y231-L284 HydrophobicContact CD2-CD1 4.06Å; Y231-L284 HydrophobicContact CG-CD1 4.34Å; I279-L284 HydrophobicContact CD1-CB 4.03Å; L284-I286 PolarHBondContact O-N 3.31Å; L284-I286 VanDerWaalsContact O-N 3.08Å; L284-C287 PolarHBondContact O-N 3.32Å; L284-F288 HydrophobicContact CD1-CD2 3.7Å; L284-F288 HydrophobicContact CD1-CE2 4.04Å; L284-F288 HydrophobicContact CD2-CD2 4.32Å; L284-F288 HydrophobicContact CG-CD2 3.89Å; L284-F288 PolarHBondContact O-N 3.4Å; L284-Y291 HydrophobicContact CB-CD1 3.94Å; L284-Y291 HydrophobicContact CB-CE1 4.17Å; L284-Y291 HydrophobicContact CD2-CD1 3.88Å; L284-Y291 HydrophobicContact CD2-CD2 3.9Å; L284-Y291 HydrophobicContact CD2-CE1 3.96Å; L284-Y291 HydrophobicContact CD2-CE2 3.99Å; L284-Y291 HydrophobicContact CD2-CG 3.83Å; L284-Y291 HydrophobicContact CG-CD1 4.23Å; L284-Y291 HydrophobicContact CG-CG 4.35Å; L284-N295 PolarHBondContact N-OD1 3.22Å; L284-A300 HydrophobicContact CB-CB 4.42Å; L284-A300 HydrophobicContact CD2-CB 3.76Å; L284-Y303 HydrophobicContact CD2-CD1 3.88Å; L284-Y303 HydrophobicContact CD2-CG 4.39Å; L284-I304 HydrophobicContact CD1-CD1 3.97Å; L284-I304 HydrophobicContact CD1-CG1 4.22Å
285	T	97.4	Very high	96.4	Very high	62 Å²	62	57.5 Å²	57.5	38%	0.38	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-61.6	-14.9	178.9	53.3	0	0	0	0	114.7	P283 C287 F288 P289 Y291	P283-T285 PolarHBondContact O-N 2.9Å; P283-T285 VanDerWaalsContact O-N 3.08Å; T285-C287 VanDerWaalsContact C-N 3.28Å; T285-F288 WeakPolarHBondContact CA-O 3.49Å; T285-F288 CarbonylContact O-C 3.6Å; T285-P289 WeakPolarHBondContact O-CA 3.41Å; T285-Y291 HydrophobicContact CG2-CD1 4.33Å
286	I	95.4	Very high	96.3	Very high	81 Å²	81	59.9 Å²	59.9	42%	0.415	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-62.1	-39.4	169.1	-69.1	166.9	0	0	0	110.9	D232 S282 P283 L284	D232-I286 HydrophobicContact CB-CD1 4.47Å; D232-I286 HydrophobicContact CB-CG2 4.21Å; S282-I286 WeakPolarHBondContact OG-CD1 3.49Å; P283-I286 HydrophobicContact CG-CD1 4.23Å; P283-I286 HydrophobicContact CG-CG1 4.28Å; P283-I286 PolarHBondContact O-N 3.06Å; P283-I286 VanDerWaalsContact O-N 3.15Å; L284-I286 PolarHBondContact O-N 3.31Å; L284-I286 VanDerWaalsContact O-N 3.08Å
287	C	96.8	Very high	96.4	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.007	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-45.1	176.5	-168	0	0	0	0	111.3	Y231 H245 L284 T285 P289	Y231-C287 HydrophobicContact CD2-CB 4.43Å; Y231-C287 VanDerWaalsContact O-CB 3.27Å; Y231-C287 WeakPolarHBondContact O-CB 3.44Å; H245-C287 PolarHBondContact CE1-O 3.48Å; H245-C287 PolarHBondContact NE2-O 3.02Å; H245-C287 VanDerWaalsContact NE2-O 3.14Å; L284-C287 PolarHBondContact O-N 3.32Å; T285-C287 VanDerWaalsContact C-N 3.28Å; C287-P289 WeakPolarHBondContact O-CD 3.39Å
288	F	97.6	Very high	96.4	Very high	3 Å²	3	62.3 Å²	62.3	1%	0.013	34%	0.337	C	S	.	.			trans	-122.7	83.5	-172.7	-58.1	-74.4	0	0	0	110.1	M244 L248 L284 T285 E290 Y291 Y303 I304 Q307	M244-F288 HydrophobicContact CG-CE2 4.07Å; M244-F288 HydrophobicContact CG-CZ 3.77Å; L248-F288 HydrophobicContact CD1-CE1 3.73Å; L248-F288 HydrophobicContact CD1-CZ 3.82Å; L284-F288 HydrophobicContact CD1-CD2 3.7Å; L284-F288 HydrophobicContact CD1-CE2 4.04Å; L284-F288 HydrophobicContact CD2-CD2 4.32Å; L284-F288 HydrophobicContact CG-CD2 3.89Å; L284-F288 PolarHBondContact O-N 3.4Å; T285-F288 WeakPolarHBondContact CA-O 3.49Å; T285-F288 CarbonylContact O-C 3.6Å; F288-E290 VanDerWaalsContact C-OE2 3.28Å; F288-E290 PolarHBondContact O-N 3.27Å; F288-Y291 WeakPolarHBondContact O-CB 3.37Å; F288-Y291 PolarHBondContact O-N 2.96Å; F288-Y303 HydrophobicContact CB-CE1 3.87Å; F288-Y303 HydrophobicContact CD1-CE1 4.06Å; F288-Y303 HydrophobicContact CD2-CD1 4.3Å; F288-Y303 AromaticContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CE2-CE1 4.48Å; F288-Y303 HydrophobicContact CG-CD1 4.49Å; F288-Y303 AromaticContact CG-CE1 3.68Å; F288-Y303 HydrophobicContact CG-CE1 3.68Å; F288-I304 HydrophobicContact CE2-CG1 4.13Å; F288-Q307 HydrophobicContact CE1-CG 4.16Å; F288-Q307 HydrophobicContact CZ-CG 4.34Å
289	P	97.3	Very high	96.5	Very high	106 Å²	106	63.8 Å²	63.8	69%	0.688	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-25.9	-178.8	-26.9	35.5	0	0	0	114.2	T285 C287 Y291	T285-P289 WeakPolarHBondContact O-CA 3.41Å; C287-P289 WeakPolarHBondContact O-CD 3.39Å; P289-Y291 VanDerWaalsContact C-N 3.32Å
290	E	96.6	Very high	96.6	Very high	110 Å²	110	63.7 Å²	63.7	51%	0.514	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-7.3	176.8	72.8	-82.7	-160.7	0	0	114.4	F288 T292 Y303	F288-E290 VanDerWaalsContact C-OE2 3.28Å; F288-E290 PolarHBondContact O-N 3.27Å; E290-T292 PolarHBondContact O-N 2.93Å; E290-Y303 WeakPolarHBondContact CG-OH 3.5Å; E290-Y303 PolarHBondContact OE1-OH 3.31Å
291	Y	97.8	Very high	96.7	Very high	16 Å²	16	57.3 Å²	57.3	6%	0.063	32%	0.32	C	S	.	.			trans	-66.6	120.7	178.4	179.1	-112	0	0	0	111	L284 T285 F288 P289 G293 A294 D299 A300 Y303	L284-Y291 HydrophobicContact CB-CD1 3.94Å; L284-Y291 HydrophobicContact CB-CE1 4.17Å; L284-Y291 HydrophobicContact CD2-CD1 3.88Å; L284-Y291 HydrophobicContact CD2-CD2 3.9Å; L284-Y291 HydrophobicContact CD2-CE1 3.96Å; L284-Y291 HydrophobicContact CD2-CE2 3.99Å; L284-Y291 HydrophobicContact CD2-CG 3.83Å; L284-Y291 HydrophobicContact CG-CD1 4.23Å; L284-Y291 HydrophobicContact CG-CG 4.35Å; T285-Y291 HydrophobicContact CG2-CD1 4.33Å; F288-Y291 WeakPolarHBondContact O-CB 3.37Å; F288-Y291 PolarHBondContact O-N 2.96Å; P289-Y291 VanDerWaalsContact C-N 3.32Å; Y291-G293 WeakPolarHBondContact CE1-O 3.39Å; Y291-G293 VanDerWaalsContact CZ-C 3.5Å; Y291-G293 VanDerWaalsContact CZ-CA 3.43Å; Y291-G293 WeakPolarHBondContact OH-CA 3.4Å; Y291-A294 WeakPolarHBondContact CE1-O 3.3Å; Y291-A294 PolarHBondContact OH-O 3.16Å; Y291-D299 VanDerWaalsContact OH-CB 3.22Å; Y291-D299 WeakPolarHBondContact OH-CB 3.4Å; Y291-A300 PolarHBondContact OH-N 3.46Å; Y291-Y303 AromaticContact CD2-CD1 3.8Å; Y291-Y303 HydrophobicContact CD2-CD1 3.8Å; Y291-Y303 AromaticContact CD2-CD2 3.45Å; Y291-Y303 HydrophobicContact CD2-CD2 3.45Å; Y291-Y303 VanDerWaalsContact CD2-CD2 3.45Å; Y291-Y303 HydrophobicContact CD2-CE1 4.1Å; Y291-Y303 AromaticContact CD2-CE2 3.76Å; Y291-Y303 HydrophobicContact CD2-CE2 3.76Å; Y291-Y303 AromaticContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CD2-CG 3.44Å; Y291-Y303 VanDerWaalsContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CE2-CD1 4.29Å; Y291-Y303 AromaticContact CE2-CD2 3.76Å; Y291-Y303 HydrophobicContact CE2-CD2 3.76Å; Y291-Y303 HydrophobicContact CE2-CE2 4.5Å; Y291-Y303 AromaticContact CE2-CG 3.61Å; Y291-Y303 HydrophobicContact CE2-CG 3.61Å
292	T	96.1	Very high	96.9	Very high	140 Å²	140	52.3 Å²	52.3	86%	0.859	31%	0.307	S	S	*	.			trans	-111.7	-2.4	-178	50.7	0	0	0	0	113.5	E290	E290-T292 PolarHBondContact O-N 2.93Å
293	G	95.3	Very high	97.1	Very high	37 Å²	37	54.3 Å²	54.3	38%	0.381	32%	0.315	S	S	.	.	S	Bend	trans	-74.4	173.7	178.5	0	0	0	0	0	113	Y291	Y291-G293 WeakPolarHBondContact CE1-O 3.39Å; Y291-G293 VanDerWaalsContact CZ-C 3.5Å; Y291-G293 VanDerWaalsContact CZ-CA 3.43Å; Y291-G293 WeakPolarHBondContact OH-CA 3.4Å
294	A	96.4	Very high	97.2	Very high	50 Å²	50	51.9 Å²	51.9	41%	0.413	30%	0.299	S	S	.	.			trans	-67.8	147.8	176	0	0	0	0	0	110.8	Y291 T296 D299	Y291-A294 WeakPolarHBondContact CE1-O 3.3Å; Y291-A294 PolarHBondContact OH-O 3.16Å; A294-T296 HydrophobicContact CB-CG2 3.93Å; A294-T296 PolarHBondContact O-N 2.9Å; A294-D299 WeakPolarHBondContact O-CB 3.31Å
295	N	95	Very high	97.2	Very high	67 Å²	67	54.6 Å²	54.6	36%	0.358	31%	0.312	S	S	.	.	S	Bend	trans	-83.7	48.6	177.9	-165.9	63.6	0	0	0	111.8	I279 P283 L284	I279-N295 VanDerWaalsContact CD1-OD1 3.27Å; I279-N295 WeakPolarHBondContact CD1-OD1 3.32Å; I279-N295 PolarHBondContact O-ND2 3.19Å; P283-N295 VanDerWaalsContact CA-OD1 3.28Å; P283-N295 WeakPolarHBondContact CA-OD1 3.26Å; L284-N295 PolarHBondContact N-OD1 3.22Å
296	T	97.1	Very high	97.2	Very high	51 Å²	51	55.4 Å²	55.4	31%	0.313	32%	0.316	S	S	.	.	S	Bend	trans	-96	163.5	175.9	66.3	0	0	0	0	109.5	A294 E298 D299 A300	A294-T296 HydrophobicContact CB-CG2 3.93Å; A294-T296 PolarHBondContact O-N 2.9Å; T296-E298 VanDerWaalsContact C-N 3.32Å; T296-D299 VanDerWaalsContact OG1-CB 3.29Å; T296-D299 WeakPolarHBondContact OG1-CB 3.41Å; T296-D299 PolarHBondContact OG1-N 3.07Å; T296-D299 VanDerWaalsContact OG1-N 3.12Å; T296-D299 PolarHBondContact OG1-OD2 3.41Å; T296-A300 WeakPolarHBondContact O-CB 3.42Å; T296-A300 PolarHBondContact O-N 3.17Å
297	Y	97.7	Very high	97.3	Very high	55 Å²	55	53.3 Å²	53.3	22%	0.216	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-44.3	175.8	168.2	-101.9	0	0	0	111.2	K272 F275 A276 T301	K272-Y297 HydrophobicContact CB-CE2 4.47Å; F275-Y297 AromaticContact CD1-CD2 3.71Å; F275-Y297 HydrophobicContact CD1-CD2 3.71Å; F275-Y297 AromaticContact CD1-CE2 3.83Å; F275-Y297 HydrophobicContact CD1-CE2 3.83Å; F275-Y297 HydrophobicContact CE1-CD2 4.11Å; F275-Y297 HydrophobicContact CE1-CE2 4.5Å; A276-Y297 HydrophobicContact CB-CD2 3.79Å; A276-Y297 HydrophobicContact CB-CE2 4.08Å; A276-Y297 HydrophobicContact CB-CG 4.45Å; Y297-T301 WeakPolarHBondContact O-CB 3.35Å; Y297-T301 PolarHBondContact O-N 2.81Å; Y297-T301 PolarHBondContact O-OG1 2.82Å
298	E	97.6	Very high	97.4	Very high	128 Å²	128	53.2 Å²	53.2	60%	0.598	30%	0.304	S	S	*	.	H	α-helix	trans	-67.2	-52.1	-175.1	-64.5	72.5	-160.3	0	0	111.8	T296 T301 A302	T296-E298 VanDerWaalsContact C-N 3.32Å; E298-T301 PolarHBondContact O-N 3.38Å; E298-A302 WeakPolarHBondContact O-CB 3.4Å; E298-A302 PolarHBondContact O-N 2.84Å
299	D	97.9	Very high	97.4	Very high	79 Å²	79	56.4 Å²	56.4	42%	0.422	32%	0.319	S	S	.	.	H	α-helix	trans	-65.5	-43.1	-178.3	-68.1	-81.5	0	0	0	111.3	Y291 A294 T296 A302 Y303	Y291-D299 VanDerWaalsContact OH-CB 3.22Å; Y291-D299 WeakPolarHBondContact OH-CB 3.4Å; A294-D299 WeakPolarHBondContact O-CB 3.31Å; T296-D299 VanDerWaalsContact OG1-CB 3.29Å; T296-D299 WeakPolarHBondContact OG1-CB 3.41Å; T296-D299 PolarHBondContact OG1-N 3.07Å; T296-D299 VanDerWaalsContact OG1-N 3.12Å; T296-D299 PolarHBondContact OG1-OD2 3.41Å; D299-A302 PolarHBondContact O-N 3.42Å; D299-Y303 WeakPolarHBondContact O-CB 3.07Å; D299-Y303 PolarHBondContact O-N 2.62Å
300	A	98.3	Very high	97.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.2	-39.1	179.7	0	0	0	0	0	112	F275 I279 L284 Y291 T296 Y303 I304	F275-A300 HydrophobicContact CE1-CB 4.16Å; F275-A300 HydrophobicContact CZ-CB 3.76Å; I279-A300 HydrophobicContact CD1-CB 4.01Å; I279-A300 HydrophobicContact CG1-CB 4.12Å; L284-A300 HydrophobicContact CB-CB 4.42Å; L284-A300 HydrophobicContact CD2-CB 3.76Å; Y291-A300 PolarHBondContact OH-N 3.46Å; T296-A300 WeakPolarHBondContact O-CB 3.42Å; T296-A300 PolarHBondContact O-N 3.17Å; A300-Y303 PolarHBondContact O-N 3Å; A300-I304 VanDerWaalsContact O-CG1 3.31Å; A300-I304 WeakPolarHBondContact O-CG1 3.17Å; A300-I304 PolarHBondContact O-N 3.08Å
301	T	98.1	Very high	97.3	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-47.4	175.5	-63.2	0	0	0	0	111.4	F275 Y297 E298 Y303 I304 Q305 L323	F275-T301 WeakPolarHBondContact CE1-OG1 3.49Å; Y297-T301 WeakPolarHBondContact O-CB 3.35Å; Y297-T301 PolarHBondContact O-N 2.81Å; Y297-T301 PolarHBondContact O-OG1 2.82Å; E298-T301 PolarHBondContact O-N 3.38Å; T301-Y303 VanDerWaalsContact C-N 3.28Å; T301-Y303 PolarHBondContact O-N 3.46Å; T301-I304 PolarHBondContact O-N 3.14Å; T301-Q305 PolarHBondContact O-N 2.97Å; T301-L323 HydrophobicContact CG2-CD1 3.75Å; T301-L323 HydrophobicContact CG2-CD2 3.27Å; T301-L323 HydrophobicContact CG2-CG 4.06Å
302	A	98	Very high	97.2	Very high	50 Å²	50	53.6 Å²	53.6	41%	0.413	31%	0.306	S	S	.	.	H	α-helix	trans	-59.9	-41.1	177.7	0	0	0	0	0	111.3	E298 D299 Q305 V306	E298-A302 WeakPolarHBondContact O-CB 3.4Å; E298-A302 PolarHBondContact O-N 2.84Å; D299-A302 PolarHBondContact O-N 3.42Å; A302-Q305 WeakPolarHBondContact O-CB 3.43Å; A302-Q305 PolarHBondContact O-N 3.36Å; A302-V306 WeakPolarHBondContact O-CG2 3.43Å; A302-V306 PolarHBondContact O-N 3.19Å
303	Y	98.4	Very high	97.1	Very high	47 Å²	47	55.1 Å²	55.1	18%	0.184	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-48	175.7	-176.3	-92.1	0	0	0	112.4	L284 F288 E290 Y291 D299 A300 T301 Q305 V306 Q307	L284-Y303 HydrophobicContact CD2-CD1 3.88Å; L284-Y303 HydrophobicContact CD2-CG 4.39Å; F288-Y303 HydrophobicContact CB-CE1 3.87Å; F288-Y303 HydrophobicContact CD1-CE1 4.06Å; F288-Y303 HydrophobicContact CD2-CD1 4.3Å; F288-Y303 AromaticContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CD2-CE1 3.92Å; F288-Y303 HydrophobicContact CE2-CE1 4.48Å; F288-Y303 HydrophobicContact CG-CD1 4.49Å; F288-Y303 AromaticContact CG-CE1 3.68Å; F288-Y303 HydrophobicContact CG-CE1 3.68Å; E290-Y303 WeakPolarHBondContact CG-OH 3.5Å; E290-Y303 PolarHBondContact OE1-OH 3.31Å; Y291-Y303 AromaticContact CD2-CD1 3.8Å; Y291-Y303 HydrophobicContact CD2-CD1 3.8Å; Y291-Y303 AromaticContact CD2-CD2 3.45Å; Y291-Y303 HydrophobicContact CD2-CD2 3.45Å; Y291-Y303 VanDerWaalsContact CD2-CD2 3.45Å; Y291-Y303 HydrophobicContact CD2-CE1 4.1Å; Y291-Y303 AromaticContact CD2-CE2 3.76Å; Y291-Y303 HydrophobicContact CD2-CE2 3.76Å; Y291-Y303 AromaticContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CD2-CG 3.44Å; Y291-Y303 VanDerWaalsContact CD2-CG 3.44Å; Y291-Y303 HydrophobicContact CE2-CD1 4.29Å; Y291-Y303 AromaticContact CE2-CD2 3.76Å; Y291-Y303 HydrophobicContact CE2-CD2 3.76Å; Y291-Y303 HydrophobicContact CE2-CE2 4.5Å; Y291-Y303 AromaticContact CE2-CG 3.61Å; Y291-Y303 HydrophobicContact CE2-CG 3.61Å; D299-Y303 WeakPolarHBondContact O-CB 3.07Å; D299-Y303 PolarHBondContact O-N 2.62Å; A300-Y303 PolarHBondContact O-N 3Å; T301-Y303 VanDerWaalsContact C-N 3.28Å; T301-Y303 PolarHBondContact O-N 3.46Å; Y303-Q305 VanDerWaalsContact C-N 3.29Å; Y303-Q305 PolarHBondContact O-N 2.87Å; Y303-V306 PolarHBondContact O-N 3.22Å; Y303-Q307 HydrophobicContact CD1-CG 3.92Å; Y303-Q307 HydrophobicContact CE1-CG 3.57Å; Y303-Q307 VanDerWaalsContact CZ-NE2 3.28Å; Y303-Q307 WeakPolarHBondContact O-CG 3.4Å; Y303-Q307 PolarHBondContact O-N 3.45Å; Y303-Q307 PolarHBondContact OH-NE2 3.26Å
304	I	98.5	Very high	96.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-43.9	177.5	-68.5	166	0	0	0	110.3	L228 M244 L269 F275 L284 F288 A300 T301 V306 Q307 F308	L228-I304 HydrophobicContact CD2-CB 4.3Å; L228-I304 HydrophobicContact CD2-CD1 3.89Å; L228-I304 HydrophobicContact CD2-CG2 3.78Å; M244-I304 HydrophobicContact CE-CD1 4.29Å; M244-I304 HydrophobicContact CE-CG2 4.2Å; M244-I304 HydrophobicContact SD-CG2 4.23Å; L269-I304 HydrophobicContact CD2-CG2 4.4Å; F275-I304 HydrophobicContact CE2-CD1 4.03Å; F275-I304 HydrophobicContact CZ-CD1 3.86Å; L284-I304 HydrophobicContact CD1-CD1 3.97Å; L284-I304 HydrophobicContact CD1-CG1 4.22Å; F288-I304 HydrophobicContact CE2-CG1 4.13Å; A300-I304 VanDerWaalsContact O-CG1 3.31Å; A300-I304 WeakPolarHBondContact O-CG1 3.17Å; A300-I304 PolarHBondContact O-N 3.08Å; T301-I304 PolarHBondContact O-N 3.14Å; I304-V306 PolarHBondContact O-N 2.98Å; I304-Q307 WeakPolarHBondContact O-CB 3.38Å; I304-Q307 PolarHBondContact O-N 3.38Å; I304-Q307 VanDerWaalsContact O-N 3.14Å; I304-F308 HydrophobicContact CG2-CD2 3.96Å; I304-F308 HydrophobicContact CG2-CE2 3.88Å; I304-F308 WeakPolarHBondContact O-CD2 3.48Å; I304-F308 PolarHBondContact O-N 2.9Å; I304-F308 VanDerWaalsContact O-N 3.17Å
305	Q	98.2	Very high	96.3	Very high	58 Å²	58	58.2 Å²	58.2	27%	0.271	31%	0.305	S	S	.	.	H	α-helix	trans	-55.1	-50.4	176	178.2	173.9	-18.2	0	0	111.5	L269 T301 A302 Y303 Q307 F308 E309 C321	L269-Q305 HydrophobicContact CD1-CB 3.84Å; L269-Q305 HydrophobicContact CD1-CG 4.43Å; T301-Q305 PolarHBondContact O-N 2.97Å; A302-Q305 WeakPolarHBondContact O-CB 3.43Å; A302-Q305 PolarHBondContact O-N 3.36Å; Y303-Q305 VanDerWaalsContact C-N 3.29Å; Y303-Q305 PolarHBondContact O-N 2.87Å; Q305-Q307 VanDerWaalsContact C-N 3.29Å; Q305-Q307 PolarHBondContact O-N 3.07Å; Q305-F308 PolarHBondContact O-N 3.13Å; Q305-F308 VanDerWaalsContact O-N 3.14Å; Q305-E309 HydrophobicContact CG-CG 4.35Å; Q305-E309 VanDerWaalsContact CG-OE1 3.27Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.25Å; Q305-E309 PolarHBondContact NE2-OE1 2.99Å; Q305-E309 WeakPolarHBondContact O-CG 3.46Å; Q305-E309 PolarHBondContact O-N 3.01Å; Q305-C321 HydrophobicContact CG-CB 4.1Å
306	V	97.5	Very high	95.8	Very high	79 Å²	79	61.8 Å²	61.8	48%	0.479	32%	0.324	S	S	.	.	H	α-helix	trans	-59.5	-38.7	177.3	170.8	0	0	0	0	111.7	A302 Y303 I304 F308 E309 S310	A302-V306 WeakPolarHBondContact O-CG2 3.43Å; A302-V306 PolarHBondContact O-N 3.19Å; Y303-V306 PolarHBondContact O-N 3.22Å; I304-V306 PolarHBondContact O-N 2.98Å; V306-F308 VanDerWaalsContact C-N 3.32Å; V306-F308 PolarHBondContact O-N 2.96Å; V306-E309 PolarHBondContact O-N 2.84Å; V306-S310 VanDerWaalsContact O-CB 3.27Å; V306-S310 WeakPolarHBondContact O-CB 3.15Å; V306-S310 PolarHBondContact O-N 2.97Å; V306-S310 PolarHBondContact O-OG 3.14Å
307	Q	98.3	Very high	95.4	Very high	36 Å²	36	60 Å²	60	17%	0.168	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-40.8	176.8	-69	-55	-48.7	0	0	112.4	L248 F288 Y303 I304 Q305 S310	L248-Q307 HydrophobicContact CD1-CB 4.49Å; L248-Q307 HydrophobicContact CD2-CB 4.01Å; F288-Q307 HydrophobicContact CE1-CG 4.16Å; F288-Q307 HydrophobicContact CZ-CG 4.34Å; Y303-Q307 HydrophobicContact CD1-CG 3.92Å; Y303-Q307 HydrophobicContact CE1-CG 3.57Å; Y303-Q307 VanDerWaalsContact CZ-NE2 3.28Å; Y303-Q307 WeakPolarHBondContact O-CG 3.4Å; Y303-Q307 PolarHBondContact O-N 3.45Å; Y303-Q307 PolarHBondContact OH-NE2 3.26Å; I304-Q307 WeakPolarHBondContact O-CB 3.38Å; I304-Q307 PolarHBondContact O-N 3.38Å; I304-Q307 VanDerWaalsContact O-N 3.14Å; Q305-Q307 VanDerWaalsContact C-N 3.29Å; Q305-Q307 PolarHBondContact O-N 3.07Å; Q307-S310 PolarHBondContact O-OG 3.44Å
308	F	98.3	Very high	94.8	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71.7	-48.5	175.5	-81.7	-86.3	0	0	0	112	F224 V226 M244 L248 F251 L267 L269 I304 Q305 V306 S310 K311	F224-F308 HydrophobicContact CE1-CE1 4.29Å; V226-F308 HydrophobicContact CB-CE2 4.46Å; V226-F308 HydrophobicContact CB-CZ 4.18Å; V226-F308 HydrophobicContact CG1-CE1 4.44Å; V226-F308 HydrophobicContact CG1-CE2 3.68Å; V226-F308 HydrophobicContact CG1-CZ 3.54Å; V226-F308 HydrophobicContact CG2-CD1 4.11Å; V226-F308 HydrophobicContact CG2-CE1 3.52Å; V226-F308 HydrophobicContact CG2-CE2 4Å; V226-F308 HydrophobicContact CG2-CZ 3.48Å; V226-F308 VanDerWaalsContact CG2-CZ 3.48Å; M244-F308 HydrophobicContact SD-CE2 3.63Å; M244-F308 HydrophobicContact SD-CZ 3.9Å; L248-F308 HydrophobicContact CD2-CD1 3.86Å; L248-F308 HydrophobicContact CD2-CD2 3.75Å; L248-F308 HydrophobicContact CD2-CE1 3.84Å; L248-F308 HydrophobicContact CD2-CE2 3.73Å; L248-F308 HydrophobicContact CD2-CG 3.8Å; L248-F308 HydrophobicContact CD2-CZ 3.77Å; L248-F308 HydrophobicContact CG-CE1 4.21Å; L248-F308 HydrophobicContact CG-CE2 4.08Å; L248-F308 HydrophobicContact CG-CZ 3.86Å; F251-F308 HydrophobicContact CB-CD1 3.71Å; F251-F308 HydrophobicContact CB-CE1 3.73Å; F251-F308 HydrophobicContact CD1-CB 4.44Å; F251-F308 AromaticContact CD1-CD1 3.76Å; F251-F308 HydrophobicContact CD1-CD1 3.76Å; F251-F308 HydrophobicContact CD2-CD1 4.08Å; F251-F308 HydrophobicContact CE1-CB 4.4Å; F251-F308 HydrophobicContact CE1-CD1 4.41Å; F251-F308 WeakPolarHBondContact CE1-O 3.41Å; F251-F308 AromaticContact CG-CD1 3.57Å; F251-F308 HydrophobicContact CG-CD1 3.57Å; F251-F308 HydrophobicContact CG-CE1 4.09Å; L267-F308 HydrophobicContact CD1-CD1 4.15Å; L267-F308 HydrophobicContact CD1-CG 4.37Å; L267-F308 HydrophobicContact CD2-CB 3.51Å; L267-F308 HydrophobicContact CD2-CG 4.04Å; L269-F308 HydrophobicContact CD2-CD2 4.33Å; I304-F308 HydrophobicContact CG2-CD2 3.96Å; I304-F308 HydrophobicContact CG2-CE2 3.88Å; I304-F308 WeakPolarHBondContact O-CD2 3.48Å; I304-F308 PolarHBondContact O-N 2.9Å; I304-F308 VanDerWaalsContact O-N 3.17Å; Q305-F308 PolarHBondContact O-N 3.13Å; Q305-F308 VanDerWaalsContact O-N 3.14Å; V306-F308 VanDerWaalsContact C-N 3.32Å; V306-F308 PolarHBondContact O-N 2.96Å; F308-S310 PolarHBondContact O-N 2.81Å; F308-K311 WeakPolarHBondContact O-CB 3.25Å; F308-K311 PolarHBondContact O-N 3.29Å
309	E	96.4	Very high	94.5	Very high	70 Å²	70	57.4 Å²	57.4	33%	0.327	30%	0.303	S	S	.	.	H	α-helix	trans	-58.1	-37.1	-179.7	-72	174.2	178.6	0	0	111.9	Q305 V306 K311 N312	Q305-E309 HydrophobicContact CG-CG 4.35Å; Q305-E309 VanDerWaalsContact CG-OE1 3.27Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.25Å; Q305-E309 PolarHBondContact NE2-OE1 2.99Å; Q305-E309 WeakPolarHBondContact O-CG 3.46Å; Q305-E309 PolarHBondContact O-N 3.01Å; V306-E309 PolarHBondContact O-N 2.84Å; E309-K311 PolarHBondContact O-N 2.91Å; E309-K311 VanDerWaalsContact O-N 3.09Å; E309-N312 WeakPolarHBondContact O-CB 3.3Å; E309-N312 PolarHBondContact O-N 3.34Å; E309-N312 VanDerWaalsContact O-N 3.08Å
310	S	96.3	Very high	94.3	Very high	71 Å²	71	55.5 Å²	55.5	50%	0.497	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.6	176.8	77.4	0	0	0	0	114.8	V306 Q307 F308 N312	V306-S310 VanDerWaalsContact O-CB 3.27Å; V306-S310 WeakPolarHBondContact O-CB 3.15Å; V306-S310 PolarHBondContact O-N 2.97Å; V306-S310 PolarHBondContact O-OG 3.14Å; Q307-S310 PolarHBondContact O-OG 3.44Å; F308-S310 PolarHBondContact O-N 2.81Å; S310-N312 VanDerWaalsContact C-N 3.28Å
311	K	96.9	Very high	94.2	Very high	61 Å²	61	56.9 Å²	56.9	27%	0.265	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-13.1	176.5	-55.7	-51.1	178.2	-167.2	0	112.9	F251 D252 N256 F308 E309 R313	F251-K311 HydrophobicContact CD1-CB 3.82Å; F251-K311 HydrophobicContact CD1-CG 4.16Å; F251-K311 HydrophobicContact CE1-CB 4.12Å; D252-K311 HydrophobicContact CB-CB 4.13Å; D252-K311 HydrophobicContact CB-CD 4.28Å; D252-K311 HydrophobicContact CB-CG 4.21Å; N256-K311 PolarHBondContact ND2-O 3.44Å; F308-K311 WeakPolarHBondContact O-CB 3.25Å; F308-K311 PolarHBondContact O-N 3.29Å; E309-K311 PolarHBondContact O-N 2.91Å; E309-K311 VanDerWaalsContact O-N 3.09Å; K311-R313 PolarHBondContact O-N 3.3Å
312	N	95.5	Very high	94.1	Very high	40 Å²	40	58.4 Å²	58.4	21%	0.214	31%	0.306	C	S	.	.			trans	-74.6	117.6	176.5	-172	11.4	0	0	0	111.3	E309 S310 S314 K317 I319	E309-N312 WeakPolarHBondContact O-CB 3.3Å; E309-N312 PolarHBondContact O-N 3.34Å; E309-N312 VanDerWaalsContact O-N 3.08Å; S310-N312 VanDerWaalsContact C-N 3.28Å; N312-S314 PolarHBondContact ND2-O 3.04Å; N312-S314 PolarHBondContact OD1-N 2.84Å; N312-S314 PolarHBondContact OD1-O 2.89Å; N312-K317 PolarHBondContact ND2-O 3.39Å; N312-I319 HydrophobicContact CB-CD1 3.61Å
313	R	94	Very high	94.1	Very high	173 Å²	173	58.8 Å²	58.8	65%	0.653	30%	0.301	S	S	*	.			trans	-100	-5.5	177.7	-54.1	175.7	-161.8	174.4	6.3	112.6	D252 N256 K311	D252-R313 IonicContact OD1-CZ 3.22Å; D252-R313 IonicContact OD1-NE 2.75Å; D252-R313 IonicContact OD1-NH2 3.44Å; D252-R313 PolarHBondContact OD1-NH2 3.33Å; D252-R313 IonicContact OD2-NH2 3.56Å; D252-R313 PolarHBondContact OD2-NH2 2.74Å; N256-R313 PolarHBondContact ND2-NE 3.34Å; N256-R313 WeakPolarHBondContact OD1-CB 3.24Å; N256-R313 WeakPolarHBondContact OD1-CG 3.45Å; N256-R313 PolarHBondContact OD1-N 2.66Å; K311-R313 PolarHBondContact O-N 3.3Å
314	S	90.1	Very high	94	Very high	27 Å²	27	56.6 Å²	56.6	19%	0.189	29%	0.292	C	S	.	.			trans	-93.2	120	178.5	178.9	0	0	0	0	110	N312 N316 K317	N312-S314 PolarHBondContact ND2-O 3.04Å; N312-S314 PolarHBondContact OD1-N 2.84Å; N312-S314 PolarHBondContact OD1-O 2.89Å; S314-N316 PolarHBondContact O-N 2.72Å; S314-K317 PolarHBondContact O-N 3.2Å; S314-K317 PolarHBondContact OG-N 3.41Å
315	P	84.2	Confident	93.9	Very high	124 Å²	124	57 Å²	57	81%	0.805	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.6	179.2	29.2	-35.2	0	0	0	112.9
316	N	84.6	Confident	93.8	Very high	142 Å²	142	54.4 Å²	54.4	76%	0.759	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-8.2	-176.2	-61.3	-21.2	0	0	0	112.9	S314	S314-N316 PolarHBondContact O-N 2.72Å
317	K	88.4	Confident	93.7	Very high	15 Å²	15	51.8 Å²	51.8	7%	0.065	27%	0.268	C	S	.	.			trans	-89.2	122.2	179.9	-179.8	176.2	-67.5	-171.2	0	109.5	C255 F260 I261 T263 I265 N312 S314	C255-K317 PolarHBondContact O-NZ 2.95Å; F260-K317 VanDerWaalsContact O-CE 3.22Å; F260-K317 WeakPolarHBondContact O-CE 3.39Å; F260-K317 PolarHBondContact O-NZ 3.08Å; I261-K317 WeakPolarHBondContact O-CE 3.46Å; T263-K317 WeakPolarHBondContact O-CE 3.48Å; I265-K317 HydrophobicContact CD1-CD 3.97Å; I265-K317 HydrophobicContact CG1-CD 4.27Å; N312-K317 PolarHBondContact ND2-O 3.39Å; S314-K317 PolarHBondContact O-N 3.2Å; S314-K317 PolarHBondContact OG-N 3.41Å
318	E	84.8	Confident	93.6	Very high	98 Å²	98	53.8 Å²	53.8	46%	0.458	28%	0.279	S	S	.	.			trans	-89.2	137.4	172.8	-65.2	-176	177.6	0	0	110.5	I265 Y320	I265-E318 PolarHBondContact N-O 3.01Å; E318-Y320 HydrophobicContact CB-CE1 4.21Å; E318-Y320 HydrophobicContact CB-CE2 4.01Å; E318-Y320 WeakPolarHBondContact OE2-CE1 3.27Å; E318-Y320 PolarHBondContact OE2-OH 3.34Å
319	I	92.7	Very high	93.4	Very high	29 Å²	29	55.5 Å²	55.5	15%	0.149	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.3	169.7	-64	169.6	0	0	0	107.7	F251 I265 L267 N312	F251-I319 HydrophobicContact CE1-CD1 3.97Å; F251-I319 HydrophobicContact CZ-CD1 3.67Å; F251-I319 HydrophobicContact CZ-CG1 4.36Å; I265-I319 HydrophobicContact CB-CG1 4.44Å; I265-I319 CarbonylContact O-C 3.48Å; I265-I319 WeakPolarHBondContact O-CA 3.4Å; L267-I319 HydrophobicContact CB-CG2 3.77Å; L267-I319 HydrophobicContact CD2-CG2 4.31Å; N312-I319 HydrophobicContact CB-CD1 3.61Å
320	Y	93.5	Very high	93.3	Very high	40 Å²	40	54 Å²	54	16%	0.157	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	105.7	177.1	-53.3	-79.1	0	0	0	109.6	I265 I266 L267 E318 I342 N346	I265-Y320 PolarHBondContact O-N 3.47Å; I266-Y320 CarbonylContact C-O 3.44Å; I266-Y320 WeakPolarHBondContact CA-O 3.48Å; I266-Y320 HydrophobicContact CG1-CD2 4.4Å; L267-Y320 PolarHBondContact N-O 3.06Å; E318-Y320 HydrophobicContact CB-CE1 4.21Å; E318-Y320 HydrophobicContact CB-CE2 4.01Å; E318-Y320 WeakPolarHBondContact OE2-CE1 3.27Å; E318-Y320 PolarHBondContact OE2-OH 3.34Å; Y320-I342 HydrophobicContact CD1-CD1 3.72Å; Y320-I342 HydrophobicContact CD1-CG1 4.42Å; Y320-I342 HydrophobicContact CD1-CG2 4.3Å; Y320-I342 HydrophobicContact CD2-CD1 4.41Å; Y320-I342 HydrophobicContact CD2-CG2 3.78Å; Y320-I342 HydrophobicContact CE1-CD1 4.2Å; Y320-I342 HydrophobicContact CE1-CG1 4.41Å; Y320-I342 HydrophobicContact CE1-CG2 3.92Å; Y320-I342 HydrophobicContact CE2-CG2 3.32Å; Y320-I342 HydrophobicContact CG-CD1 3.82Å; Y320-I342 HydrophobicContact CG-CG2 4.21Å; Y320-N346 PolarHBondContact OH-ND2 3.19Å
321	C	95.7	Very high	93.2	Very high	28 Å²	28	51.9 Å²	51.9	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	131.8	-177.8	-168.5	0	0	0	0	112.1	L267 L269 Q305	L267-C321 HydrophobicContact CB-CB 4.49Å; L267-C321 HydrophobicContact CD2-CB 4.49Å; L267-C321 CarbonylContact O-C 3.58Å; L267-C321 WeakPolarHBondContact O-CA 3.45Å; L269-C321 WeakPolarHBondContact CD1-SG 3.46Å; Q305-C321 HydrophobicContact CG-CB 4.1Å
322	H	96.2	Very high	93.1	Very high	39 Å²	39	49 Å²	49	18%	0.181	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.5	174.2	-62.8	-87.2	0	0	0	111.1	L267 F268 L269 T324 V335	L267-H322 PolarHBondContact O-N 2.71Å; F268-H322 WeakPolarHBondContact CA-O 3.41Å; F268-H322 HydrophobicContact CD1-CB 4.05Å; F268-H322 HydrophobicContact CE1-CB 4.19Å; L269-H322 PolarHBondContact N-O 2.71Å; H322-T324 HydrophobicContact CB-CG2 4.3Å; H322-V335 HydrophobicContact CB-CG1 3.73Å; H322-V335 HydrophobicContact CB-CG2 4.28Å
323	L	97	Very high	92.9	Very high	58 Å²	58	51.5 Å²	51.5	30%	0.304	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	119.5	170.4	-70.4	166.2	0	0	0	110.3	L228 L269 K272 T301	L228-L323 HydrophobicContact CD1-CD2 3.83Å; L269-L323 HydrophobicContact CB-CD2 3.67Å; L269-L323 HydrophobicContact CD1-CD2 4.1Å; K272-L323 HydrophobicContact CD-CB 4.08Å; T301-L323 HydrophobicContact CG2-CD1 3.75Å; T301-L323 HydrophobicContact CG2-CD2 3.27Å; T301-L323 HydrophobicContact CG2-CG 4.06Å
324	T	97.4	Very high	92.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.273	C	S	.	.			trans	-122	149.1	-173.1	59	0	0	0	0	113.2	F268 L269 N270 K271 K272 H322 N331 I332 V335	F268-T324 HydrophobicContact CB-CG2 4.25Å; F268-T324 HydrophobicContact CD1-CG2 3.98Å; F268-T324 HydrophobicContact CD2-CG2 4.14Å; F268-T324 HydrophobicContact CE1-CG2 4.35Å; F268-T324 HydrophobicContact CG-CG2 3.87Å; L269-T324 PolarHBondContact O-N 2.86Å; N270-T324 CarbonylContact C-O 3.6Å; N270-T324 VanDerWaalsContact CA-O 3.31Å; N270-T324 WeakPolarHBondContact CA-O 3.47Å; N270-T324 WeakPolarHBondContact CA-OG1 3.32Å; N270-T324 VanDerWaalsContact CB-OG1 3.31Å; N270-T324 WeakPolarHBondContact CB-OG1 3.33Å; N270-T324 PolarHBondContact OD1-O 3.43Å; N270-T324 PolarHBondContact OD1-OG1 3.19Å; K271-T324 PolarHBondContact N-O 3.19Å; K271-T324 VanDerWaalsContact N-O 3.1Å; K272-T324 WeakPolarHBondContact CG-O 3.43Å; K272-T324 PolarHBondContact N-O 3.11Å; H322-T324 HydrophobicContact CB-CG2 4.3Å; T324-N331 VanDerWaalsContact CA-OD1 3.24Å; T324-N331 WeakPolarHBondContact CA-OD1 3.37Å; T324-I332 HydrophobicContact CG2-CD1 4.21Å; T324-V335 HydrophobicContact CG2-CB 4.41Å; T324-V335 HydrophobicContact CG2-CG1 3.94Å; T324-V335 HydrophobicContact CG2-CG2 4.14Å
325	C	96.9	Very high	92.7	Very high	8 Å²	8	47.3 Å²	47.3	5%	0.054	27%	0.266	C	S	.	.			trans	-122	99.6	159.9	176.2	0	0	0	0	106.4	K272 T327 D328 N331	K272-C325 HydrophobicContact CG-CB 4.26Å; C325-T327 PolarHBondContact O-N 3.3Å; C325-T327 PolarHBondContact SG-OG1 3.28Å; C325-D328 HydrophobicContact CB-CB 3.95Å; C325-D328 PolarHBondContact O-N 3.46Å; C325-N331 PolarHBondContact N-OD1 3.46Å
326	A	95.8	Very high	92.9	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.033	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-15.3	-176.9	0	0	0	0	0	114	T48 I49 Q52 N270	T48-A326 HydrophobicContact CG2-CB 3.67Å; T48-A326 VanDerWaalsContact CG2-O 3.28Å; T48-A326 WeakPolarHBondContact CG2-O 3.42Å; I49-A326 HydrophobicContact CG1-CB 4.14Å; Q52-A326 VanDerWaalsContact CG-O 3.32Å; Q52-A326 WeakPolarHBondContact CG-O 3.45Å; Q52-A326 PolarHBondContact NE2-O 3.2Å; N270-A326 WeakPolarHBondContact OD1-CB 3.07Å; N270-A326 PolarHBondContact OD1-N 3.49Å
327	T	95.2	Very high	93.1	Very high	25 Å²	25	37 Å²	37	15%	0.153	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-9.8	174.1	64.7	0	0	0	0	113.8	T48 Q173 R177 C325	T48-T327 HydrophobicContact CG2-CG2 4.36Å; Q173-T327 PolarHBondContact NE2-O 3.21Å; R177-T327 HydrophobicContact CG-CG2 4.06Å; R177-T327 PolarHBondContact NH2-OG1 2.92Å; C325-T327 PolarHBondContact O-N 3.3Å; C325-T327 PolarHBondContact SG-OG1 3.28Å
328	D	96.3	Very high	92.9	Very high	77 Å²	77	38 Å²	38	41%	0.412	22%	0.215	S	C	.	.			trans	-97.9	104.9	175.5	178.1	-10.6	0	0	0	109.8	C325 G330 N331 I332	C325-D328 HydrophobicContact CB-CB 3.95Å; C325-D328 PolarHBondContact O-N 3.46Å; D328-G330 VanDerWaalsContact C-N 3.32Å; D328-G330 PolarHBondContact O-N 3.22Å; D328-G330 PolarHBondContact OD1-N 3.09Å; D328-N331 HydrophobicContact CB-CB 3.91Å; D328-N331 PolarHBondContact O-N 3.3Å; D328-N331 PolarHBondContact OD1-N 2.95Å; D328-N331 WeakPolarHBondContact OD2-CB 3.43Å; D328-I332 PolarHBondContact O-N 3.31Å
329	T	94.8	Very high	93	Very high	37 Å²	37	33.3 Å²	33.3	23%	0.227	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-39	-178.6	-57.5	0	0	0	0	112.3	Q52 I55 I56 I332 Q333	Q52-T329 PolarHBondContact NE2-OG1 3.47Å; Q52-T329 PolarHBondContact OE1-OG1 3.41Å; I55-T329 HydrophobicContact CG2-CG2 4.04Å; I56-T329 HydrophobicContact CD1-CG2 4.21Å; I56-T329 HydrophobicContact CG1-CG2 3.8Å; T329-I332 PolarHBondContact O-N 3.11Å; T329-Q333 WeakPolarHBondContact O-CB 3.29Å; T329-Q333 PolarHBondContact O-N 3.23Å
330	G	93.9	Very high	92.7	Very high	38 Å²	38	32 Å²	32	39%	0.392	19%	0.187	S	C	.	.	H	α-helix	trans	-67.1	-41.1	179.1	0	0	0	0	0	111.7	D328 Q333 V334	D328-G330 VanDerWaalsContact C-N 3.32Å; D328-G330 PolarHBondContact O-N 3.22Å; D328-G330 PolarHBondContact OD1-N 3.09Å; G330-Q333 PolarHBondContact O-N 2.71Å; G330-V334 WeakPolarHBondContact O-CG2 3.34Å; G330-V334 PolarHBondContact O-N 3.49Å
331	N	93.4	Very high	92.3	Very high	26 Å²	26	34 Å²	34	14%	0.139	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-43.2	175	176.9	-123	0	0	0	112.5	K272 T324 C325 D328 V335	K272-N331 PolarHBondContact NZ-ND2 3.35Å; T324-N331 VanDerWaalsContact CA-OD1 3.24Å; T324-N331 WeakPolarHBondContact CA-OD1 3.37Å; C325-N331 PolarHBondContact N-OD1 3.46Å; D328-N331 HydrophobicContact CB-CB 3.91Å; D328-N331 PolarHBondContact O-N 3.3Å; D328-N331 PolarHBondContact OD1-N 2.95Å; D328-N331 WeakPolarHBondContact OD2-CB 3.43Å; N331-V335 WeakPolarHBondContact O-CB 3.5Å; N331-V335 VanDerWaalsContact O-CG2 3.26Å; N331-V335 WeakPolarHBondContact O-CG2 3.5Å; N331-V335 PolarHBondContact O-N 3.47Å; N331-V335 VanDerWaalsContact O-N 3.12Å
332	I	94.1	Very high	91.6	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-68	-38.3	179	-67.3	-58.7	0	0	0	111.9	Q52 M53 I56 T324 D328 T329 V335 F336	Q52-I332 HydrophobicContact CB-CB 4.44Å; Q52-I332 HydrophobicContact CB-CG2 3.82Å; Q52-I332 HydrophobicContact CG-CB 4.36Å; Q52-I332 HydrophobicContact CG-CG1 4.21Å; Q52-I332 HydrophobicContact CG-CG2 4.23Å; M53-I332 HydrophobicContact CE-CG2 3.76Å; I56-I332 HydrophobicContact CD1-CB 4.3Å; I56-I332 HydrophobicContact CD1-CG2 3.87Å; T324-I332 HydrophobicContact CG2-CD1 4.21Å; D328-I332 PolarHBondContact O-N 3.31Å; T329-I332 PolarHBondContact O-N 3.11Å; I332-V335 PolarHBondContact O-N 3.22Å; I332-F336 VanDerWaalsContact O-CB 3.28Å; I332-F336 WeakPolarHBondContact O-CB 3.44Å; I332-F336 PolarHBondContact O-N 3.48Å
333	Q	92.3	Very high	91	Very high	92 Å²	92	32.8 Å²	32.8	43%	0.43	19%	0.193	S	C	.	.	H	α-helix	trans	-58.9	-51.1	176.2	-173.2	174.7	-0.1	0	0	111.6	I56 T329 G330 V335 F336 D337	I56-Q333 HydrophobicContact CD1-CB 4.11Å; I56-Q333 HydrophobicContact CG2-CB 4.39Å; I56-Q333 HydrophobicContact CG2-CG 4.02Å; T329-Q333 WeakPolarHBondContact O-CB 3.29Å; T329-Q333 PolarHBondContact O-N 3.23Å; G330-Q333 PolarHBondContact O-N 2.71Å; Q333-V335 VanDerWaalsContact C-N 3.32Å; Q333-V335 PolarHBondContact O-N 3.38Å; Q333-F336 PolarHBondContact O-N 2.85Å; Q333-D337 VanDerWaalsContact O-CG 3.24Å; Q333-D337 PolarHBondContact O-N 3.03Å
334	V	89.8	Confident	90.2	Very high	102 Å²	102	32.3 Å²	32.3	62%	0.618	19%	0.19	S	C	*	.	H	α-helix	trans	-60.8	-41	178.9	173.2	0	0	0	0	111.9	G330 A338	G330-V334 WeakPolarHBondContact O-CG2 3.34Å; G330-V334 PolarHBondContact O-N 3.49Å; V334-A338 PolarHBondContact O-N 3.39Å
335	V	89.2	Confident	89.2	Confident	10 Å²	10	34.1 Å²	34.1	6%	0.061	21%	0.205	C	C	.	.	H	α-helix	trans	-69.3	-40.9	179.7	170.5	0	0	0	0	111	F268 H322 T324 N331 I332 Q333 A338 V339	F268-V335 HydrophobicContact CD1-CG1 4.21Å; F268-V335 HydrophobicContact CE1-CG1 3.33Å; F268-V335 HydrophobicContact CE2-CG1 4.47Å; F268-V335 HydrophobicContact CZ-CG1 3.51Å; H322-V335 HydrophobicContact CB-CG1 3.73Å; H322-V335 HydrophobicContact CB-CG2 4.28Å; T324-V335 HydrophobicContact CG2-CB 4.41Å; T324-V335 HydrophobicContact CG2-CG1 3.94Å; T324-V335 HydrophobicContact CG2-CG2 4.14Å; N331-V335 WeakPolarHBondContact O-CB 3.5Å; N331-V335 VanDerWaalsContact O-CG2 3.26Å; N331-V335 WeakPolarHBondContact O-CG2 3.5Å; N331-V335 PolarHBondContact O-N 3.47Å; N331-V335 VanDerWaalsContact O-N 3.12Å; I332-V335 PolarHBondContact O-N 3.22Å; Q333-V335 VanDerWaalsContact C-N 3.32Å; Q333-V335 PolarHBondContact O-N 3.38Å; V335-A338 PolarHBondContact O-N 2.73Å; V335-V339 HydrophobicContact CG1-CG2 4.43Å; V335-V339 WeakPolarHBondContact O-CB 3.26Å; V335-V339 VanDerWaalsContact O-CG2 3.28Å; V335-V339 WeakPolarHBondContact O-CG2 3.47Å; V335-V339 PolarHBondContact O-N 2.81Å
336	F	88.6	Confident	88.2	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.009	21%	0.211	C	C	.	.	H	α-helix	trans	-69.7	-33.9	179.8	-160.6	-94.2	0	0	0	112.4	L36 M53 H57 F190 F192 F197 I223 I332 Q333 V339 T340	L36-F336 HydrophobicContact CD1-CE2 4.07Å; L36-F336 HydrophobicContact CD1-CZ 4Å; M53-F336 HydrophobicContact CE-CB 4.46Å; M53-F336 HydrophobicContact CE-CD2 3.85Å; M53-F336 HydrophobicContact CE-CE2 4.33Å; M53-F336 HydrophobicContact CE-CG 4.08Å; M53-F336 HydrophobicContact SD-CD1 4.3Å; M53-F336 HydrophobicContact SD-CD2 3.79Å; M53-F336 HydrophobicContact SD-CE1 4.22Å; M53-F336 HydrophobicContact SD-CE2 3.68Å; M53-F336 HydrophobicContact SD-CG 4.11Å; M53-F336 HydrophobicContact SD-CZ 3.93Å; H57-F336 AromaticContact NE2-CD1 3.49Å; H57-F336 WeakPolarHBondContact NE2-CD1 3.26Å; H57-F336 AromaticContact NE2-CE1 3.83Å; F190-F336 AromaticContact CE2-CE1 3.74Å; F190-F336 HydrophobicContact CE2-CE1 3.74Å; F190-F336 AromaticContact CE2-CZ 3.78Å; F190-F336 HydrophobicContact CE2-CZ 3.78Å; F190-F336 HydrophobicContact CZ-CE1 4.01Å; F190-F336 HydrophobicContact CZ-CE2 4.34Å; F190-F336 AromaticContact CZ-CZ 3.55Å; F190-F336 HydrophobicContact CZ-CZ 3.55Å; F192-F336 HydrophobicContact CD1-CD1 4.28Å; F192-F336 HydrophobicContact CD1-CE1 4.14Å; F192-F336 HydrophobicContact CE1-CD1 4.46Å; F197-F336 HydrophobicContact CD1-CZ 4.18Å; F197-F336 HydrophobicContact CE1-CE1 4.4Å; F197-F336 HydrophobicContact CE1-CZ 4.07Å; F197-F336 HydrophobicContact CZ-CE1 4.38Å; F197-F336 HydrophobicContact CZ-CZ 4.5Å; I223-F336 HydrophobicContact CD1-CE2 4.43Å; I332-F336 VanDerWaalsContact O-CB 3.28Å; I332-F336 WeakPolarHBondContact O-CB 3.44Å; I332-F336 PolarHBondContact O-N 3.48Å; Q333-F336 PolarHBondContact O-N 2.85Å; F336-V339 PolarHBondContact O-N 3.21Å; F336-T340 WeakPolarHBondContact CE1-OG1 3.28Å; F336-T340 WeakPolarHBondContact O-CB 3.43Å; F336-T340 PolarHBondContact O-N 3.46Å; F336-T340 PolarHBondContact O-OG1 2.93Å
337	D	88.9	Confident	86.9	Confident	47 Å²	47	37.8 Å²	37.8	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-59.1	-48.7	171.5	-73.4	-17.6	0	0	0	111.3	F192 Q333 T340 D341	F192-D337 WeakPolarHBondContact CZ-OD1 3.39Å; Q333-D337 VanDerWaalsContact O-CG 3.24Å; Q333-D337 PolarHBondContact O-N 3.03Å; D337-T340 PolarHBondContact O-N 2.76Å; D337-D341 PolarHBondContact O-N 3Å; D337-D341 VanDerWaalsContact O-N 3.08Å
338	A	85.4	Confident	85.6	Confident	36 Å²	36	39.8 Å²	39.8	30%	0.298	23%	0.233	S	C	.	.	H	α-helix	trans	-63.9	-42.1	178.2	0	0	0	0	0	112.2	V334 V335 T340 D341 I342	V334-A338 PolarHBondContact O-N 3.39Å; V335-A338 PolarHBondContact O-N 2.73Å; A338-T340 VanDerWaalsContact C-N 3.32Å; A338-T340 PolarHBondContact O-N 3.28Å; A338-D341 PolarHBondContact O-N 3.36Å; A338-I342 WeakPolarHBondContact O-CD1 3.49Å; A338-I342 WeakPolarHBondContact O-CG1 3.42Å; A338-I342 PolarHBondContact O-N 2.94Å; A338-I342 VanDerWaalsContact O-N 3.15Å
339	V	86	Confident	84.2	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60	-43.2	174.7	161.1	0	0	0	0	111.3	I266 F268 V335 F336 D341 I342 I343	I266-V339 HydrophobicContact CB-CG2 4.48Å; I266-V339 HydrophobicContact CD1-CB 4.39Å; I266-V339 HydrophobicContact CD1-CG1 3.44Å; I266-V339 VanDerWaalsContact CD1-CG1 3.44Å; I266-V339 HydrophobicContact CD1-CG2 4.23Å; I266-V339 HydrophobicContact CG1-CG1 4.26Å; I266-V339 HydrophobicContact CG1-CG2 4.18Å; I266-V339 HydrophobicContact CG2-CG2 3.54Å; F268-V339 HydrophobicContact CE1-CG2 4.04Å; F268-V339 HydrophobicContact CZ-CG2 4.25Å; V335-V339 HydrophobicContact CG1-CG2 4.43Å; V335-V339 WeakPolarHBondContact O-CB 3.26Å; V335-V339 VanDerWaalsContact O-CG2 3.28Å; V335-V339 WeakPolarHBondContact O-CG2 3.47Å; V335-V339 PolarHBondContact O-N 2.81Å; F336-V339 PolarHBondContact O-N 3.21Å; V339-D341 VanDerWaalsContact C-N 3.35Å; V339-D341 PolarHBondContact O-N 3.44Å; V339-I342 PolarHBondContact O-N 3.19Å; V339-I343 HydrophobicContact CG1-CD1 3.62Å; V339-I343 HydrophobicContact CG1-CG1 4.47Å; V339-I343 WeakPolarHBondContact O-CD1 3.31Å; V339-I343 VanDerWaalsContact O-CG1 3.3Å; V339-I343 WeakPolarHBondContact O-CG1 3.41Å; V339-I343 PolarHBondContact O-N 3.05Å
340	T	86.6	Confident	82.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.5	-41.8	179.2	-61.7	0	0	0	0	111.4	F192 K193 L195 F197 F336 D337 A338 I342 I343 I344	F192-T340 HydrophobicContact CD1-CG2 3.89Å; F192-T340 HydrophobicContact CE1-CG2 3.9Å; K193-T340 HydrophobicContact CD-CG2 3.91Å; L195-T340 HydrophobicContact CD1-CG2 4.44Å; F197-T340 HydrophobicContact CZ-CG2 3.94Å; F336-T340 WeakPolarHBondContact CE1-OG1 3.28Å; F336-T340 WeakPolarHBondContact O-CB 3.43Å; F336-T340 PolarHBondContact O-N 3.46Å; F336-T340 PolarHBondContact O-OG1 2.93Å; D337-T340 PolarHBondContact O-N 2.76Å; A338-T340 VanDerWaalsContact C-N 3.32Å; A338-T340 PolarHBondContact O-N 3.28Å; T340-I342 VanDerWaalsContact C-N 3.31Å; T340-I342 PolarHBondContact O-N 3.23Å; T340-I343 PolarHBondContact O-N 2.87Å; T340-I344 HydrophobicContact CG2-CD1 3.71Å; T340-I344 HydrophobicContact CG2-CG1 4.34Å; T340-I344 WeakPolarHBondContact O-CB 3.22Å; T340-I344 VanDerWaalsContact O-CG1 3.27Å; T340-I344 WeakPolarHBondContact O-CG1 3.4Å; T340-I344 PolarHBondContact O-N 3.44Å
341	D	84.4	Confident	81	Confident	83 Å²	83	47.1 Å²	47.1	44%	0.444	27%	0.274	S	S	.	.	H	α-helix	trans	-64.5	-37.1	178.6	-67.9	-21.6	0	0	0	111.9	K193 D337 A338 V339 A345	K193-D341 IonicContact NZ-OD1 2.8Å; K193-D341 PolarHBondContact NZ-OD1 3.1Å; K193-D341 IonicContact NZ-OD2 3.55Å; K193-D341 PolarHBondContact NZ-OD2 2.91Å; D337-D341 PolarHBondContact O-N 3Å; D337-D341 VanDerWaalsContact O-N 3.08Å; A338-D341 PolarHBondContact O-N 3.36Å; V339-D341 VanDerWaalsContact C-N 3.35Å; V339-D341 PolarHBondContact O-N 3.44Å; D341-A345 WeakPolarHBondContact O-CB 3.47Å; D341-A345 PolarHBondContact O-N 3.19Å
342	I	81.8	Confident	78.9	Confident	35 Å²	35	49 Å²	49	18%	0.179	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-46.9	173.7	-68.3	162.2	0	0	0	111.1	Y320 A338 V339 T340 I344 A345 N346	Y320-I342 HydrophobicContact CD1-CD1 3.72Å; Y320-I342 HydrophobicContact CD1-CG1 4.42Å; Y320-I342 HydrophobicContact CD1-CG2 4.3Å; Y320-I342 HydrophobicContact CD2-CD1 4.41Å; Y320-I342 HydrophobicContact CD2-CG2 3.78Å; Y320-I342 HydrophobicContact CE1-CD1 4.2Å; Y320-I342 HydrophobicContact CE1-CG1 4.41Å; Y320-I342 HydrophobicContact CE1-CG2 3.92Å; Y320-I342 HydrophobicContact CE2-CG2 3.32Å; Y320-I342 HydrophobicContact CG-CD1 3.82Å; Y320-I342 HydrophobicContact CG-CG2 4.21Å; A338-I342 WeakPolarHBondContact O-CD1 3.49Å; A338-I342 WeakPolarHBondContact O-CG1 3.42Å; A338-I342 PolarHBondContact O-N 2.94Å; A338-I342 VanDerWaalsContact O-N 3.15Å; V339-I342 PolarHBondContact O-N 3.19Å; T340-I342 VanDerWaalsContact C-N 3.31Å; T340-I342 PolarHBondContact O-N 3.23Å; I342-I344 VanDerWaalsContact C-N 3.33Å; I342-I344 PolarHBondContact O-N 3.19Å; I342-A345 PolarHBondContact O-N 3.15Å; I342-N346 PolarHBondContact O-N 2.85Å
343	I	82.6	Confident	76.8	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-44.2	178.9	-68.5	159.4	0	0	0	110.5	V34 L36 F197 T220 A221 I266 V339 T340 N346 N347	V34-I343 HydrophobicContact CG1-CD1 4.45Å; V34-I343 HydrophobicContact CG1-CG2 3.84Å; V34-I343 HydrophobicContact CG2-CG2 4.16Å; L36-I343 HydrophobicContact CD1-CD1 4.49Å; L36-I343 HydrophobicContact CD2-CD1 3.73Å; F197-I343 HydrophobicContact CE1-CD1 4.43Å; T220-I343 HydrophobicContact CG2-CG2 3.86Å; A221-I343 HydrophobicContact CB-CD1 4.45Å; A221-I343 HydrophobicContact CB-CG1 4.2Å; I266-I343 HydrophobicContact CD1-CD1 4.36Å; V339-I343 HydrophobicContact CG1-CD1 3.62Å; V339-I343 HydrophobicContact CG1-CG1 4.47Å; V339-I343 WeakPolarHBondContact O-CD1 3.31Å; V339-I343 VanDerWaalsContact O-CG1 3.3Å; V339-I343 WeakPolarHBondContact O-CG1 3.41Å; V339-I343 PolarHBondContact O-N 3.05Å; T340-I343 PolarHBondContact O-N 2.87Å; I343-N346 PolarHBondContact O-N 3.31Å; I343-N347 WeakPolarHBondContact O-CB 3.37Å; I343-N347 PolarHBondContact O-N 2.84Å
344	I	80.3	Confident	74.3	Confident	49 Å²	49	62.2 Å²	62.2	25%	0.251	36%	0.355	S	S	.	.	H	α-helix	trans	-59.8	-48.4	176.1	-71.7	165.8	0	0	0	110.3	K193 L195 T340 I342 N346 N347 L348	K193-I344 HydrophobicContact CD-CD1 4.48Å; L195-I344 HydrophobicContact CD1-CD1 3.88Å; L195-I344 HydrophobicContact CD1-CG1 3.55Å; T340-I344 HydrophobicContact CG2-CD1 3.71Å; T340-I344 HydrophobicContact CG2-CG1 4.34Å; T340-I344 WeakPolarHBondContact O-CB 3.22Å; T340-I344 VanDerWaalsContact O-CG1 3.27Å; T340-I344 WeakPolarHBondContact O-CG1 3.4Å; T340-I344 PolarHBondContact O-N 3.44Å; I342-I344 VanDerWaalsContact C-N 3.33Å; I342-I344 PolarHBondContact O-N 3.19Å; I344-N346 VanDerWaalsContact C-N 3.32Å; I344-N346 PolarHBondContact O-N 3.5Å; I344-N347 PolarHBondContact O-N 3.47Å; I344-L348 HydrophobicContact CG2-CD1 3.76Å; I344-L348 HydrophobicContact CG2-CG 4.29Å; I344-L348 WeakPolarHBondContact O-CB 3.38Å; I344-L348 VanDerWaalsContact O-CG 3.26Å; I344-L348 WeakPolarHBondContact O-CG 3.47Å; I344-L348 PolarHBondContact O-N 3.3Å
345	A	77.3	Confident	73.5	Confident	38 Å²	38	60.2 Å²	60.2	31%	0.314	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-42.1	179.8	0	0	0	0	0	112.1	D341 I342 L348 R349	D341-A345 WeakPolarHBondContact O-CB 3.47Å; D341-A345 PolarHBondContact O-N 3.19Å; I342-A345 PolarHBondContact O-N 3.15Å; A345-L348 PolarHBondContact O-N 3.3Å; A345-R349 WeakPolarHBondContact O-CG 3.38Å; A345-R349 PolarHBondContact O-N 3.13Å; A345-R349 VanDerWaalsContact O-N 3.11Å
346	N	74.7	Confident	72.7	Confident	35 Å²	35	62.8 Å²	62.8	19%	0.187	36%	0.357	C	S	.	.	H	α-helix	trans	-71.1	-40.6	179.2	-73.9	-12.4	0	0	0	112.4	S264 Y320 I342 I343 I344 L348 R349 G350	S264-N346 PolarHBondContact OG-ND2 3.06Å; Y320-N346 PolarHBondContact OH-ND2 3.19Å; I342-N346 PolarHBondContact O-N 2.85Å; I343-N346 PolarHBondContact O-N 3.31Å; I344-N346 VanDerWaalsContact C-N 3.32Å; I344-N346 PolarHBondContact O-N 3.5Å; N346-L348 VanDerWaalsContact C-N 3.35Å; N346-L348 PolarHBondContact O-N 3.01Å; N346-R349 PolarHBondContact O-N 3.37Å; N346-G350 PolarHBondContact O-N 3.39Å
347	N	70.2	Confident	71.8	Confident	53 Å²	53	66.2 Å²	66.2	28%	0.283	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-41.9	173.9	-79.4	-10.6	0	0	0	111.7	T220 I343 I344 R349 G350 C351	T220-N347 WeakPolarHBondContact CG2-OD1 3.42Å; I343-N347 WeakPolarHBondContact O-CB 3.37Å; I343-N347 PolarHBondContact O-N 2.84Å; I344-N347 PolarHBondContact O-N 3.47Å; N347-R349 PolarHBondContact O-N 3.48Å; N347-G350 PolarHBondContact O-N 2.96Å; N347-C351 PolarHBondContact O-N 3.36Å; N347-C351 PolarHBondContact O-SG 3.44Å; N347-C351 VanDerWaalsContact O-SG 3.37Å
348	L	67.3	Low	70.8	Confident	67 Å²	67	67.4 Å²	67.4	35%	0.351	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-39.6	177.3	-72	172.5	0	0	0	112.6	I344 A345 N346 C351 G352 L353	I344-L348 HydrophobicContact CG2-CD1 3.76Å; I344-L348 HydrophobicContact CG2-CG 4.29Å; I344-L348 WeakPolarHBondContact O-CB 3.38Å; I344-L348 VanDerWaalsContact O-CG 3.26Å; I344-L348 WeakPolarHBondContact O-CG 3.47Å; I344-L348 PolarHBondContact O-N 3.3Å; A345-L348 PolarHBondContact O-N 3.3Å; N346-L348 VanDerWaalsContact C-N 3.35Å; N346-L348 PolarHBondContact O-N 3.01Å; L348-C351 PolarHBondContact O-N 2.74Å; L348-G352 PolarHBondContact O-N 2.95Å; L348-L353 HydrophobicContact CD2-CB 4.43Å; L348-L353 HydrophobicContact CD2-CD1 3.98Å; L348-L353 PolarHBondContact O-N 3.46Å; L348-L353 VanDerWaalsContact O-N 3.09Å
349	R	67.3	Low	69.9	Low	145 Å²	145	69.3 Å²	69.3	55%	0.547	39%	0.389	S	S	.	.	H	α-helix	trans	-63.1	-43.7	171.7	-71.7	-176.2	-148.6	164.9	8.3	111.5	A345 N346 N347 C351 G352	A345-R349 WeakPolarHBondContact O-CG 3.38Å; A345-R349 PolarHBondContact O-N 3.13Å; A345-R349 VanDerWaalsContact O-N 3.11Å; N346-R349 PolarHBondContact O-N 3.37Å; N347-R349 PolarHBondContact O-N 3.48Å; R349-C351 PolarHBondContact O-N 3.33Å; R349-G352 PolarHBondContact O-N 2.88Å
350	G	63.1	Low	68.8	Low	72 Å²	72	73.9 Å²	73.9	74%	0.742	42%	0.415	S	S	*	.	H	α-helix	trans	-60.5	-30.6	177.9	0	0	0	0	0	113.6	N346 N347 G352	N346-G350 PolarHBondContact O-N 3.39Å; N347-G350 PolarHBondContact O-N 2.96Å; G350-G352 VanDerWaalsContact C-N 3.35Å
351	C	57.4	Low	67.5	Low	90 Å²	90	79.2 Å²	79.2	61%	0.608	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	0.5	174.8	-63.9	0	0	0	0	114.5	N347 L348 R349 L353	N347-C351 PolarHBondContact O-N 3.36Å; N347-C351 PolarHBondContact O-SG 3.44Å; N347-C351 VanDerWaalsContact O-SG 3.37Å; L348-C351 PolarHBondContact O-N 2.74Å; R349-C351 PolarHBondContact O-N 3.33Å; C351-L353 VanDerWaalsContact C-N 3.33Å; C351-L353 HydrophobicContact CB-CD1 4.06Å; C351-L353 HydrophobicContact CB-CG 4.3Å; C351-L353 PolarHBondContact O-N 3.31Å
352	G	49.5	Very low	66.2	Low	64 Å²	64	78.9 Å²	78.9	66%	0.66	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	24.5	-178.8	0	0	0	0	0	114.4	L348 R349 G350	L348-G352 PolarHBondContact O-N 2.95Å; R349-G352 PolarHBondContact O-N 2.88Å; G350-G352 VanDerWaalsContact C-N 3.35Å
353	L	49.2	Very low	64.9	Low	124 Å²	124	82.6 Å²	82.6	65%	0.649	47%	0.466	S	S	*	.			trans	-95.5	9.3	-179	-70.1	167.5	0	0	0	113.4	L348 C351	L348-L353 HydrophobicContact CD2-CB 4.43Å; L348-L353 HydrophobicContact CD2-CD1 3.98Å; L348-L353 PolarHBondContact O-N 3.46Å; L348-L353 VanDerWaalsContact O-N 3.09Å; C351-L353 VanDerWaalsContact C-N 3.33Å; C351-L353 HydrophobicContact CB-CD1 4.06Å; C351-L353 HydrophobicContact CB-CG 4.3Å; C351-L353 PolarHBondContact O-N 3.31Å
354	Y	39.7	Very low	63.3	Low	248 Å²	248	89.5 Å²	89.5	97%	0.973	51%	0.506	S	S	*	.			trans	-143.4	0	178.4	-124.9	-87.5	0	0	0	112.8

Retrieved 354 of 354 residues in 3005.3 ms (Link to these results)

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