A0A096LXM3_POEFO Loading...

Hexosyltransferase

N-acetyl glucosamine (GlcNAc) transferase that catalyzes the transfer of GlcNAc via a beta1->3 linkage from UDP-GlcNAc to the non-reducing terminal galactose (Gal) in the linearly growing chain of N- and O-linked keratan sulfate proteoglycans. Cooperates with B4GALT4 galactosyltransferase and CHST6 and CHST1 sulfotransferases to construct and elongate mono- and disulfated disaccharide units [->3Galbeta1->4(6-sulfoGlcNAcbeta)1->] and [->3(6-sulfoGalbeta)1->4(6-sulfoGlcNAcbeta)1->] within keratan sulfate polymer. Involved in biosynthesis of N-linked keratan sulfate proteoglycans in cornea, with an impact on proteoglycan fibril organization and corneal transparency. May play a role in the maintenance of tissue architecture by suppressing cellular motility and invasion.

AlphaFold DB , UniProt , Accession A0A096LXM3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 417 aa.

Structure Viewer

Loading PAE data...

(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	58	Low	73	Confident	184 Å²	184	134.3 Å²	134.3	91%	0.906	59%	0.594	S	S	*	*				0	121.1	0	-109.8	156.2	65.7	0	0	108.8	R6	M1-R6 HydrophobicContact CE-CG 4.12Å
2	N	73.1	Confident	73.9	Confident	117 Å²	117	138.8 Å²	138.8	63%	0.626	60%	0.604	S	S	*	*			trans	-70.9	152.1	-176.5	-159	-9.6	0	0	0	110.2	R4 D5 R6	N2-R4 PolarHBondContact O-N 2.95Å; N2-D5 WeakPolarHBondContact O-CB 3.34Å; N2-D5 PolarHBondContact O-N 3.31Å; N2-R6 PolarHBondContact O-N 3.48Å
3	N	67	Low	74.7	Confident	122 Å²	122	133.7 Å²	133.7	65%	0.652	59%	0.592	S	S	*	*	H	α-helix	trans	-55.4	-29.7	-177.1	-102.8	-11.1	0	0	0	112.5	W7	N3-W7 PolarHBondContact O-N 3.29Å; N3-W7 VanDerWaalsContact O-N 3.12Å
4	R	72.6	Confident	75.3	Confident	183 Å²	183	128.1 Å²	128.1	69%	0.691	58%	0.576	S	S	*	*	H	α-helix	trans	-69	-29.5	176.8	-157.8	169.9	170.9	178.5	-6.1	113.3	N2 R8	N2-R4 PolarHBondContact O-N 2.95Å; R4-R8 WeakPolarHBondContact O-CG 2.97Å; R4-R8 PolarHBondContact O-N 3.07Å
5	D	70.8	Confident	76	Confident	65 Å²	65	122.9 Å²	122.9	35%	0.348	57%	0.565	S	S	.	*	H	α-helix	trans	-80.9	-38.6	177.1	-60.5	-39.6	0	0	0	111.4	N2 W7 R8 V9	N2-D5 WeakPolarHBondContact O-CB 3.34Å; N2-D5 PolarHBondContact O-N 3.31Å; D5-W7 VanDerWaalsContact C-N 3.28Å; D5-W7 PolarHBondContact O-N 3.38Å; D5-R8 PolarHBondContact O-N 3.01Å; D5-V9 WeakPolarHBondContact O-CG2 3.37Å; D5-V9 PolarHBondContact O-N 3.17Å
6	R	74	Confident	76.6	Confident	159 Å²	159	123.4 Å²	123.4	60%	0.6	57%	0.57	S	S	*	*	H	α-helix	trans	-58.9	-41	171.5	-73.4	177.2	67.5	-179.3	1.6	111.5	M1 N2 V9 Y10	M1-R6 HydrophobicContact CE-CG 4.12Å; N2-R6 PolarHBondContact O-N 3.48Å; R6-V9 PolarHBondContact O-N 2.04Å; R6-Y10 WeakPolarHBondContact O-CB 2.98Å; R6-Y10 PolarHBondContact O-N 3.13Å
7	W	71.1	Confident	77.1	Confident	159 Å²	159	124.8 Å²	124.8	60%	0.602	57%	0.574	S	S	*	*	H	α-helix	trans	-66.3	-36.9	176.5	-170.2	-108.8	0	0	0	113.2	N3 D5 K11	N3-W7 PolarHBondContact O-N 3.29Å; N3-W7 VanDerWaalsContact O-N 3.12Å; D5-W7 VanDerWaalsContact C-N 3.28Å; D5-W7 PolarHBondContact O-N 3.38Å; W7-K11 WeakPolarHBondContact O-CB 3.26Å; W7-K11 PolarHBondContact O-N 3.5Å
8	R	74.6	Confident	77.6	Confident	136 Å²	136	126 Å²	126	51%	0.513	58%	0.578	S	S	.	*	H	α-helix	trans	-66.7	-42.3	173.8	-76.2	-176	-154.2	179.2	7.5	112	R4 D5 K11 R12	R4-R8 WeakPolarHBondContact O-CG 2.97Å; R4-R8 PolarHBondContact O-N 3.07Å; D5-R8 PolarHBondContact O-N 3.01Å; R8-K11 PolarHBondContact O-N 3.49Å; R8-R12 WeakPolarHBondContact O-CG 3.45Å; R8-R12 PolarHBondContact O-N 2.89Å
9	V	80.2	Confident	78	Confident	77 Å²	77	125.1 Å²	125.1	47%	0.467	58%	0.578	S	S	.	*	H	α-helix	trans	-63.7	-45.5	176.6	174.6	0	0	0	0	109.8	D5 R6 K11 R12 V13	D5-V9 WeakPolarHBondContact O-CG2 3.37Å; D5-V9 PolarHBondContact O-N 3.17Å; R6-V9 PolarHBondContact O-N 2.04Å; V9-K11 PolarHBondContact O-N 3.34Å; V9-R12 PolarHBondContact O-N 2.79Å; V9-R12 VanDerWaalsContact O-N 3.17Å; V9-V13 HydrophobicContact CG1-CG2 4.23Å; V9-V13 VanDerWaalsContact O-CG2 3.31Å; V9-V13 WeakPolarHBondContact O-CG2 3.24Å; V9-V13 PolarHBondContact O-N 3.32Å
10	Y	83	Confident	78.3	Confident	145 Å²	145	121.3 Å²	121.3	57%	0.569	57%	0.569	S	S	*	*	H	α-helix	trans	-60	-46.2	177.2	-168.6	-99.1	0	0	0	112.2	R6 R12 V13 C14	R6-Y10 WeakPolarHBondContact O-CB 2.98Å; R6-Y10 PolarHBondContact O-N 3.13Å; Y10-R12 VanDerWaalsContact C-N 3.33Å; Y10-R12 PolarHBondContact O-N 2.76Å; Y10-V13 PolarHBondContact O-N 3.48Å; Y10-C14 VanDerWaalsContact CE1-SG 3.53Å; Y10-C14 WeakPolarHBondContact O-CB 3.47Å; Y10-C14 PolarHBondContact O-N 3.06Å; Y10-C14 PolarHBondContact O-SG 3.04Å; Y10-C14 VanDerWaalsContact O-SG 3.41Å
11	K	78.8	Confident	78.5	Confident	130 Å²	130	119.2 Å²	119.2	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-59.5	-40.8	174.4	-87.7	-171.4	172.9	-172.2	0	112.9	W7 R8 V9 A15	W7-K11 WeakPolarHBondContact O-CB 3.26Å; W7-K11 PolarHBondContact O-N 3.5Å; R8-K11 PolarHBondContact O-N 3.49Å; V9-K11 PolarHBondContact O-N 3.34Å; K11-A15 VanDerWaalsContact O-CB 3.29Å; K11-A15 WeakPolarHBondContact O-CB 3.4Å; K11-A15 PolarHBondContact O-N 3.16Å
12	R	83.8	Confident	79.5	Confident	188 Å²	188	113 Å²	113	71%	0.709	54%	0.536	S	S	*	.	H	α-helix	trans	-67.3	-42.8	177.5	-75	-179.6	177.3	-168.1	-1.3	111.6	R8 V9 Y10 A15 M16	R8-R12 WeakPolarHBondContact O-CG 3.45Å; R8-R12 PolarHBondContact O-N 2.89Å; V9-R12 PolarHBondContact O-N 2.79Å; V9-R12 VanDerWaalsContact O-N 3.17Å; Y10-R12 VanDerWaalsContact C-N 3.33Å; Y10-R12 PolarHBondContact O-N 2.76Å; R12-A15 PolarHBondContact O-N 3.24Å; R12-M16 WeakPolarHBondContact O-CB 3.46Å; R12-M16 WeakPolarHBondContact O-CG 3.4Å; R12-M16 PolarHBondContact O-N 2.88Å
13	V	84.3	Confident	79.7	Confident	73 Å²	73	109.9 Å²	109.9	44%	0.442	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-43.6	177.7	174	0	0	0	0	111.1	V9 Y10 M16 F17	V9-V13 HydrophobicContact CG1-CG2 4.23Å; V9-V13 VanDerWaalsContact O-CG2 3.31Å; V9-V13 WeakPolarHBondContact O-CG2 3.24Å; V9-V13 PolarHBondContact O-N 3.32Å; Y10-V13 PolarHBondContact O-N 3.48Å; V13-M16 PolarHBondContact O-N 3.21Å; V13-F17 HydrophobicContact CG1-CD2 4.26Å; V13-F17 PolarHBondContact O-N 3.18Å
14	C	82.6	Confident	79.9	Confident	56 Å²	56	109.1 Å²	109.1	38%	0.378	52%	0.523	S	S	.	.	H	α-helix	trans	-63.5	-40.8	174.9	-72.3	0	0	0	0	112.4	Y10 F17 F18	Y10-C14 VanDerWaalsContact CE1-SG 3.53Å; Y10-C14 WeakPolarHBondContact O-CB 3.47Å; Y10-C14 PolarHBondContact O-N 3.06Å; Y10-C14 PolarHBondContact O-SG 3.04Å; Y10-C14 VanDerWaalsContact O-SG 3.41Å; C14-F17 PolarHBondContact O-N 3.09Å; C14-F18 WeakPolarHBondContact O-CB 3.37Å; C14-F18 PolarHBondContact O-N 3.13Å
15	A	86.4	Confident	79.7	Confident	49 Å²	49	103.5 Å²	103.5	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-64.5	-40.6	175.9	0	0	0	0	0	111.9	K11 R12 F18 L19	K11-A15 VanDerWaalsContact O-CB 3.29Å; K11-A15 WeakPolarHBondContact O-CB 3.4Å; K11-A15 PolarHBondContact O-N 3.16Å; R12-A15 PolarHBondContact O-N 3.24Å; A15-F18 PolarHBondContact O-N 3.25Å; A15-L19 WeakPolarHBondContact O-CB 3.12Å; A15-L19 VanDerWaalsContact O-CG 3.29Å; A15-L19 WeakPolarHBondContact O-CG 3.44Å; A15-L19 PolarHBondContact O-N 3.19Å
16	M	85.8	Confident	79.6	Confident	131 Å²	131	105.6 Å²	105.6	65%	0.645	52%	0.519	S	S	*	.	H	α-helix	trans	-65.9	-41.5	175.7	-70.2	-65.6	-70.2	0	0	112	R12 V13 L19 A20	R12-M16 WeakPolarHBondContact O-CB 3.46Å; R12-M16 WeakPolarHBondContact O-CG 3.4Å; R12-M16 PolarHBondContact O-N 2.88Å; V13-M16 PolarHBondContact O-N 3.21Å; M16-L19 PolarHBondContact O-N 3.11Å; M16-A20 WeakPolarHBondContact O-CB 3.35Å; M16-A20 PolarHBondContact O-N 3.28Å
17	F	84.1	Confident	79.2	Confident	147 Å²	147	102.5 Å²	102.5	65%	0.645	52%	0.517	S	S	*	.	H	α-helix	trans	-63	-42.2	173.8	-108.3	-86.2	0	0	0	111.9	V13 C14 A20 V21	V13-F17 HydrophobicContact CG1-CD2 4.26Å; V13-F17 PolarHBondContact O-N 3.18Å; C14-F17 PolarHBondContact O-N 3.09Å; F17-A20 PolarHBondContact O-N 3.45Å; F17-V21 VanDerWaalsContact O-CG2 3.3Å; F17-V21 WeakPolarHBondContact O-CG2 3.39Å; F17-V21 PolarHBondContact O-N 3.47Å
18	F	86.1	Confident	78.2	Confident	147 Å²	147	100.9 Å²	100.9	65%	0.645	52%	0.516	S	S	*	.	H	α-helix	trans	-63.8	-44.4	177.1	-166.7	-93.9	0	0	0	111.4	C14 A15 A20 V21 V22	C14-F18 WeakPolarHBondContact O-CB 3.37Å; C14-F18 PolarHBondContact O-N 3.13Å; A15-F18 PolarHBondContact O-N 3.25Å; F18-A20 VanDerWaalsContact C-N 3.33Å; F18-A20 PolarHBondContact O-N 3.08Å; F18-V21 PolarHBondContact O-N 3.16Å; F18-V22 HydrophobicContact CD1-CG2 3.98Å; F18-V22 HydrophobicContact CE1-CG2 3.76Å; F18-V22 HydrophobicContact CZ-CG2 4.35Å; F18-V22 WeakPolarHBondContact O-CB 3.28Å; F18-V22 VanDerWaalsContact O-CG2 3.27Å; F18-V22 WeakPolarHBondContact O-CG2 3.43Å; F18-V22 PolarHBondContact O-N 2.95Å
19	L	86.3	Confident	77	Confident	109 Å²	109	104.1 Å²	104.1	57%	0.571	53%	0.529	S	S	*	.	H	α-helix	trans	-63.8	-37.1	175.1	-72.3	170.2	0	0	0	112.3	A15 M16 V22 A23	A15-L19 WeakPolarHBondContact O-CB 3.12Å; A15-L19 VanDerWaalsContact O-CG 3.29Å; A15-L19 WeakPolarHBondContact O-CG 3.44Å; A15-L19 PolarHBondContact O-N 3.19Å; M16-L19 PolarHBondContact O-N 3.11Å; L19-V22 PolarHBondContact O-N 3.12Å; L19-A23 WeakPolarHBondContact O-CB 3.27Å; L19-A23 PolarHBondContact O-N 3.05Å
20	A	82.8	Confident	74.9	Confident	48 Å²	48	102.9 Å²	102.9	40%	0.397	53%	0.531	S	S	.	.	H	α-helix	trans	-66.5	-41	175.3	0	0	0	0	0	112	M16 F17 F18 A23 L24	M16-A20 WeakPolarHBondContact O-CB 3.35Å; M16-A20 PolarHBondContact O-N 3.28Å; F17-A20 PolarHBondContact O-N 3.45Å; F18-A20 VanDerWaalsContact C-N 3.33Å; F18-A20 PolarHBondContact O-N 3.08Å; A20-A23 PolarHBondContact O-N 3.13Å; A20-L24 WeakPolarHBondContact O-CB 3.36Å; A20-L24 WeakPolarHBondContact O-CD1 3.05Å; A20-L24 WeakPolarHBondContact O-CG 3.42Å; A20-L24 PolarHBondContact O-N 3.4Å
21	V	82.7	Confident	72.7	Confident	78 Å²	78	100.6 Å²	100.6	47%	0.473	54%	0.537	S	S	.	.	H	α-helix	trans	-67	-39.6	175	171.8	0	0	0	0	111.2	F17 F18 L24 T25	F17-V21 VanDerWaalsContact O-CG2 3.3Å; F17-V21 WeakPolarHBondContact O-CG2 3.39Å; F17-V21 PolarHBondContact O-N 3.47Å; F18-V21 PolarHBondContact O-N 3.16Å; V21-L24 PolarHBondContact O-N 3.05Å; V21-T25 HydrophobicContact CG1-CG2 4.49Å; V21-T25 WeakPolarHBondContact O-CB 3.48Å; V21-T25 WeakPolarHBondContact O-CG2 3.15Å; V21-T25 PolarHBondContact O-N 3.5Å; V21-T25 PolarHBondContact O-OG1 3.17Å
22	V	80.8	Confident	70.8	Confident	53 Å²	53	100.5 Å²	100.5	32%	0.321	54%	0.541	S	S	.	.	H	α-helix	trans	-65.1	-42.6	174.1	171.9	0	0	0	0	110.9	F18 L19 T25 I26	F18-V22 HydrophobicContact CD1-CG2 3.98Å; F18-V22 HydrophobicContact CE1-CG2 3.76Å; F18-V22 HydrophobicContact CZ-CG2 4.35Å; F18-V22 WeakPolarHBondContact O-CB 3.28Å; F18-V22 VanDerWaalsContact O-CG2 3.27Å; F18-V22 WeakPolarHBondContact O-CG2 3.43Å; F18-V22 PolarHBondContact O-N 2.95Å; L19-V22 PolarHBondContact O-N 3.12Å; V22-T25 WeakPolarHBondContact CA-OG1 3.21Å; V22-T25 PolarHBondContact O-N 2.9Å; V22-T25 PolarHBondContact O-OG1 3.18Å; V22-I26 HydrophobicContact CG1-CD1 3.71Å; V22-I26 HydrophobicContact CG1-CG1 4.41Å; V22-I26 WeakPolarHBondContact O-CB 3.41Å; V22-I26 WeakPolarHBondContact O-CG1 3.45Å; V22-I26 PolarHBondContact O-N 2.89Å
23	A	77.1	Confident	68.2	Low	52 Å²	52	98.4 Å²	98.4	43%	0.43	54%	0.544	S	S	.	.	H	α-helix	trans	-64.1	-44.3	175.5	0	0	0	0	0	111.8	L19 A20 T25 I26 V27	L19-A23 WeakPolarHBondContact O-CB 3.27Å; L19-A23 PolarHBondContact O-N 3.05Å; A20-A23 PolarHBondContact O-N 3.13Å; A23-T25 PolarHBondContact O-N 3.22Å; A23-I26 PolarHBondContact O-N 3.36Å; A23-V27 WeakPolarHBondContact O-CB 3.48Å; A23-V27 VanDerWaalsContact O-CG2 3.24Å; A23-V27 WeakPolarHBondContact O-CG2 3.45Å; A23-V27 PolarHBondContact O-N 3.4Å
24	L	70.1	Confident	65.7	Low	107 Å²	107	103.9 Å²	103.9	56%	0.56	57%	0.567	S	S	*	*	H	α-helix	trans	-63.1	-39.5	176.2	-81.2	160.9	0	0	0	112.3	A20 V21 V27 Q28	A20-L24 WeakPolarHBondContact O-CB 3.36Å; A20-L24 WeakPolarHBondContact O-CD1 3.05Å; A20-L24 WeakPolarHBondContact O-CG 3.42Å; A20-L24 PolarHBondContact O-N 3.4Å; V21-L24 PolarHBondContact O-N 3.05Å; L24-V27 PolarHBondContact O-N 3.49Å; L24-Q28 WeakPolarHBondContact O-CB 3.43Å; L24-Q28 WeakPolarHBondContact O-CG 3.24Å; L24-Q28 PolarHBondContact O-N 3.46Å
25	T	69.1	Low	63.2	Low	65 Å²	65	104.2 Å²	104.2	40%	0.399	58%	0.58	S	S	.	*	H	α-helix	trans	-72.5	-32.9	176.8	49.3	0	0	0	0	112.6	V21 V22 A23 R29	V21-T25 HydrophobicContact CG1-CG2 4.49Å; V21-T25 WeakPolarHBondContact O-CB 3.48Å; V21-T25 WeakPolarHBondContact O-CG2 3.15Å; V21-T25 PolarHBondContact O-N 3.5Å; V21-T25 PolarHBondContact O-OG1 3.17Å; V22-T25 WeakPolarHBondContact CA-OG1 3.21Å; V22-T25 PolarHBondContact O-N 2.9Å; V22-T25 PolarHBondContact O-OG1 3.18Å; A23-T25 PolarHBondContact O-N 3.22Å; T25-R29 WeakPolarHBondContact O-CB 3.25Å; T25-R29 PolarHBondContact O-N 2.99Å
26	I	69	Low	60.4	Low	109 Å²	109	107.7 Å²	107.7	56%	0.559	60%	0.596	S	S	*	*	H	α-helix	trans	-69	-40.2	171.1	-69.3	168	0	0	0	110.8	V22 A23 R29 G30	V22-I26 HydrophobicContact CG1-CD1 3.71Å; V22-I26 HydrophobicContact CG1-CG1 4.41Å; V22-I26 WeakPolarHBondContact O-CB 3.41Å; V22-I26 WeakPolarHBondContact O-CG1 3.45Å; V22-I26 PolarHBondContact O-N 2.89Å; A23-I26 PolarHBondContact O-N 3.36Å; I26-R29 PolarHBondContact O-N 3.28Å; I26-G30 WeakPolarHBondContact O-CA 3.37Å; I26-G30 PolarHBondContact O-N 3.23Å
27	V	64.9	Low	57.9	Low	93 Å²	93	107.3 Å²	107.3	56%	0.564	60%	0.603	S	S	*	*	H	α-helix	trans	-68.9	-38.2	176.1	170.2	0	0	0	0	111.5	A23 L24 G30 S31	A23-V27 WeakPolarHBondContact O-CB 3.48Å; A23-V27 VanDerWaalsContact O-CG2 3.24Å; A23-V27 WeakPolarHBondContact O-CG2 3.45Å; A23-V27 PolarHBondContact O-N 3.4Å; L24-V27 PolarHBondContact O-N 3.49Å; V27-G30 PolarHBondContact O-N 2.67Å; V27-S31 WeakPolarHBondContact O-CB 3.31Å; V27-S31 PolarHBondContact O-N 3.11Å; V27-S31 PolarHBondContact O-OG 2.83Å
28	Q	50.1	Low	55.3	Low	126 Å²	126	108.1 Å²	108.1	59%	0.589	61%	0.607	S	S	*	*	H	α-helix	trans	-67.1	-40.5	171.8	-78.4	-180	-26.9	0	0	111.9	L24 I32	L24-Q28 WeakPolarHBondContact O-CB 3.43Å; L24-Q28 WeakPolarHBondContact O-CG 3.24Å; L24-Q28 PolarHBondContact O-N 3.46Å; Q28-I32 VanDerWaalsContact O-CD1 3.25Å; Q28-I32 WeakPolarHBondContact O-CD1 3.5Å; Q28-I32 WeakPolarHBondContact O-CG1 3.43Å; Q28-I32 PolarHBondContact O-N 3.04Å
29	R	48.9	Very low	52.6	Low	204 Å²	204	109.1 Å²	109.1	77%	0.77	61%	0.613	S	S	*	*	H	α-helix	trans	-69.1	-32.4	172.5	-90.9	-177.2	166	174.7	-3.4	113.2	T25 I26 I32	T25-R29 WeakPolarHBondContact O-CB 3.25Å; T25-R29 PolarHBondContact O-N 2.99Å; I26-R29 PolarHBondContact O-N 3.28Å; R29-I32 PolarHBondContact O-N 2.92Å
30	G	37.3	Very low	49.9	Very low	51 Å²	51	110.7 Å²	110.7	53%	0.526	62%	0.622	S	S	.	*	H	α-helix	trans	-72.1	-34.4	175.7	0	0	0	0	0	112.7	I26 V27 I32	I26-G30 WeakPolarHBondContact O-CA 3.37Å; I26-G30 PolarHBondContact O-N 3.23Å; V27-G30 PolarHBondContact O-N 2.67Å; G30-I32 VanDerWaalsContact C-N 3.28Å; G30-I32 PolarHBondContact O-N 3.44Å
31	S	35.8	Very low	47.4	Very low	97 Å²	97	116 Å²	116	68%	0.678	64%	0.639	S	S	*	*	H	α-helix	trans	-76.1	-12	172.4	-69.6	0	0	0	0	113.8	V27	V27-S31 WeakPolarHBondContact O-CB 3.31Å; V27-S31 PolarHBondContact O-N 3.11Å; V27-S31 PolarHBondContact O-OG 2.83Å
32	I	38.1	Very low	44.9	Very low	128 Å²	128	123.4 Å²	123.4	66%	0.656	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-3.1	177.2	-69.6	166.7	0	0	0	112.1	Q28 R29 G30	Q28-I32 VanDerWaalsContact O-CD1 3.25Å; Q28-I32 WeakPolarHBondContact O-CD1 3.5Å; Q28-I32 WeakPolarHBondContact O-CG1 3.43Å; Q28-I32 PolarHBondContact O-N 3.04Å; R29-I32 PolarHBondContact O-N 2.92Å; G30-I32 VanDerWaalsContact C-N 3.28Å; G30-I32 PolarHBondContact O-N 3.44Å
33	N	30.4	Very low	42.4	Very low	143 Å²	143	128 Å²	128	77%	0.765	68%	0.68	S	S	*	*	S	Bend	trans	-114.9	35.2	-175.9	-96.5	0	0	0	0	115.2
34	M	32.2	Very low	40.1	Very low	188 Å²	188	128.9 Å²	128.9	93%	0.926	69%	0.687	S	S	*	*	S	Bend	trans	-126.3	84.6	160.9	-88.6	-94.3	-81.3	0	0	108.6
35	G	28.8	Very low	38.5	Very low	63 Å²	63	134.5 Å²	134.5	65%	0.649	70%	0.701	S	S	*	*	S	Bend	trans	159	81	-178	0	0	0	0	0	109.4
36	T	28.9	Very low	36.6	Very low	123 Å²	123	138.6 Å²	138.6	76%	0.755	72%	0.717	S	S	*	*			trans	-47.8	128.7	172.7	36	0	0	0	0	110.9	F38	T36-F38 PolarHBondContact O-N 3.45Å
37	P	32	Very low	34.5	Very low	122 Å²	122	142.1 Å²	142.1	79%	0.792	73%	0.731	S	S	*	*			trans	-74	105.4	163.7	2	13.7	0	0	0	107.1	E39	P37-E39 VanDerWaalsContact C-N 3.28Å; P37-E39 PolarHBondContact O-N 3.32Å
38	F	29.4	Very low	32.8	Very low	165 Å²	165	142.4 Å²	142.4	72%	0.724	74%	0.743	S	S	*	*			trans	-79.7	81.3	177.2	-139.9	-89.4	0	0	0	110.2	T36 L40	T36-F38 PolarHBondContact O-N 3.45Å; F38-L40 PolarHBondContact O-N 2.93Å
39	E	30.9	Very low	31.6	Very low	167 Å²	167	141.4 Å²	141.4	78%	0.78	75%	0.75	S	S	*	*			trans	-78.9	93	156	-93.8	-73.2	165.3	0	0	108.3	P37	P37-E39 VanDerWaalsContact C-N 3.28Å; P37-E39 PolarHBondContact O-N 3.32Å
40	L	28.9	Very low	30.8	Very low	142 Å²	142	137.6 Å²	137.6	74%	0.743	75%	0.752	S	S	*	*			trans	-173.8	82.8	147.3	-135.1	76.8	0	0	0	111.5	F38	F38-L40 PolarHBondContact O-N 2.93Å
41	E	30.4	Very low	30.4	Very low	161 Å²	161	140.1 Å²	140.1	75%	0.752	77%	0.768	S	S	*	*			trans	-133.6	57.4	165.5	-148.6	168.5	-157	0	0	110.4
42	R	29.2	Very low	30	Very low	232 Å²	232	144 Å²	144	88%	0.875	78%	0.781	S	S	*	*	S	Bend	trans	-108.1	-1.7	-175.4	-146.2	175.9	-166.6	176.3	4.2	115.8
43	L	28.9	Very low	29.4	Very low	151 Å²	151	141 Å²	141	79%	0.791	78%	0.781	S	S	*	*	S	Bend	trans	-136	12	-165.9	-97.9	155.8	0	0	0	118.6
44	A	29.5	Very low	29.4	Very low	70 Å²	70	140.6 Å²	140.6	58%	0.579	79%	0.786	S	S	*	*	S	Bend	trans	-113.9	19.9	-178.2	0	0	0	0	0	116.1
45	R	35.6	Very low	29.1	Very low	224 Å²	224	143.6 Å²	143.6	85%	0.845	79%	0.788	S	S	*	*			trans	-130.2	13.7	176.7	-74.7	-171.8	-175.2	173.5	1.1	115.6
46	M	28.6	Very low	29	Very low	152 Å²	152	145 Å²	145	75%	0.749	79%	0.793	S	S	*	*			trans	-93.2	96	163.6	-74.8	-163.7	-76.5	0	0	108.4
47	H	26.4	Very low	29	Very low	183 Å²	183	145 Å²	145	85%	0.847	80%	0.795	S	S	*	*			trans	167	86.7	142.4	-85.6	-57.9	0	0	0	109
48	A	28	Very low	28.8	Very low	99 Å²	99	145.1 Å²	145.1	82%	0.818	80%	0.796	S	S	*	*			trans	-143	89.5	146.7	0	0	0	0	0	105
49	S	26.4	Very low	28.7	Very low	105 Å²	105	146.7 Å²	146.7	73%	0.734	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-62.4	137.4	171.2	-57.5	0	0	0	0	109
50	P	31	Very low	28.4	Very low	123 Å²	123	148 Å²	148	80%	0.799	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-82.2	134	165.3	29	-22.6	0	0	0	109.4
51	A	29.1	Very low	28.2	Very low	105 Å²	105	144.5 Å²	144.5	87%	0.868	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.9	135.4	166.4	0	0	0	0	0	109.3
52	D	27.4	Very low	28.2	Very low	178 Å²	178	143.2 Å²	143.2	95%	0.952	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-80.3	147.9	-177.6	-138.1	-12	0	0	0	111.5
53	G	25.4	Very low	27.9	Very low	64 Å²	64	137.1 Å²	137.1	66%	0.66	81%	0.808	S	S	*	*			trans	171.3	140	172.6	0	0	0	0	0	112.8
54	P	29.7	Very low	27.7	Very low	135 Å²	135	137.1 Å²	137.1	88%	0.877	81%	0.808	S	S	*	*				-95.9	158.8	-123.7	34.5	-36	0	0	0	117.1
55	R	26.1	Very low	27.4	Very low	252 Å²	252	141.7 Å²	141.7	95%	0.951	82%	0.817	S	S	*	*			trans	-58.9	145.7	171.6	-79.4	173.1	172.4	159	-1.7	114
56	A	27.2	Very low	26.8	Very low	92 Å²	92	139 Å²	139	76%	0.76	82%	0.819	S	S	*	*			trans	-129.9	154	153.8	0	0	0	0	0	109.4
57	P	29.2	Very low	26.6	Very low	124 Å²	124	135.1 Å²	135.1	81%	0.805	82%	0.817	S	S	*	*			trans	-89.7	173.6	-154	37.5	-36.3	0	0	0	114.6
58	P	28.1	Very low	26.9	Very low	123 Å²	123	135.1 Å²	135.1	80%	0.799	82%	0.823	S	S	*	*			trans	-90.3	146.9	-173.1	35.8	-30.2	0	0	0	112.1
59	E	25.7	Very low	26.9	Very low	199 Å²	199	139.6 Å²	139.6	93%	0.93	82%	0.824	S	S	*	*			trans	-110.6	139	162.3	-79.5	-167.3	160.6	0	0	110.5
60	E	25.8	Very low	27.3	Very low	194 Å²	194	138.1 Å²	138.1	91%	0.907	81%	0.813	S	S	*	*			trans	-71.9	158	-175.1	-64.3	178.1	143.6	0	0	112.9
61	G	24.3	Very low	27.6	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	80%	0.797	S	S	*	*			trans	-70.1	-175.8	-179.9	0	0	0	0	0	115
62	P	29.6	Very low	28.1	Very low	134 Å²	134	135 Å²	135	87%	0.87	77%	0.766	S	S	*	*				-140.9	168.9	95.6	32.8	-15.6	0	0	0	115.8
63	S	24.6	Very low	28.4	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	76%	0.757	S	S	*	*			trans	-60.6	154.7	-176.6	51.9	0	0	0	0	116.1
64	L	23.2	Very low	29	Very low	152 Å²	152	136 Å²	136	80%	0.796	76%	0.761	S	S	*	*				176.9	132.8	116.5	-108	118	0	0	0	113
65	H	23.6	Very low	29.2	Very low	165 Å²	165	137.5 Å²	137.5	76%	0.764	76%	0.761	S	S	*	*			trans	27.1	116.2	144.5	-83.7	-78.9	0	0	0	121.4
66	L	24.3	Very low	29.5	Very low	169 Å²	169	136.3 Å²	136.3	89%	0.885	76%	0.757	S	S	*	*				156.8	142	113	-119.3	76.9	0	0	0	111.3
67	G	23.9	Very low	29.6	Very low	69 Å²	69	141 Å²	141	71%	0.711	76%	0.763	S	S	*	*			trans	98.5	105.9	145	0	0	0	0	0	117.7	K69	G67-K69 VanDerWaalsContact C-N 3.33Å; G67-K69 PolarHBondContact O-N 3.14Å
68	L	31.3	Very low	29.5	Very low	183 Å²	183	144.7 Å²	144.7	96%	0.958	77%	0.767	S	S	*	*			trans	-65.4	82.1	163.2	-169.1	82.3	0	0	0	110.2
69	K	29.1	Very low	29.6	Very low	194 Å²	194	144.7 Å²	144.7	84%	0.843	77%	0.767	S	S	*	*			trans	-147.7	132.8	168.7	-70.6	-165.8	175.1	179.1	0	113.1	G67	G67-K69 VanDerWaalsContact C-N 3.33Å; G67-K69 PolarHBondContact O-N 3.14Å
70	S	34.3	Very low	29.7	Very low	74 Å²	74	145.4 Å²	145.4	52%	0.517	77%	0.767	S	S	.	*			trans	65.8	95	167.3	72.6	0	0	0	0	117.6
71	F	37.8	Very low	29.9	Very low	105 Å²	105	140.7 Å²	140.7	46%	0.461	76%	0.761	S	S	.	*	S	Bend	trans	-82.2	-26.3	166.5	-176.7	-111.5	0	0	0	112.3	K73	F71-K73 PolarHBondContact O-N 2.99Å
72	W	40.5	Very low	30.1	Very low	56 Å²	56	147.6 Å²	147.6	21%	0.212	77%	0.771	C	S	.	*			trans	-97.4	48	-172.8	-52	106.4	0	0	0	115.2	N265 E268 H360 A362	W72-N265 HydrophobicContact CZ2-CB 4.32Å; W72-E268 PolarHBondContact NE1-OE1 3.37Å; W72-E268 PolarHBondContact NE1-OE2 3.2Å; W72-H360 AromaticContact CE3-CE1 3.6Å; W72-H360 AromaticContact CE3-NE2 3.58Å; W72-H360 AromaticContact CZ3-CE1 3.27Å; W72-H360 WeakPolarHBondContact CZ3-CE1 3.48Å; W72-H360 AromaticContact CZ3-NE2 3.74Å; W72-A362 HydrophobicContact CH2-CB 3.75Å; W72-A362 HydrophobicContact CZ3-CB 3.83Å
73	K	33.2	Very low	29.9	Very low	173 Å²	173	145.8 Å²	145.8	75%	0.752	77%	0.768	S	S	*	*			trans	-89.4	106.2	167.2	-87.5	-178.9	179.3	174.2	0	110	F71	F71-K73 PolarHBondContact O-N 2.99Å
74	A	38	Very low	30.2	Very low	90 Å²	90	152.4 Å²	152.4	74%	0.744	78%	0.777	S	S	*	*			trans	-67.7	130.4	166.8	0	0	0	0	0	110.1	R76	A74-R76 PolarHBondContact O-N 3.08Å
75	D	32.5	Very low	30.4	Very low	167 Å²	167	149 Å²	149	89%	0.893	77%	0.771	S	S	*	*			trans	-69.8	117.4	177.9	-149.5	-0.1	0	0	0	109.6	Q77	D75-Q77 PolarHBondContact O-N 2.61Å
76	R	32.8	Very low	30.9	Very low	228 Å²	228	147.6 Å²	147.6	86%	0.86	77%	0.774	S	S	*	*			trans	-91	101.6	-176	-73.6	-175.6	-179.4	-175.3	0.1	110.1	A74 K78	A74-R76 PolarHBondContact O-N 3.08Å; R76-K78 PolarHBondContact O-N 3.46Å
77	Q	29.5	Very low	31.2	Very low	190 Å²	190	145.4 Å²	145.4	89%	0.888	77%	0.768	S	S	*	*			trans	-80.3	114.3	157	-82	-176.4	-13.5	0	0	109.7	D75	D75-Q77 PolarHBondContact O-N 2.61Å
78	K	26.7	Very low	31.4	Very low	202 Å²	202	151.1 Å²	151.1	88%	0.878	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-71.4	129.2	172.5	-74.1	-179.2	177.6	178.1	0	110.5	R76	R76-K78 PolarHBondContact O-N 3.46Å
79	P	31.3	Very low	31.3	Very low	123 Å²	123	150.8 Å²	150.8	80%	0.799	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-78.8	139.1	160.3	-7.5	25.4	0	0	0	110.3
80	K	28.2	Very low	31.4	Very low	214 Å²	214	147.2 Å²	147.2	93%	0.93	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-68.4	138.7	171.8	-76.7	178	174.5	176.8	0	110.6
81	A	29.3	Very low	31.2	Very low	94 Å²	94	155 Å²	155	78%	0.777	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.9	140.4	179.7	0	0	0	0	0	113.8
82	K	27.9	Very low	31.3	Very low	214 Å²	214	155.7 Å²	155.7	93%	0.93	80%	0.797	S	S	*	*			trans	167.5	137.4	144	-93.1	173.2	-177.5	-173.2	0	106.4
83	A	26.6	Very low	31	Very low	97 Å²	97	158.5 Å²	158.5	80%	0.802	82%	0.82	S	S	*	*			cis	-147	163.8	22.7	0	0	0	0	0	111.6
84	W	30.8	Very low	31.5	Very low	241 Å²	241	157.7 Å²	157.7	91%	0.913	82%	0.824	S	S	*	*			trans	-67.9	123.6	178.9	-156.4	-37.8	0	0	0	110.7
85	A	27.7	Very low	31.7	Very low	82 Å²	82	160.7 Å²	160.7	68%	0.678	83%	0.828	S	S	*	*			trans	-129.1	119.6	163.4	0	0	0	0	0	108	T87	A85-T87 PolarHBondContact O-N 2.89Å
86	T	33.4	Very low	32.2	Very low	134 Å²	134	158 Å²	158	82%	0.822	82%	0.818	S	S	*	*			trans	-73.8	104.5	178.7	-26	0	0	0	0	108.3
87	T	30.2	Very low	33.1	Very low	123 Å²	123	149.9 Å²	149.9	76%	0.755	80%	0.796	S	S	*	*			trans	-133.7	118.5	170.6	-32.2	0	0	0	0	108.1	A85 E89	A85-T87 PolarHBondContact O-N 2.89Å; T87-E89 PolarHBondContact O-N 2.98Å
88	Q	29.3	Very low	34.3	Very low	189 Å²	189	143.6 Å²	143.6	88%	0.883	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-55.8	123.9	175.8	-72.2	175.9	-17.9	0	0	109.4
89	E	29.2	Very low	36.3	Very low	177 Å²	177	137.6 Å²	137.6	83%	0.827	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-61.1	131.5	166.9	-72.2	-175.6	153.1	0	0	108.7	T87 R91	T87-E89 PolarHBondContact O-N 2.98Å; E89-R91 PolarHBondContact O-N 2.83Å; E89-R91 VanDerWaalsContact O-N 3.12Å
90	P	29.7	Very low	38.8	Very low	119 Å²	119	136.6 Å²	136.6	77%	0.773	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-64.3	118.3	170.7	-3.4	16.3	0	0	0	107.7	V92	P90-V92 PolarHBondContact O-N 2.84Å
91	R	31.5	Very low	41.7	Very low	237 Å²	237	127.4 Å²	127.4	89%	0.894	71%	0.714	S	S	*	*			trans	-60.9	104.5	166.8	-83.2	-178.5	176.3	176.1	-1.6	108	E89 T93	E89-R91 PolarHBondContact O-N 2.83Å; E89-R91 VanDerWaalsContact O-N 3.12Å; R91-T93 PolarHBondContact O-N 3.12Å
92	V	38.5	Very low	44.4	Very low	119 Å²	119	127.5 Å²	127.5	72%	0.721	70%	0.702	S	S	*	*			trans	-67.2	108.3	165.9	180	0	0	0	0	106.6	P90 D94	P90-V92 PolarHBondContact O-N 2.84Å; V92-D94 PolarHBondContact O-N 3.28Å
93	T	34.4	Very low	47.3	Very low	115 Å²	115	118.4 Å²	118.4	71%	0.706	66%	0.664	S	S	*	*			trans	-73.2	114	169.1	46.2	0	0	0	0	108.3	R91 D95	R91-T93 PolarHBondContact O-N 3.12Å; T93-D95 PolarHBondContact O-N 3.37Å; T93-D95 VanDerWaalsContact O-N 3.09Å
94	D	45.1	Very low	50.1	Low	157 Å²	157	119.7 Å²	119.7	84%	0.84	66%	0.662	S	S	*	*			trans	-80.6	27.1	-167.1	-134	4.3	0	0	0	114.3	V92	V92-D94 PolarHBondContact O-N 3.28Å
95	D	41.1	Very low	52.6	Low	153 Å²	153	111.1 Å²	111.1	82%	0.818	64%	0.639	S	S	*	*			trans	-134.8	23.1	-158.2	-131.1	-0.2	0	0	0	116.8	T93	T93-D95 PolarHBondContact O-N 3.37Å; T93-D95 VanDerWaalsContact O-N 3.09Å
96	T	44	Very low	55.1	Low	110 Å²	110	109.3 Å²	109.3	68%	0.675	62%	0.621	S	S	*	*			trans	-136.2	33	178.1	43.1	0	0	0	0	114.3	P98	T96-P98 WeakPolarHBondContact O-CD 3.45Å
97	S	51.8	Low	57.2	Low	58 Å²	58	110.2 Å²	110.2	41%	0.406	62%	0.621	S	S	.	*			trans	-71.8	122.1	163.4	-63	0	0	0	0	108.5	G99 H243	S97-G99 PolarHBondContact O-N 3.49Å; S97-H243 PolarHBondContact OG-CE1 2.82Å; S97-H243 PolarHBondContact OG-NE2 2.73Å
98	P	54.8	Low	60	Low	58 Å²	58	106.3 Å²	106.3	38%	0.377	60%	0.598	S	S	.	*			trans	-56.8	131.1	173.4	-12	21	0	0	0	108.3	T96 N100 T244	T96-P98 WeakPolarHBondContact O-CD 3.45Å; P98-N100 PolarHBondContact O-N 3.47Å; P98-T244 WeakPolarHBondContact O-CG2 3.32Å
99	G	68.4	Low	62.9	Low	76 Å²	76	101.4 Å²	101.4	78%	0.784	59%	0.585	S	S	*	*	S	Bend	trans	-68.4	1	178.1	0	0	0	0	0	114.1	S97	S97-G99 PolarHBondContact O-N 3.49Å
100	N	82.6	Confident	66	Low	102 Å²	102	94.2 Å²	94.2	55%	0.545	56%	0.556	S	S	.	*	S	Bend	trans	-154.1	157.5	-179.5	-163.1	22.6	0	0	0	111.9	P98 D102 Y245	P98-N100 PolarHBondContact O-N 3.47Å; N100-D102 PolarHBondContact O-N 3.2Å; N100-Y245 PolarHBondContact OD1-OH 2.95Å
101	W	88.9	Confident	69.1	Low	20 Å²	20	91.1 Å²	91.1	8%	0.076	53%	0.533	C	S	.	.			trans	-66.4	116.3	172.1	-173.1	-92.7	0	0	0	109.9	V103 F139 M141 W222 H237 K240 W241 Y245	W101-V103 HydrophobicContact CZ2-CB 4.38Å; W101-V103 HydrophobicContact CZ2-CG2 4.33Å; W101-V103 PolarHBondContact NE1-O 2.98Å; W101-F139 WeakPolarHBondContact CZ2-O 3.35Å; W101-F139 PolarHBondContact NE1-O 3.11Å; W101-M141 HydrophobicContact CD2-CG 3.72Å; W101-M141 HydrophobicContact CD2-SD 4.47Å; W101-M141 HydrophobicContact CE3-CG 4.42Å; W101-M141 HydrophobicContact CG-CG 3.73Å; W101-M141 HydrophobicContact CZ2-CG 4.36Å; W101-W222 AromaticContact CH2-NE1 3.46Å; W101-W222 AromaticContact CZ2-CD1 3.82Å; W101-W222 AromaticContact CZ2-NE1 3.54Å; W101-W222 AromaticContact CZ3-NE1 3.99Å; W101-H237 HydrophobicContact CH2-CB 4.29Å; W101-H237 AromaticContact CH2-CD2 3.78Å; W101-H237 AromaticContact CZ2-CD2 3.79Å; W101-K240 HydrophobicContact CE3-CD 4.34Å; W101-K240 HydrophobicContact CE3-CG 4.17Å; W101-K240 HydrophobicContact CH2-CB 4.15Å; W101-K240 HydrophobicContact CH2-CD 3.77Å; W101-K240 HydrophobicContact CH2-CG 4.04Å; W101-K240 HydrophobicContact CZ2-CD 4.49Å; W101-K240 HydrophobicContact CZ3-CB 3.77Å; W101-K240 HydrophobicContact CZ3-CD 3.7Å; W101-K240 HydrophobicContact CZ3-CG 3.51Å; W101-W241 HydrophobicContact CE3-CB 4.46Å; W101-W241 HydrophobicContact CZ3-CB 4.12Å; W101-Y245 HydrophobicContact CB-CE2 4.3Å; W101-Y245 WeakPolarHBondContact CB-OH 3.3Å; W101-Y245 PolarHBondContact N-OH 3.08Å
102	D	87.3	Confident	72.1	Confident	96 Å²	96	85.5 Å²	85.5	51%	0.513	52%	0.52	S	S	.	.			trans	-93.4	-5.5	-170.3	62.2	-23.6	0	0	0	114.1	N100 T104 K240	N100-D102 PolarHBondContact O-N 3.2Å; D102-T104 PolarHBondContact O-N 2.96Å; D102-K240 VanDerWaalsContact OD1-CE 3.25Å; D102-K240 WeakPolarHBondContact OD1-CE 3.44Å; D102-K240 IonicContact OD1-NZ 2.77Å; D102-K240 PolarHBondContact OD1-NZ 3.24Å; D102-K240 IonicContact OD2-NZ 2.66Å
103	V	88.6	Confident	74.7	Confident	24 Å²	24	85.8 Å²	85.8	15%	0.145	52%	0.517	C	S	.	.			trans	-90.6	100.4	-177.3	-172.8	0	0	0	0	109.6	W101 F138 P140	W101-V103 HydrophobicContact CZ2-CB 4.38Å; W101-V103 HydrophobicContact CZ2-CG2 4.33Å; W101-V103 PolarHBondContact NE1-O 2.98Å; V103-F138 HydrophobicContact CG1-CB 4.08Å; V103-F138 HydrophobicContact CG2-CB 3.85Å; V103-F138 HydrophobicContact CG2-CG 4.42Å; V103-P140 WeakPolarHBondContact O-CA 3.5Å
104	T	84.6	Confident	77.4	Confident	124 Å²	124	81.4 Å²	81.4	76%	0.761	49%	0.49	S	S	*	.			trans	-98.4	-19.5	-175.8	56.5	0	0	0	0	113.9	D102	D102-T104 PolarHBondContact O-N 2.96Å
105	S	84.1	Confident	79.6	Confident	60 Å²	60	75.6 Å²	75.6	42%	0.42	46%	0.461	S	S	.	.			trans	-149	147	174.5	58.7	0	0	0	0	110.6
106	S	79.4	Confident	81.9	Confident	44 Å²	44	73.5 Å²	73.5	31%	0.308	46%	0.458	S	S	.	.			trans	-98.4	84.3	169.1	57.5	0	0	0	0	109.3	C108	S106-C108 PolarHBondContact O-N 3.12Å
107	N	77.8	Confident	84.3	Confident	154 Å²	154	71.7 Å²	71.7	82%	0.824	44%	0.442	S	S	*	.			trans	-78	60.9	170.7	-71.9	-20.9	0	0	0	110.2
108	C	88.2	Confident	86.3	Confident	40 Å²	40	73.1 Å²	73.1	27%	0.27	46%	0.457	S	S	.	.			trans	-102.1	123	-177.2	161.7	0	0	0	0	109.5	S106 Y133 C136	S106-C108 PolarHBondContact O-N 3.12Å; C108-Y133 VanDerWaalsContact SG-CD1 3.52Å; C108-C136 HydrophobicContact CB-CB 3.72Å; C108-C136 WeakPolarHBondContact CB-SG 3.36Å; C108-C136 WeakPolarHBondContact SG-CB 3.38Å; C108-C136 CovalentContact SG-SG 1.99Å; C108-C136 PolarHBondContact SG-SG 3.12Å
109	S	92.1	Very high	88.1	Confident	86 Å²	86	74.2 Å²	74.2	60%	0.601	45%	0.454	S	S	*	.			trans	-115.2	154.8	178	59.4	0	0	0	0	110.9	N111 H135	S109-N111 PolarHBondContact O-N 3.48Å; S109-H135 PolarHBondContact O-CE1 2.83Å; S109-H135 PolarHBondContact O-NE2 2.85Å; S109-H135 VanDerWaalsContact O-NE2 3.15Å
110	A	94.3	Very high	89.4	Confident	26 Å²	26	71 Å²	71	22%	0.215	42%	0.418	C	S	.	.			trans	-65.7	133.7	178.3	0	0	0	0	0	111	L112 L132 Y133	A110-L112 VanDerWaalsContact C-N 3.34Å; A110-L112 HydrophobicContact CB-CD2 4.01Å; A110-L112 HydrophobicContact CB-CG 4.44Å; A110-L112 PolarHBondContact O-N 3.4Å; A110-L132 HydrophobicContact CB-CB 4.27Å; A110-Y133 HydrophobicContact CB-CE1 4.25Å; A110-Y133 HydrophobicContact CB-CE2 4.09Å
111	N	94.1	Very high	90	Very high	54 Å²	54	71.3 Å²	71.3	29%	0.289	42%	0.417	S	S	.	.			trans	-77.7	82.3	172.9	-175.6	1	0	0	0	111.4	S109 N113 L114 L132	S109-N111 PolarHBondContact O-N 3.48Å; N111-N113 PolarHBondContact O-N 3.49Å; N111-N113 VanDerWaalsContact O-N 3.14Å; N111-N113 WeakPolarHBondContact OD1-CB 3.27Å; N111-N113 PolarHBondContact OD1-N 2.81Å; N111-L114 PolarHBondContact O-N 3.46Å; N111-L132 PolarHBondContact N-O 3.02Å; N111-L132 VanDerWaalsContact O-CD2 3.25Å; N111-L132 WeakPolarHBondContact O-CD2 3.41Å
112	L	94	Very high	90.2	Very high	119 Å²	119	74.1 Å²	74.1	62%	0.623	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-67.6	-10.1	-176.7	-59	178	0	0	0	114.4	A110 L114 S115	A110-L112 VanDerWaalsContact C-N 3.34Å; A110-L112 HydrophobicContact CB-CD2 4.01Å; A110-L112 HydrophobicContact CB-CG 4.44Å; A110-L112 PolarHBondContact O-N 3.4Å; L112-L114 PolarHBondContact O-N 3.46Å; L112-S115 WeakPolarHBondContact O-CB 3.29Å; L112-S115 PolarHBondContact O-N 2.86Å; L112-S115 VanDerWaalsContact O-N 3.07Å; L112-S115 PolarHBondContact O-OG 3.38Å
113	N	92.6	Very high	90.5	Very high	125 Å²	125	70.3 Å²	70.3	67%	0.668	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-64.9	-18.3	174.7	-62.8	-22.5	0	0	0	112.6	N111 Q117	N111-N113 PolarHBondContact O-N 3.49Å; N111-N113 VanDerWaalsContact O-N 3.14Å; N111-N113 WeakPolarHBondContact OD1-CB 3.27Å; N111-N113 PolarHBondContact OD1-N 2.81Å; N113-Q117 PolarHBondContact O-NE2 3.11Å
114	L	91.2	Very high	90.8	Very high	24 Å²	24	72.2 Å²	72.2	13%	0.126	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-79.3	-26.5	175.5	-57.4	-179.7	0	0	0	112.1	N111 L112 S116 Q117 W119 F120 M131	N111-L114 PolarHBondContact O-N 3.46Å; L112-L114 PolarHBondContact O-N 3.46Å; L114-S116 VanDerWaalsContact C-N 3.28Å; L114-S116 PolarHBondContact O-N 3.41Å; L114-Q117 WeakPolarHBondContact O-CB 3.32Å; L114-Q117 PolarHBondContact O-N 3.16Å; L114-W119 HydrophobicContact CD2-CH2 4.16Å; L114-W119 HydrophobicContact CD2-CZ2 4.11Å; L114-F120 HydrophobicContact CB-CD2 3.86Å; L114-F120 HydrophobicContact CB-CE2 4.12Å; L114-F120 HydrophobicContact CB-CG 4.31Å; L114-F120 VanDerWaalsContact O-CB 3.22Å; L114-F120 WeakPolarHBondContact O-CB 3.27Å; L114-F120 WeakPolarHBondContact O-CG 3.26Å; L114-M131 HydrophobicContact CD1-CB 4.08Å; L114-M131 HydrophobicContact CD1-CE 4.43Å; L114-M131 WeakPolarHBondContact CD1-O 3.13Å
115	S	91.1	Very high	91.3	Very high	35 Å²	35	72.3 Å²	72.3	25%	0.245	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-27.7	-169.7	-58.1	0	0	0	0	113.8	L112 Q117 Q121	L112-S115 WeakPolarHBondContact O-CB 3.29Å; L112-S115 PolarHBondContact O-N 2.86Å; L112-S115 VanDerWaalsContact O-N 3.07Å; L112-S115 PolarHBondContact O-OG 3.38Å; S115-Q117 VanDerWaalsContact C-N 3.29Å; S115-Q117 PolarHBondContact O-N 2.84Å; S115-Q121 PolarHBondContact O-NE2 3.35Å
116	S	90.6	Very high	91.7	Very high	108 Å²	108	72.9 Å²	72.9	76%	0.755	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-10.2	178.4	57.9	0	0	0	0	113.5	L114	L114-S116 VanDerWaalsContact C-N 3.28Å; L114-S116 PolarHBondContact O-N 3.41Å
117	Q	93.6	Very high	92.5	Very high	73 Å²	73	71 Å²	71	34%	0.341	41%	0.411	S	S	.	.			trans	-82.9	131.7	-171.6	-53.4	-170.2	35.3	0	0	111.2	N113 L114 S115 W119 F120 Q121	N113-Q117 PolarHBondContact O-NE2 3.11Å; L114-Q117 WeakPolarHBondContact O-CB 3.32Å; L114-Q117 PolarHBondContact O-N 3.16Å; S115-Q117 VanDerWaalsContact C-N 3.29Å; S115-Q117 PolarHBondContact O-N 2.84Å; Q117-W119 VanDerWaalsContact C-N 3.27Å; Q117-W119 HydrophobicContact CB-CD2 4.49Å; Q117-W119 HydrophobicContact CB-CG 4.47Å; Q117-W119 HydrophobicContact CB-CZ2 4.28Å; Q117-W119 PolarHBondContact O-N 3.12Å; Q117-W119 VanDerWaalsContact OE1-CE2 3.22Å; Q117-F120 HydrophobicContact CB-CB 4.26Å; Q117-F120 WeakPolarHBondContact O-CB 3.44Å; Q117-F120 PolarHBondContact O-N 3.14Å; Q117-Q121 PolarHBondContact O-N 3.45Å; Q117-Q121 VanDerWaalsContact O-N 3.13Å
118	A	93.3	Very high	93.4	Very high	87 Å²	87	65.5 Å²	65.5	72%	0.719	38%	0.38	S	S	*	.	H	α-helix	trans	-58.8	-38.1	-176.8	0	0	0	0	0	112.9	F120 Q121 A122	A118-F120 VanDerWaalsContact C-N 3.29Å; A118-F120 PolarHBondContact O-N 3.08Å; A118-Q121 PolarHBondContact O-N 3.28Å; A118-A122 PolarHBondContact O-N 3.16Å
119	W	93.6	Very high	93.7	Very high	81 Å²	81	68.7 Å²	68.7	31%	0.307	39%	0.391	S	S	.	.	H	α-helix	trans	-66.6	-31.1	176.9	66.5	-101.9	0	0	0	112.5	L114 Q117 L123 M131 V303	L114-W119 HydrophobicContact CD2-CH2 4.16Å; L114-W119 HydrophobicContact CD2-CZ2 4.11Å; Q117-W119 VanDerWaalsContact C-N 3.27Å; Q117-W119 HydrophobicContact CB-CD2 4.49Å; Q117-W119 HydrophobicContact CB-CG 4.47Å; Q117-W119 HydrophobicContact CB-CZ2 4.28Å; Q117-W119 PolarHBondContact O-N 3.12Å; Q117-W119 VanDerWaalsContact OE1-CE2 3.22Å; W119-L123 HydrophobicContact CE3-CD1 4.07Å; W119-L123 HydrophobicContact CZ3-CD1 3.83Å; W119-M131 HydrophobicContact CH2-CE 3.69Å; W119-M131 HydrophobicContact CZ3-CE 3.96Å; W119-V303 HydrophobicContact CB-CG1 4.13Å; W119-V303 HydrophobicContact CE3-CB 4.14Å; W119-V303 HydrophobicContact CE3-CG1 4.33Å; W119-V303 HydrophobicContact CE3-CG2 3.94Å; W119-V303 HydrophobicContact CZ3-CG2 4.29Å
120	F	96	Very high	93.9	Very high	8 Å²	8	65.2 Å²	65.2	4%	0.035	37%	0.365	C	S	.	.	H	α-helix	trans	-72.2	-41.6	178	176	-89.6	0	0	0	110.4	L114 Q117 A118 A122 L123 K128 M131 L132	L114-F120 HydrophobicContact CB-CD2 3.86Å; L114-F120 HydrophobicContact CB-CE2 4.12Å; L114-F120 HydrophobicContact CB-CG 4.31Å; L114-F120 VanDerWaalsContact O-CB 3.22Å; L114-F120 WeakPolarHBondContact O-CB 3.27Å; L114-F120 WeakPolarHBondContact O-CG 3.26Å; Q117-F120 HydrophobicContact CB-CB 4.26Å; Q117-F120 WeakPolarHBondContact O-CB 3.44Å; Q117-F120 PolarHBondContact O-N 3.14Å; A118-F120 VanDerWaalsContact C-N 3.29Å; A118-F120 PolarHBondContact O-N 3.08Å; F120-A122 PolarHBondContact O-N 2.84Å; F120-L123 HydrophobicContact CD2-CD1 4.37Å; F120-L123 VanDerWaalsContact O-CB 3.32Å; F120-L123 WeakPolarHBondContact O-CB 3.41Å; F120-L123 PolarHBondContact O-N 3.12Å; F120-K128 HydrophobicContact CD1-CG 4.43Å; F120-K128 HydrophobicContact CE1-CB 4.23Å; F120-K128 HydrophobicContact CE1-CD 4.21Å; F120-K128 HydrophobicContact CE1-CG 3.94Å; F120-K128 HydrophobicContact CE2-CB 4.03Å; F120-K128 HydrophobicContact CE2-CG 4.14Å; F120-K128 HydrophobicContact CZ-CB 3.63Å; F120-K128 HydrophobicContact CZ-CD 4.45Å; F120-K128 HydrophobicContact CZ-CG 3.78Å; F120-K128 WeakPolarHBondContact O-CE 3.44Å; F120-M131 HydrophobicContact CD2-CB 4.26Å; F120-M131 HydrophobicContact CE2-CB 3.95Å; F120-L132 HydrophobicContact CE2-CD2 4.21Å; F120-L132 HydrophobicContact CE2-CG 4.09Å; F120-L132 HydrophobicContact CZ-CD1 4.13Å; F120-L132 HydrophobicContact CZ-CD2 3.87Å; F120-L132 HydrophobicContact CZ-CG 3.77Å
121	Q	93.8	Very high	93.9	Very high	109 Å²	109	65 Å²	65	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-30.8	177.5	-69.2	-62	-17.1	0	0	113	S115 Q117 A118 L123 K128	S115-Q121 PolarHBondContact O-NE2 3.35Å; Q117-Q121 PolarHBondContact O-N 3.45Å; Q117-Q121 VanDerWaalsContact O-N 3.13Å; A118-Q121 PolarHBondContact O-N 3.28Å; Q121-L123 VanDerWaalsContact C-N 3.29Å; Q121-L123 PolarHBondContact O-N 3.04Å; Q121-K128 VanDerWaalsContact O-CE 3.32Å; Q121-K128 WeakPolarHBondContact O-CE 3.26Å; Q121-K128 PolarHBondContact O-NZ 2.78Å
122	A	93.4	Very high	94	Very high	79 Å²	79	63.5 Å²	63.5	65%	0.653	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-7.5	176.5	0	0	0	0	0	114.8	A118 F120	A118-A122 PolarHBondContact O-N 3.16Å; F120-A122 PolarHBondContact O-N 2.84Å
123	L	95	Very high	94.1	Very high	16 Å²	16	62.1 Å²	62.1	8%	0.084	34%	0.339	C	S	.	.	S	Bend	trans	-77	153.8	177.3	-67.4	178.2	0	0	0	112.2	W119 F120 Q121 F127 K128 M131 P301 V303	W119-L123 HydrophobicContact CE3-CD1 4.07Å; W119-L123 HydrophobicContact CZ3-CD1 3.83Å; F120-L123 HydrophobicContact CD2-CD1 4.37Å; F120-L123 VanDerWaalsContact O-CB 3.32Å; F120-L123 WeakPolarHBondContact O-CB 3.41Å; F120-L123 PolarHBondContact O-N 3.12Å; Q121-L123 VanDerWaalsContact C-N 3.29Å; Q121-L123 PolarHBondContact O-N 3.04Å; L123-F127 HydrophobicContact CB-CB 4.07Å; L123-F127 HydrophobicContact CD1-CB 4.2Å; L123-F127 HydrophobicContact CD2-CB 4.3Å; L123-F127 HydrophobicContact CG-CB 4.43Å; L123-K128 HydrophobicContact CB-CG 3.85Å; L123-K128 WeakPolarHBondContact O-CE 3.44Å; L123-K128 PolarHBondContact O-NZ 3.12Å; L123-M131 HydrophobicContact CD1-CG 4.08Å; L123-P301 HydrophobicContact CD2-CB 3.86Å; L123-P301 HydrophobicContact CD2-CG 3.74Å; L123-V303 HydrophobicContact CD1-CG2 4.28Å; L123-V303 HydrophobicContact CD2-CG2 3.84Å; L123-V303 HydrophobicContact CG-CG2 4.5Å
124	E	94.5	Very high	94.1	Very high	65 Å²	65	58.3 Å²	58.3	30%	0.304	32%	0.315	S	S	.	.			trans	-72.5	155.9	168.5	-60.1	167.3	154.1	0	0	110	N126 F127 K128	E124-N126 VanDerWaalsContact C-N 3.29Å; E124-N126 WeakPolarHBondContact CB-OD1 3.39Å; E124-N126 PolarHBondContact O-N 2.67Å; E124-F127 HydrophobicContact CB-CD2 4.19Å; E124-F127 WeakPolarHBondContact O-CA 3.35Å; E124-F127 WeakPolarHBondContact O-CB 3.27Å; E124-F127 PolarHBondContact O-N 3.25Å; E124-K128 PolarHBondContact O-N 3.21Å
125	D	94.3	Very high	94.2	Very high	126 Å²	126	61.5 Å²	61.5	67%	0.674	33%	0.33	S	S	*	.	H	α-helix	trans	-61.6	-35.4	-168.6	-64.3	-28	0	0	0	113.5	F127 K128 Q129	D125-F127 VanDerWaalsContact C-N 3.32Å; D125-F127 PolarHBondContact O-N 3.19Å; D125-K128 PolarHBondContact O-N 3.16Å; D125-Q129 WeakPolarHBondContact O-CB 3.21Å; D125-Q129 PolarHBondContact O-N 2.86Å
126	N	93.6	Very high	94.2	Very high	72 Å²	72	60.3 Å²	60.3	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-60.6	-39.6	172.6	59.8	-40.2	0	0	0	112.3	E124 F130 F229	E124-N126 VanDerWaalsContact C-N 3.29Å; E124-N126 WeakPolarHBondContact CB-OD1 3.39Å; E124-N126 PolarHBondContact O-N 2.67Å; N126-F130 WeakPolarHBondContact O-CB 3.32Å; N126-F130 PolarHBondContact O-N 2.91Å; N126-F229 HydrophobicContact CB-CD2 4.37Å; N126-F229 HydrophobicContact CB-CE2 3.96Å; N126-F229 VanDerWaalsContact ND2-CE2 3.26Å; N126-F229 WeakPolarHBondContact ND2-CE2 3.45Å; N126-F229 WeakPolarHBondContact ND2-CZ 3.46Å
127	F	96.2	Very high	94.1	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.013	29%	0.294	C	S	.	.	H	α-helix	trans	-75	-36.9	175.5	-72.7	-71.2	0	0	0	112.4	L123 E124 D125 F130 M131 F229 Y299 I300 P301 L304	L123-F127 HydrophobicContact CB-CB 4.07Å; L123-F127 HydrophobicContact CD1-CB 4.2Å; L123-F127 HydrophobicContact CD2-CB 4.3Å; L123-F127 HydrophobicContact CG-CB 4.43Å; E124-F127 HydrophobicContact CB-CD2 4.19Å; E124-F127 WeakPolarHBondContact O-CA 3.35Å; E124-F127 WeakPolarHBondContact O-CB 3.27Å; E124-F127 PolarHBondContact O-N 3.25Å; D125-F127 VanDerWaalsContact C-N 3.32Å; D125-F127 PolarHBondContact O-N 3.19Å; F127-F130 PolarHBondContact O-N 2.83Å; F127-M131 WeakPolarHBondContact O-CB 3.15Å; F127-M131 VanDerWaalsContact O-CG 3.22Å; F127-M131 WeakPolarHBondContact O-CG 3.5Å; F127-M131 PolarHBondContact O-N 3.46Å; F127-F229 AromaticContact CD1-CE2 3.59Å; F127-F229 HydrophobicContact CD1-CE2 3.59Å; F127-F229 AromaticContact CD1-CZ 3.93Å; F127-F229 HydrophobicContact CD1-CZ 3.93Å; F127-F229 HydrophobicContact CD2-CE2 4.35Å; F127-F229 HydrophobicContact CD2-CZ 4.48Å; F127-F229 HydrophobicContact CE1-CE1 4.44Å; F127-F229 AromaticContact CE1-CE2 3.58Å; F127-F229 HydrophobicContact CE1-CE2 3.58Å; F127-F229 AromaticContact CE1-CZ 3.4Å; F127-F229 HydrophobicContact CE1-CZ 3.4Å; F127-F229 VanDerWaalsContact CE1-CZ 3.4Å; F127-F229 HydrophobicContact CE2-CE2 4.32Å; F127-F229 HydrophobicContact CE2-CZ 4Å; F127-F229 HydrophobicContact CG-CE2 4Å; F127-F229 HydrophobicContact CG-CZ 4.45Å; F127-F229 HydrophobicContact CZ-CE1 4.49Å; F127-F229 AromaticContact CZ-CE2 3.96Å; F127-F229 HydrophobicContact CZ-CE2 3.96Å; F127-F229 AromaticContact CZ-CZ 3.45Å; F127-F229 HydrophobicContact CZ-CZ 3.45Å; F127-F229 VanDerWaalsContact CZ-CZ 3.45Å; F127-Y299 AromaticContact CE2-CD1 3.57Å; F127-Y299 HydrophobicContact CE2-CD1 3.57Å; F127-Y299 AromaticContact CE2-CE1 3.78Å; F127-Y299 HydrophobicContact CE2-CE1 3.78Å; F127-Y299 AromaticContact CZ-CD1 3.91Å; F127-Y299 HydrophobicContact CZ-CD1 3.91Å; F127-Y299 HydrophobicContact CZ-CE1 4.3Å; F127-Y299 WeakPolarHBondContact CZ-O 3.32Å; F127-I300 HydrophobicContact CE1-CD1 4.14Å; F127-P301 HydrophobicContact CD1-CG 4.11Å; F127-P301 VanDerWaalsContact CE1-CD 3.45Å; F127-P301 HydrophobicContact CE1-CG 4.16Å; F127-P301 HydrophobicContact CG-CG 4.31Å; F127-P301 HydrophobicContact CZ-CG 4.45Å; F127-L304 HydrophobicContact CD1-CD1 3.36Å; F127-L304 HydrophobicContact CE1-CD1 3.63Å; F127-L304 HydrophobicContact CG-CD1 4.46Å
128	K	96.1	Very high	94	Very high	40 Å²	40	56.1 Å²	56.1	17%	0.174	29%	0.289	C	S	.	.	H	α-helix	trans	-58.3	-50.6	172.5	-71.6	176.3	172.8	160.1	0	110.4	F120 Q121 L123 E124 D125 F130 M131 L132	F120-K128 HydrophobicContact CD1-CG 4.43Å; F120-K128 HydrophobicContact CE1-CB 4.23Å; F120-K128 HydrophobicContact CE1-CD 4.21Å; F120-K128 HydrophobicContact CE1-CG 3.94Å; F120-K128 HydrophobicContact CE2-CB 4.03Å; F120-K128 HydrophobicContact CE2-CG 4.14Å; F120-K128 HydrophobicContact CZ-CB 3.63Å; F120-K128 HydrophobicContact CZ-CD 4.45Å; F120-K128 HydrophobicContact CZ-CG 3.78Å; F120-K128 WeakPolarHBondContact O-CE 3.44Å; Q121-K128 VanDerWaalsContact O-CE 3.32Å; Q121-K128 WeakPolarHBondContact O-CE 3.26Å; Q121-K128 PolarHBondContact O-NZ 2.78Å; L123-K128 HydrophobicContact CB-CG 3.85Å; L123-K128 WeakPolarHBondContact O-CE 3.44Å; L123-K128 PolarHBondContact O-NZ 3.12Å; E124-K128 PolarHBondContact O-N 3.21Å; D125-K128 PolarHBondContact O-N 3.16Å; K128-F130 PolarHBondContact O-N 3.03Å; K128-M131 PolarHBondContact O-N 3.02Å; K128-L132 VanDerWaalsContact O-CG 3.31Å; K128-L132 WeakPolarHBondContact O-CG 3.12Å; K128-L132 PolarHBondContact O-N 2.68Å
129	Q	94.8	Very high	94.1	Very high	106 Å²	106	53.3 Å²	53.3	50%	0.495	26%	0.26	S	S	.	.	H	α-helix	trans	-56.6	-49.9	175.8	-175.8	66	25	0	0	111	D125 M131 L132 Y133	D125-Q129 WeakPolarHBondContact O-CB 3.21Å; D125-Q129 PolarHBondContact O-N 2.86Å; Q129-M131 VanDerWaalsContact C-N 3.34Å; Q129-M131 PolarHBondContact O-N 3.33Å; Q129-L132 PolarHBondContact O-N 3.05Å; Q129-Y133 WeakPolarHBondContact O-CD2 3.42Å; Q129-Y133 PolarHBondContact O-N 3.4Å
130	F	95.6	Very high	94.2	Very high	13 Å²	13	50.4 Å²	50.4	6%	0.057	25%	0.252	C	S	.	.	H	α-helix	trans	-56.3	-48.1	176.9	177.9	-94.6	0	0	0	112.1	N126 F127 K128 L132 Y133 R134 F229 L304 I338 P340	N126-F130 WeakPolarHBondContact O-CB 3.32Å; N126-F130 PolarHBondContact O-N 2.91Å; F127-F130 PolarHBondContact O-N 2.83Å; K128-F130 PolarHBondContact O-N 3.03Å; F130-L132 PolarHBondContact O-N 2.96Å; F130-Y133 CarbonylContact O-C 3.56Å; F130-Y133 PolarHBondContact O-N 3.06Å; F130-R134 HydrophobicContact CE1-CB 4.42Å; F130-R134 HydrophobicContact CE1-CG 3.92Å; F130-R134 HydrophobicContact CZ-CG 4.07Å; F130-R134 WeakPolarHBondContact O-CA 3.34Å; F130-R134 WeakPolarHBondContact O-CB 3.47Å; F130-R134 PolarHBondContact O-N 3Å; F130-F229 HydrophobicContact CB-CD2 3.94Å; F130-F229 HydrophobicContact CD2-CB 4.01Å; F130-F229 HydrophobicContact CD2-CD2 4.42Å; F130-F229 HydrophobicContact CG-CD2 4.35Å; F130-L304 HydrophobicContact CD1-CD2 4.41Å; F130-L304 HydrophobicContact CE1-CD2 4.12Å; F130-I338 HydrophobicContact CE2-CG2 3.9Å; F130-I338 HydrophobicContact CZ-CG2 4Å; F130-I338 WeakPolarHBondContact CZ-O 3.22Å; F130-P340 HydrophobicContact CD1-CG 3.9Å; F130-P340 HydrophobicContact CD2-CB 4.48Å; F130-P340 HydrophobicContact CD2-CG 4.23Å; F130-P340 HydrophobicContact CE1-CG 3.6Å; F130-P340 HydrophobicContact CE2-CB 4.25Å; F130-P340 HydrophobicContact CE2-CG 3.94Å; F130-P340 HydrophobicContact CG-CG 4.21Å; F130-P340 HydrophobicContact CZ-CB 4.37Å; F130-P340 VanDerWaalsContact CZ-CD 3.49Å; F130-P340 HydrophobicContact CZ-CG 3.61Å
131	M	95.6	Very high	94.2	Very high	21 Å²	21	51.6 Å²	51.6	10%	0.103	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-39.4	-178	-73	-59	-71.9	0	0	113.1	L114 W119 F120 L123 F127 K128 Q129 Y133 L304	L114-M131 HydrophobicContact CD1-CB 4.08Å; L114-M131 HydrophobicContact CD1-CE 4.43Å; L114-M131 WeakPolarHBondContact CD1-O 3.13Å; W119-M131 HydrophobicContact CH2-CE 3.69Å; W119-M131 HydrophobicContact CZ3-CE 3.96Å; F120-M131 HydrophobicContact CD2-CB 4.26Å; F120-M131 HydrophobicContact CE2-CB 3.95Å; L123-M131 HydrophobicContact CD1-CG 4.08Å; F127-M131 WeakPolarHBondContact O-CB 3.15Å; F127-M131 VanDerWaalsContact O-CG 3.22Å; F127-M131 WeakPolarHBondContact O-CG 3.5Å; F127-M131 PolarHBondContact O-N 3.46Å; K128-M131 PolarHBondContact O-N 3.02Å; Q129-M131 VanDerWaalsContact C-N 3.34Å; Q129-M131 PolarHBondContact O-N 3.33Å; M131-Y133 PolarHBondContact O-N 3.43Å; M131-L304 HydrophobicContact CE-CD2 4.44Å; M131-L304 HydrophobicContact SD-CD2 3.34Å; M131-L304 WeakPolarHBondContact SD-CD2 3.43Å; M131-L304 HydrophobicContact SD-CG 4.15Å
132	L	95.6	Very high	94.4	Very high	23 Å²	23	49.5 Å²	49.5	12%	0.12	25%	0.25	C	C	.	.	H	α-helix	trans	-61.8	-33.7	177.9	-72.5	173.3	0	0	0	112.5	A110 N111 F120 K128 Q129 F130 H135	A110-L132 HydrophobicContact CB-CB 4.27Å; N111-L132 PolarHBondContact N-O 3.02Å; N111-L132 VanDerWaalsContact O-CD2 3.25Å; N111-L132 WeakPolarHBondContact O-CD2 3.41Å; F120-L132 HydrophobicContact CE2-CD2 4.21Å; F120-L132 HydrophobicContact CE2-CG 4.09Å; F120-L132 HydrophobicContact CZ-CD1 4.13Å; F120-L132 HydrophobicContact CZ-CD2 3.87Å; F120-L132 HydrophobicContact CZ-CG 3.77Å; K128-L132 VanDerWaalsContact O-CG 3.31Å; K128-L132 WeakPolarHBondContact O-CG 3.12Å; K128-L132 PolarHBondContact O-N 2.68Å; Q129-L132 PolarHBondContact O-N 3.05Å; F130-L132 PolarHBondContact O-N 2.96Å; L132-H135 PolarHBondContact O-CE1 3.17Å; L132-H135 PolarHBondContact O-ND1 3.15Å
133	Y	95.1	Very high	94.6	Very high	91 Å²	91	46.8 Å²	46.8	36%	0.357	22%	0.224	S	C	.	.	H	α-helix	trans	-112.7	5.6	-172.6	-67.7	-84.3	0	0	0	113.9	C108 A110 Q129 F130 M131 H135 C136	C108-Y133 VanDerWaalsContact SG-CD1 3.52Å; A110-Y133 HydrophobicContact CB-CE1 4.25Å; A110-Y133 HydrophobicContact CB-CE2 4.09Å; Q129-Y133 WeakPolarHBondContact O-CD2 3.42Å; Q129-Y133 PolarHBondContact O-N 3.4Å; F130-Y133 CarbonylContact O-C 3.56Å; F130-Y133 PolarHBondContact O-N 3.06Å; M131-Y133 PolarHBondContact O-N 3.43Å; Y133-H135 PolarHBondContact O-N 3.02Å; Y133-C136 WeakPolarHBondContact O-CB 3.39Å; Y133-C136 PolarHBondContact O-N 3.39Å
134	R	93.7	Very high	94.7	Very high	44 Å²	44	48.4 Å²	48.4	17%	0.166	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.3	-176.2	-171.3	178.1	-176	-146	-6	114	F130 C136 E337 I338	F130-R134 HydrophobicContact CE1-CB 4.42Å; F130-R134 HydrophobicContact CE1-CG 3.92Å; F130-R134 HydrophobicContact CZ-CG 4.07Å; F130-R134 WeakPolarHBondContact O-CA 3.34Å; F130-R134 WeakPolarHBondContact O-CB 3.47Å; F130-R134 PolarHBondContact O-N 3Å; R134-C136 VanDerWaalsContact C-N 3.26Å; R134-C136 PolarHBondContact O-N 2.99Å; R134-E337 IonicContact CZ-OE2 3.98Å; R134-E337 VanDerWaalsContact NH1-CD 3.34Å; R134-E337 IonicContact NH1-OE1 3.59Å; R134-E337 IonicContact NH1-OE2 3.04Å; R134-E337 PolarHBondContact NH1-OE2 3.01Å; R134-E337 IonicContact NH2-OE2 3.42Å; R134-E337 PolarHBondContact NH2-OE2 3.43Å; R134-I338 PolarHBondContact NE-O 3.04Å; R134-I338 PolarHBondContact NH2-O 2.78Å
135	H	92.2	Very high	94.8	Very high	92 Å²	92	46.2 Å²	46.2	43%	0.426	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	3	-179.8	68.3	-79.6	0	0	0	113.5	S109 L132 Y133 H137	S109-H135 PolarHBondContact O-CE1 2.83Å; S109-H135 PolarHBondContact O-NE2 2.85Å; S109-H135 VanDerWaalsContact O-NE2 3.15Å; L132-H135 PolarHBondContact O-CE1 3.17Å; L132-H135 PolarHBondContact O-ND1 3.15Å; Y133-H135 PolarHBondContact O-N 3.02Å; H135-H137 VanDerWaalsContact C-CD2 3.49Å; H135-H137 PolarHBondContact O-CD2 2.96Å
136	C	92.6	Very high	94.9	Very high	10 Å²	10	42.6 Å²	42.6	7%	0.068	21%	0.206	C	C	.	.			trans	-99.7	98	178.4	-59.4	0	0	0	0	110	C108 Y133 R134 F139 L233	C108-C136 HydrophobicContact CB-CB 3.72Å; C108-C136 WeakPolarHBondContact CB-SG 3.36Å; C108-C136 WeakPolarHBondContact SG-CB 3.38Å; C108-C136 CovalentContact SG-SG 1.99Å; C108-C136 PolarHBondContact SG-SG 3.12Å; Y133-C136 WeakPolarHBondContact O-CB 3.39Å; Y133-C136 PolarHBondContact O-N 3.39Å; R134-C136 VanDerWaalsContact C-N 3.26Å; R134-C136 PolarHBondContact O-N 2.99Å; C136-F139 HydrophobicContact CB-CZ 4.13Å; C136-L233 WeakPolarHBondContact O-CD2 3.3Å
137	H	88.6	Confident	95	Very high	41 Å²	41	44 Å²	44	19%	0.19	21%	0.21	C	C	.	.			trans	-91.6	-29.3	-168.3	-74.3	-119.9	0	0	0	114.2	H135 H237 L336 I338	H135-H137 VanDerWaalsContact C-CD2 3.49Å; H135-H137 PolarHBondContact O-CD2 2.96Å; H137-H237 PolarHBondContact O-CE1 2.74Å; H137-L336 PolarHBondContact CE1-O 3.29Å; H137-I338 HydrophobicContact CB-CD1 4.4Å
138	F	90.9	Very high	95	Very high	51 Å²	51	45 Å²	45	22%	0.224	22%	0.215	C	C	.	.			trans	-134.1	140.2	-171	-60.7	-67.2	0	0	0	113.4	V103 H237 K240 E334	V103-F138 HydrophobicContact CG1-CB 4.08Å; V103-F138 HydrophobicContact CG2-CB 3.85Å; V103-F138 HydrophobicContact CG2-CG 4.42Å; F138-H237 WeakPolarHBondContact CA-NE2 3.33Å; F138-K240 HydrophobicContact CD1-CD 3.73Å; F138-K240 HydrophobicContact CE1-CB 4.13Å; F138-K240 HydrophobicContact CE1-CD 3.42Å; F138-K240 VanDerWaalsContact CE1-CD 3.42Å; F138-K240 HydrophobicContact CE1-CG 4.37Å; F138-K240 HydrophobicContact CG-CD 4.49Å; F138-K240 HydrophobicContact CZ-CD 3.96Å; F138-E334 HydrophobicContact CZ-CG 3.99Å; F138-E334 WeakPolarHBondContact CZ-OE1 3.41Å
139	F	95.4	Very high	95	Very high	28 Å²	28	43.5 Å²	43.5	12%	0.123	21%	0.209	C	C	.	.			trans	-130.1	152.5	-177.5	-65.2	-95.5	0	0	0	110.2	W101 C136 D223 F224 L233 H237	W101-F139 WeakPolarHBondContact CZ2-O 3.35Å; W101-F139 PolarHBondContact NE1-O 3.11Å; C136-F139 HydrophobicContact CB-CZ 4.13Å; F139-D223 WeakPolarHBondContact CD1-O 3.34Å; F139-F224 HydrophobicContact CB-CB 4.44Å; F139-F224 HydrophobicContact CB-CD1 4.37Å; F139-F224 HydrophobicContact CD1-CB 3.97Å; F139-F224 HydrophobicContact CD2-CB 3.91Å; F139-F224 HydrophobicContact CD2-CD1 4.16Å; F139-F224 HydrophobicContact CD2-CG 4.43Å; F139-F224 HydrophobicContact CE1-CB 4.18Å; F139-F224 HydrophobicContact CE2-CB 4.15Å; F139-F224 HydrophobicContact CG-CB 3.84Å; F139-F224 HydrophobicContact CG-CD1 4.37Å; F139-F224 HydrophobicContact CZ-CB 4.27Å; F139-L233 HydrophobicContact CD2-CD1 4.35Å; F139-L233 HydrophobicContact CD2-CD2 4.47Å; F139-L233 HydrophobicContact CE2-CD1 3.67Å; F139-L233 HydrophobicContact CE2-CD2 3.94Å; F139-L233 HydrophobicContact CE2-CG 4.43Å; F139-L233 HydrophobicContact CZ-CD1 4.31Å; F139-H237 AromaticContact CD2-CE1 3.64Å; F139-H237 AromaticContact CD2-NE2 3.57Å; F139-H237 PolarHBondContact N-NE2 2.84Å
140	P	95.8	Very high	94.8	Very high	20 Å²	20	42.8 Å²	42.8	13%	0.13	21%	0.212	C	C	.	.			trans	-57.7	152.8	174.8	-24.8	35.1	0	0	0	113	V103 W222 D223	V103-P140 WeakPolarHBondContact O-CA 3.5Å; P140-W222 WeakPolarHBondContact O-CA 3.49Å; P140-D223 PolarHBondContact O-N 2.79Å
141	M	96.6	Very high	94.6	Very high	33 Å²	33	43 Å²	43	16%	0.163	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	135.1	169.4	-68	-100.8	-63.2	0	0	109.6	W101 L143 N144 L220 W222	W101-M141 HydrophobicContact CD2-CG 3.72Å; W101-M141 HydrophobicContact CD2-SD 4.47Å; W101-M141 HydrophobicContact CE3-CG 4.42Å; W101-M141 HydrophobicContact CG-CG 3.73Å; W101-M141 HydrophobicContact CZ2-CG 4.36Å; M141-L143 VanDerWaalsContact CE-O 3.31Å; M141-L143 WeakPolarHBondContact CE-O 3.49Å; M141-N144 VanDerWaalsContact CE-CA 3.43Å; M141-N144 HydrophobicContact CE-CB 3.19Å; M141-N144 WeakPolarHBondContact CE-OD1 3.36Å; M141-L220 HydrophobicContact CE-CD2 4.42Å; M141-W222 VanDerWaalsContact SD-CD1 3.59Å; M141-W222 HydrophobicContact SD-CD2 4.12Å; M141-W222 HydrophobicContact SD-CG 4.29Å; M141-W222 HydrophobicContact SD-CZ2 3.66Å; M141-W222 PolarHBondContact SD-NE1 3.3Å
142	I	96.8	Very high	94.5	Very high	66 Å²	66	48.7 Å²	48.7	34%	0.338	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-45.9	170.1	-58.3	174.7	0	0	0	109.4	T195 Q221 D223	I142-T195 HydrophobicContact CD1-CG2 3.48Å; I142-T195 VanDerWaalsContact CD1-CG2 3.48Å; I142-Q221 HydrophobicContact CB-CB 4.28Å; I142-Q221 HydrophobicContact CB-CG 4.24Å; I142-Q221 HydrophobicContact CD1-CG 4.25Å; I142-Q221 PolarHBondContact N-O 3.38Å; I142-D223 HydrophobicContact CD1-CB 3.97Å; I142-D223 HydrophobicContact CG1-CB 3.98Å
143	L	97.9	Very high	94.6	Very high	22 Å²	22	47.7 Å²	47.7	12%	0.115	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	128.9	179.3	-58.5	177	0	0	0	109.6	M141 V209 N213 L219 Q221	M141-L143 VanDerWaalsContact CE-O 3.31Å; M141-L143 WeakPolarHBondContact CE-O 3.49Å; L143-V209 HydrophobicContact CD1-CG1 3.76Å; L143-N213 HydrophobicContact CD1-CB 3.84Å; L143-L219 WeakPolarHBondContact CB-O 3.41Å; L143-L219 HydrophobicContact CD1-CB 4.24Å; L143-Q221 HydrophobicContact CB-CB 3.89Å; L143-Q221 HydrophobicContact CD1-CB 4.08Å; L143-Q221 HydrophobicContact CG-CB 4.01Å; L143-Q221 PolarHBondContact N-O 3.18Å; L143-Q221 PolarHBondContact O-N 3.35Å; L143-Q221 VanDerWaalsContact O-N 3.15Å
144	N	97.6	Very high	94.8	Very high	50 Å²	50	44.8 Å²	44.8	27%	0.267	23%	0.228	S	C	.	.			trans	-134.9	141.8	-176.3	-166.7	10	0	0	0	111.6	M141 W241 Y245	M141-N144 VanDerWaalsContact CE-CA 3.43Å; M141-N144 HydrophobicContact CE-CB 3.19Å; M141-N144 WeakPolarHBondContact CE-OD1 3.36Å; N144-W241 PolarHBondContact OD1-NE1 2.99Å; N144-Y245 PolarHBondContact ND2-OH 3.23Å; N144-Y245 VanDerWaalsContact ND2-OH 3.11Å
145	H	97.2	Very high	95	Very high	18 Å²	18	42.7 Å²	42.7	8%	0.083	22%	0.22	C	C	.	.			trans	-138.8	61.2	-179.5	-70.7	-70.7	0	0	0	112.8	E147 K148 N213 G217 L219 L220 W241	H145-E147 VanDerWaalsContact CA-OE2 3.23Å; H145-E147 WeakPolarHBondContact CA-OE2 3.13Å; H145-E147 WeakPolarHBondContact CB-OE1 3.38Å; H145-E147 IonicContact CE1-OE1 2.7Å; H145-E147 IonicContact CG-OE1 3.67Å; H145-E147 IonicContact ND1-OE1 3.02Å; H145-E147 PolarHBondContact ND1-OE1 3.09Å; H145-E147 PolarHBondContact O-N 3.39Å; H145-K148 HydrophobicContact CB-CB 4.44Å; H145-K148 HydrophobicContact CB-CG 3.76Å; H145-K148 VanDerWaalsContact O-CB 3.31Å; H145-K148 WeakPolarHBondContact O-CB 3.49Å; H145-K148 PolarHBondContact O-N 2.84Å; H145-N213 PolarHBondContact NE2-ND2 3.06Å; H145-N213 PolarHBondContact NE2-OD1 3.22Å; H145-G217 VanDerWaalsContact CE1-CA 3.48Å; H145-G217 WeakPolarHBondContact CE1-CA 3.39Å; H145-G217 PolarHBondContact ND1-O 2.72Å; H145-L219 PolarHBondContact CD2-O 2.85Å; H145-L219 VanDerWaalsContact CD2-O 3.24Å; H145-L220 HydrophobicContact CB-CD2 4.22Å; H145-W241 WeakPolarHBondContact O-CZ2 3.39Å
146	P	96.1	Very high	95.3	Very high	51 Å²	51	38.3 Å²	38.3	33%	0.331	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-60.3	-27.8	-179.1	28.9	-36.1	0	0	0	112.4	K148 C149 Y245	P146-K148 PolarHBondContact O-N 2.87Å; P146-C149 PolarHBondContact O-N 2.89Å; P146-C149 VanDerWaalsContact O-N 3.08Å; P146-Y245 HydrophobicContact CB-CD1 3.48Å; P146-Y245 VanDerWaalsContact CB-CD1 3.48Å; P146-Y245 HydrophobicContact CB-CE1 3.74Å; P146-Y245 HydrophobicContact CB-CG 3.91Å
147	E	95.5	Very high	95.6	Very high	101 Å²	101	37.8 Å²	37.8	47%	0.472	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-60.8	-24.7	176.7	74.8	-71.6	171.9	0	0	113	H145 C149 T150	H145-E147 VanDerWaalsContact CA-OE2 3.23Å; H145-E147 WeakPolarHBondContact CA-OE2 3.13Å; H145-E147 WeakPolarHBondContact CB-OE1 3.38Å; H145-E147 IonicContact CE1-OE1 2.7Å; H145-E147 IonicContact CG-OE1 3.67Å; H145-E147 IonicContact ND1-OE1 3.02Å; H145-E147 PolarHBondContact ND1-OE1 3.09Å; H145-E147 PolarHBondContact O-N 3.39Å; E147-C149 PolarHBondContact O-N 2.92Å; E147-T150 WeakPolarHBondContact CA-OG1 3.47Å; E147-T150 VanDerWaalsContact O-CB 3.23Å; E147-T150 WeakPolarHBondContact O-CB 3.49Å; E147-T150 PolarHBondContact O-N 2.76Å; E147-T150 PolarHBondContact O-OG1 3.44Å
148	K	95.5	Very high	96.1	Very high	25 Å²	25	35.9 Å²	35.9	11%	0.109	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-62.9	-22.1	176	-73.8	-75	-128.8	-162.9	0	112.9	H145 P146 I153 E179 L190 G217	H145-K148 HydrophobicContact CB-CB 4.44Å; H145-K148 HydrophobicContact CB-CG 3.76Å; H145-K148 VanDerWaalsContact O-CB 3.31Å; H145-K148 WeakPolarHBondContact O-CB 3.49Å; H145-K148 PolarHBondContact O-N 2.84Å; P146-K148 PolarHBondContact O-N 2.87Å; K148-I153 WeakPolarHBondContact O-CD1 3.47Å; K148-E179 WeakPolarHBondContact CE-OE1 3.24Å; K148-E179 IonicContact NZ-OE1 2.73Å; K148-E179 PolarHBondContact NZ-OE1 3.42Å; K148-E179 IonicContact NZ-OE2 3.77Å; K148-L190 HydrophobicContact CB-CD2 4.13Å; K148-L190 HydrophobicContact CG-CD2 3.91Å; K148-G217 WeakPolarHBondContact CE-O 3.33Å
149	C	95.3	Very high	96.4	Very high	7 Å²	7	33.4 Å²	33.4	5%	0.047	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-97.4	15.8	175.9	-78.4	0	0	0	0	114.1	P146 E147 Y245 C246	P146-C149 PolarHBondContact O-N 2.89Å; P146-C149 VanDerWaalsContact O-N 3.08Å; E147-C149 PolarHBondContact O-N 2.92Å; C149-Y245 WeakPolarHBondContact CB-O 3.24Å; C149-C246 HydrophobicContact CB-CB 3.78Å; C149-C246 WeakPolarHBondContact CB-SG 3.39Å; C149-C246 WeakPolarHBondContact SG-CB 3.38Å; C149-C246 CovalentContact SG-SG 2.03Å; C149-C246 PolarHBondContact SG-SG 2.75Å
150	T	92.1	Very high	96.6	Very high	91 Å²	91	32.6 Å²	32.6	56%	0.558	17%	0.173	S	C	*	.			trans	-77.4	133.1	176.5	-51.9	0	0	0	0	112.2	E147 R186	E147-T150 WeakPolarHBondContact CA-OG1 3.47Å; E147-T150 VanDerWaalsContact O-CB 3.23Å; E147-T150 WeakPolarHBondContact O-CB 3.49Å; E147-T150 PolarHBondContact O-N 2.76Å; E147-T150 PolarHBondContact O-OG1 3.44Å; T150-R186 PolarHBondContact O-NH1 2.73Å
151	G	91.1	Very high	96.7	Very high	19 Å²	19	31.8 Å²	31.8	20%	0.196	17%	0.168	C	C	.	.	S	Bend	trans	83.8	-161.1	-178.4	0	0	0	0	0	113.5	R248	G151-R248 PolarHBondContact O-NE 3.48Å
152	E	93.8	Very high	96.7	Very high	140 Å²	140	32.6 Å²	32.6	65%	0.654	17%	0.174	S	C	*	.			trans	-92.6	123.5	177	-63.3	-173.3	168	0	0	109.9	R186	E152-R186 WeakPolarHBondContact O-CD 3.37Å; E152-R186 PolarHBondContact O-NE 3.09Å
153	I	97.6	Very high	96.7	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.1	179.4	-63.5	165.5	0	0	0	106.7	K148 L155 L156 K188 V249 Q250	K148-I153 WeakPolarHBondContact O-CD1 3.47Å; I153-L155 WeakPolarHBondContact CG2-O 3.22Å; I153-L156 HydrophobicContact CG2-CB 4.41Å; I153-K188 HydrophobicContact CD1-CG 4.09Å; I153-K188 HydrophobicContact CG1-CG 4.18Å; I153-K188 HydrophobicContact CG2-CB 4.33Å; I153-K188 HydrophobicContact CG2-CG 4.33Å; I153-V249 HydrophobicContact CB-CG2 3.96Å; I153-V249 HydrophobicContact CD1-CG2 4.15Å; I153-V249 HydrophobicContact CG2-CG1 4.42Å; I153-V249 HydrophobicContact CG2-CG2 4.19Å; I153-V249 WeakPolarHBondContact O-CA 3.29Å; I153-Q250 PolarHBondContact O-N 3.49Å; I153-Q250 VanDerWaalsContact O-N 3.08Å
154	Y	97.8	Very high	96.6	Very high	30 Å²	30	31.8 Å²	31.8	12%	0.118	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-47.2	179.9	-174.9	-96	0	0	0	110.6	K185 R186 Y251 L267 L270	Y154-K185 HydrophobicContact CD1-CB 3.84Å; Y154-K185 HydrophobicContact CD1-CD 3.77Å; Y154-K185 HydrophobicContact CD1-CG 4.12Å; Y154-K185 HydrophobicContact CD2-CB 4.4Å; Y154-K185 HydrophobicContact CD2-CD 4.29Å; Y154-K185 HydrophobicContact CD2-CG 4.19Å; Y154-K185 HydrophobicContact CE1-CD 3.61Å; Y154-K185 HydrophobicContact CE1-CG 4.41Å; Y154-K185 HydrophobicContact CE2-CD 4.15Å; Y154-K185 HydrophobicContact CE2-CG 4.45Å; Y154-K185 HydrophobicContact CG-CB 3.75Å; Y154-K185 HydrophobicContact CG-CD 4.1Å; Y154-K185 HydrophobicContact CG-CG 3.99Å; Y154-R186 PolarHBondContact N-O 3.47Å; Y154-Y251 HydrophobicContact CD1-CD2 4.45Å; Y154-Y251 HydrophobicContact CE1-CD2 4.02Å; Y154-Y251 HydrophobicContact CE1-CE2 4.31Å; Y154-Y251 HydrophobicContact CE2-CD2 4.17Å; Y154-Y251 AromaticContact CE2-CE2 3.9Å; Y154-Y251 HydrophobicContact CE2-CE2 3.9Å; Y154-Y251 AromaticContact CZ-CD2 3.89Å; Y154-Y251 AromaticContact CZ-CE2 3.72Å; Y154-Y251 PolarHBondContact O-N 2.76Å; Y154-L267 HydrophobicContact CD1-CD2 3.93Å; Y154-L267 HydrophobicContact CE1-CD2 3.82Å; Y154-L270 HydrophobicContact CE1-CB 4.28Å; Y154-L270 HydrophobicContact CE1-CD1 3.85Å; Y154-L270 WeakPolarHBondContact OH-CB 3.36Å
155	L	98.4	Very high	96.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	123.5	-178.9	179.3	64.7	0	0	0	110.6	I153 M157 R186 I187 K188 Y251 F253 I266 L270 L320	I153-L155 WeakPolarHBondContact CG2-O 3.22Å; L155-M157 HydrophobicContact CD1-SD 4.42Å; L155-M157 HydrophobicContact CD2-SD 3.57Å; L155-M157 VanDerWaalsContact CD2-SD 3.57Å; L155-M157 HydrophobicContact CG-SD 3.84Å; L155-R186 PolarHBondContact N-O 3.24Å; L155-I187 HydrophobicContact CB-CG1 4.18Å; L155-I187 HydrophobicContact CD2-CG1 4.49Å; L155-I187 HydrophobicContact CD2-CG2 4.4Å; L155-I187 WeakPolarHBondContact O-CA 3.25Å; L155-K188 PolarHBondContact O-N 2.92Å; L155-K188 VanDerWaalsContact O-N 3.07Å; L155-Y251 WeakPolarHBondContact CA-O 3.42Å; L155-F253 HydrophobicContact CD1-CB 4.05Å; L155-I266 HydrophobicContact CD1-CG2 4.38Å; L155-I266 HydrophobicContact CD2-CG2 3.68Å; L155-L270 HydrophobicContact CD1-CD1 4.49Å; L155-L320 HydrophobicContact CD1-CD2 4.15Å
156	L	98.8	Very high	96.5	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116	168.9	-173.9	66.3	0	0	0	109.2	I153 V158 K188 L190 F238 F242 V249 Y251 V252 F253	I153-L156 HydrophobicContact CG2-CB 4.41Å; L156-V158 HydrophobicContact CD2-CG2 3.9Å; L156-V158 HydrophobicContact CG-CG2 3.72Å; L156-K188 HydrophobicContact CD1-CB 3.84Å; L156-L190 HydrophobicContact CD1-CD1 3.95Å; L156-L190 HydrophobicContact CD1-CG 4.27Å; L156-L190 HydrophobicContact CD2-CD1 4.17Å; L156-L190 HydrophobicContact CG-CD1 4.46Å; L156-F238 HydrophobicContact CD2-CE2 4.48Å; L156-F242 HydrophobicContact CD2-CD2 3.93Å; L156-F242 HydrophobicContact CD2-CE2 3.96Å; L156-V249 HydrophobicContact CB-CG1 3.75Å; L156-V249 HydrophobicContact CB-CG2 4.48Å; L156-V249 HydrophobicContact CD2-CG2 4.44Å; L156-Y251 PolarHBondContact N-O 3.44Å; L156-V252 WeakPolarHBondContact O-CA 3.24Å; L156-F253 PolarHBondContact O-N 3.14Å
157	M	98.8	Very high	96.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	119.5	173.4	-54.3	-66.3	-73	0	0	108.5	L155 I159 W176 I187 K188 T189 L190 F253 V261 I266	L155-M157 HydrophobicContact CD1-SD 4.42Å; L155-M157 HydrophobicContact CD2-SD 3.57Å; L155-M157 VanDerWaalsContact CD2-SD 3.57Å; L155-M157 HydrophobicContact CG-SD 3.84Å; M157-I159 VanDerWaalsContact C-CD1 3.46Å; M157-I159 HydrophobicContact CB-CD1 3.78Å; M157-W176 HydrophobicContact CE-CE3 3.8Å; M157-W176 HydrophobicContact CE-CZ3 3.87Å; M157-I187 HydrophobicContact CG-CG2 3.84Å; M157-K188 WeakPolarHBondContact CB-O 3.5Å; M157-K188 PolarHBondContact N-O 3.37Å; M157-T189 HydrophobicContact CB-CG2 4.24Å; M157-T189 CarbonylContact O-C 3.59Å; M157-T189 WeakPolarHBondContact O-CA 3.35Å; M157-L190 PolarHBondContact O-N 2.89Å; M157-F253 HydrophobicContact CE-CB 4.18Å; M157-F253 HydrophobicContact CE-CD1 3.34Å; M157-F253 HydrophobicContact CE-CE1 3.9Å; M157-F253 HydrophobicContact CE-CG 3.87Å; M157-F253 HydrophobicContact SD-CB 3.59Å; M157-F253 VanDerWaalsContact SD-CB 3.59Å; M157-F253 HydrophobicContact SD-CD1 3.88Å; M157-F253 HydrophobicContact SD-CG 3.97Å; M157-V261 HydrophobicContact CE-CG1 4Å; M157-I266 HydrophobicContact CE-CD1 4.38Å
158	V	98.8	Very high	96.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	110.9	-175.1	-177.9	0	0	0	0	109.6	L156 L190 L192 F238 V252 F253 K254 G255	L156-V158 HydrophobicContact CD2-CG2 3.9Å; L156-V158 HydrophobicContact CG-CG2 3.72Å; V158-L190 WeakPolarHBondContact CA-O 3.46Å; V158-L192 HydrophobicContact CG1-CD1 3.5Å; V158-L192 HydrophobicContact CG1-CD2 3.81Å; V158-L192 HydrophobicContact CG1-CG 3.65Å; V158-F238 HydrophobicContact CB-CE2 4.2Å; V158-F238 HydrophobicContact CB-CZ 4.14Å; V158-F238 HydrophobicContact CG1-CD1 4.21Å; V158-F238 HydrophobicContact CG1-CD2 3.7Å; V158-F238 HydrophobicContact CG1-CE1 4.15Å; V158-F238 HydrophobicContact CG1-CE2 3.64Å; V158-F238 HydrophobicContact CG1-CG 4.01Å; V158-F238 HydrophobicContact CG1-CZ 3.9Å; V158-F238 HydrophobicContact CG2-CD2 4.45Å; V158-F238 HydrophobicContact CG2-CE1 4.35Å; V158-F238 HydrophobicContact CG2-CE2 3.56Å; V158-F238 HydrophobicContact CG2-CZ 3.52Å; V158-V252 HydrophobicContact CB-CG1 4.33Å; V158-V252 HydrophobicContact CG2-CG1 3.8Å; V158-F253 PolarHBondContact N-O 3.47Å; V158-K254 HydrophobicContact CB-CG 4.14Å; V158-K254 HydrophobicContact CG1-CG 4.17Å; V158-K254 VanDerWaalsContact O-CA 3.29Å; V158-K254 WeakPolarHBondContact O-CA 3.43Å; V158-K254 WeakPolarHBondContact O-CG 3.33Å; V158-G255 PolarHBondContact O-N 3.39Å; V158-G255 VanDerWaalsContact O-N 3.08Å
159	I	98.7	Very high	96.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.4	-167.5	-64.9	64.8	0	0	0	109.4	M157 S161 I172 W176 T189 L190 F191 L192 G255 D257	M157-I159 VanDerWaalsContact C-CD1 3.46Å; M157-I159 HydrophobicContact CB-CD1 3.78Å; I159-S161 PolarHBondContact O-N 2.91Å; I159-I172 HydrophobicContact CG2-CD1 4.1Å; I159-W176 HydrophobicContact CD1-CH2 4.27Å; I159-W176 HydrophobicContact CD1-CZ3 3.97Å; I159-W176 HydrophobicContact CG1-CH2 3.55Å; I159-W176 HydrophobicContact CG1-CZ3 3.79Å; I159-T189 HydrophobicContact CD1-CG2 3.85Å; I159-L190 PolarHBondContact N-O 2.9Å; I159-F191 HydrophobicContact CB-CD1 3.61Å; I159-F191 HydrophobicContact CB-CE1 3.85Å; I159-F191 HydrophobicContact CG1-CD1 4.42Å; I159-F191 HydrophobicContact CG1-CE1 4.2Å; I159-F191 HydrophobicContact CG2-CD1 3.75Å; I159-F191 HydrophobicContact CG2-CE1 3.87Å; I159-F191 CarbonylContact O-C 3.56Å; I159-F191 WeakPolarHBondContact O-CA 3.49Å; I159-L192 PolarHBondContact O-N 3.36Å; I159-G255 WeakPolarHBondContact CA-O 3.35Å; I159-D257 HydrophobicContact CG2-CB 3.8Å
160	K	98.4	Very high	97	Very high	10 Å²	10	32.7 Å²	32.7	4%	0.043	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	124.8	168.7	-69.8	-179.7	-83.6	165.9	0	109.1	K234 E235 G255 D256 D257 D342	K160-K234 HydrophobicContact CB-CD 4.24Å; K160-K234 HydrophobicContact CG-CD 3.97Å; K160-E235 WeakPolarHBondContact CD-OE1 3.33Å; K160-G255 PolarHBondContact N-O 3.26Å; K160-D256 WeakPolarHBondContact CE-OD1 3.35Å; K160-D256 IonicContact NZ-OD1 3.71Å; K160-D256 PolarHBondContact NZ-OD1 2.86Å; K160-D257 WeakPolarHBondContact O-CB 3.37Å; K160-D257 PolarHBondContact O-N 3.38Å; K160-D342 IonicContact NZ-OD2 2.79Å; K160-D342 PolarHBondContact NZ-OD2 3.36Å
161	S	97.9	Very high	97.3	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.021	15%	0.152	C	C	.	.			trans	-137.7	-179.3	173.4	-165.9	0	0	0	0	109.9	I159 R169 L192 K234 D257	I159-S161 PolarHBondContact O-N 2.91Å; S161-R169 PolarHBondContact OG-NH1 3.43Å; S161-L192 PolarHBondContact N-O 3.1Å; S161-L192 VanDerWaalsContact N-O 3.08Å; S161-K234 PolarHBondContact O-NZ 3.03Å; S161-D257 WeakPolarHBondContact CA-OD2 3.41Å; S161-D257 VanDerWaalsContact CB-OD2 3.32Å; S161-D257 WeakPolarHBondContact CB-OD2 3.32Å; S161-D257 PolarHBondContact OG-OD2 2.83Å
162	V	97.1	Very high	97.7	Very high	50 Å²	50	28.4 Å²	28.4	30%	0.303	14%	0.143	S	C	.	.			trans	-130	156.7	171.6	-58.6	0	0	0	0	109.2	T164 Q165 R169 L193	V162-T164 PolarHBondContact O-N 3.23Å; V162-Q165 HydrophobicContact CG2-CB 4.23Å; V162-Q165 HydrophobicContact CG2-CG 3.41Å; V162-Q165 VanDerWaalsContact CG2-CG 3.41Å; V162-Q165 PolarHBondContact O-N 2.91Å; V162-R169 PolarHBondContact O-NH1 3.43Å; V162-L193 VanDerWaalsContact C-CD2 3.43Å
163	A	96.3	Very high	97.9	Very high	3 Å²	3	23.1 Å²	23.1	3%	0.025	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-44.9	-171.7	0	0	0	0	0	113.2	Q165 H166 R169 P196 V209	A163-Q165 VanDerWaalsContact C-N 3.35Å; A163-Q165 PolarHBondContact O-N 3.32Å; A163-H166 PolarHBondContact O-CD2 3.24Å; A163-H166 PolarHBondContact O-CE1 3.07Å; A163-H166 PolarHBondContact O-NE2 2.86Å; A163-R169 PolarHBondContact O-NH2 3.48Å; A163-P196 HydrophobicContact CB-CB 4.29Å; A163-P196 HydrophobicContact CB-CG 3.74Å; A163-V209 HydrophobicContact CB-CG2 3.74Å
164	T	95.5	Very high	98	Very high	68 Å²	68	28.8 Å²	28.8	42%	0.417	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.2	-175	56.2	0	0	0	0	115.9	V162 H166	V162-T164 PolarHBondContact O-N 3.23Å; T164-H166 VanDerWaalsContact C-N 3.27Å; T164-H166 PolarHBondContact O-N 3.08Å; T164-H166 VanDerWaalsContact O-N 3.13Å
165	Q	97	Very high	98	Very high	51 Å²	51	27.6 Å²	27.6	24%	0.238	14%	0.137	C	C	.	.			trans	-89.5	48.8	-175.6	-62.5	-67.4	-13.5	0	0	112.9	V162 A163 D167 R168 R169 D257	V162-Q165 HydrophobicContact CG2-CB 4.23Å; V162-Q165 HydrophobicContact CG2-CG 3.41Å; V162-Q165 VanDerWaalsContact CG2-CG 3.41Å; V162-Q165 PolarHBondContact O-N 2.91Å; A163-Q165 VanDerWaalsContact C-N 3.35Å; A163-Q165 PolarHBondContact O-N 3.32Å; Q165-D167 VanDerWaalsContact C-N 3.3Å; Q165-D167 PolarHBondContact O-N 3.43Å; Q165-R168 HydrophobicContact CB-CB 4.22Å; Q165-R168 HydrophobicContact CB-CG 4.21Å; Q165-R168 PolarHBondContact O-N 3.37Å; Q165-R168 VanDerWaalsContact OE1-CD 3.31Å; Q165-R169 PolarHBondContact O-N 2.87Å; Q165-R169 PolarHBondContact O-NH1 3.18Å; Q165-D257 WeakPolarHBondContact CB-OD2 3.08Å
166	H	96.6	Very high	98	Very high	47 Å²	47	27.7 Å²	27.7	22%	0.218	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-37.8	-179.7	-57.8	-81.3	0	0	0	112.4	A163 T164 R169 E170 E212	A163-H166 PolarHBondContact O-CD2 3.24Å; A163-H166 PolarHBondContact O-CE1 3.07Å; A163-H166 PolarHBondContact O-NE2 2.86Å; T164-H166 VanDerWaalsContact C-N 3.27Å; T164-H166 PolarHBondContact O-N 3.08Å; T164-H166 VanDerWaalsContact O-N 3.13Å; H166-R169 PolarHBondContact CE1-NH2 3.19Å; H166-R169 PolarHBondContact ND1-NH2 2.96Å; H166-R169 PolarHBondContact O-N 2.67Å; H166-E170 VanDerWaalsContact O-CB 3.3Å; H166-E170 WeakPolarHBondContact O-CB 3.42Å; H166-E170 PolarHBondContact O-N 2.96Å; H166-E212 IonicContact CE1-OE2 3.78Å; H166-E212 IonicContact CG-OE2 2.77Å; H166-E212 IonicContact ND1-OE2 3.71Å; H166-E212 PolarHBondContact ND1-OE2 2.92Å
167	D	97.5	Very high	98	Very high	85 Å²	85	27.8 Å²	27.8	46%	0.455	14%	0.138	S	C	.	.	H	α-helix	trans	-67	-38.3	-179.6	63.4	-24.4	0	0	0	112.7	Q165 E170 V171 P394	Q165-D167 VanDerWaalsContact C-N 3.3Å; Q165-D167 PolarHBondContact O-N 3.43Å; D167-E170 PolarHBondContact O-N 3.2Å; D167-V171 WeakPolarHBondContact O-CG2 3Å; D167-V171 PolarHBondContact O-N 3.15Å; D167-P394 HydrophobicContact CB-CG 4.46Å
168	R	98.4	Very high	97.9	Very high	43 Å²	43	33.6 Å²	33.6	16%	0.162	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-51.2	173	-64.9	-173	-177.2	-162.3	-9.2	111	Q165 E170 V171 I172 D257 D258 P394	Q165-R168 HydrophobicContact CB-CB 4.22Å; Q165-R168 HydrophobicContact CB-CG 4.21Å; Q165-R168 PolarHBondContact O-N 3.37Å; Q165-R168 VanDerWaalsContact OE1-CD 3.31Å; R168-E170 VanDerWaalsContact C-N 3.3Å; R168-E170 PolarHBondContact O-N 3.44Å; R168-V171 PolarHBondContact O-N 3.36Å; R168-I172 VanDerWaalsContact O-CG1 3.24Å; R168-I172 WeakPolarHBondContact O-CG1 3.25Å; R168-I172 PolarHBondContact O-N 3.42Å; R168-D257 HydrophobicContact CB-CB 4.13Å; R168-D257 WeakPolarHBondContact CD-OD1 3.16Å; R168-D257 IonicContact CZ-OD1 3.36Å; R168-D257 IonicContact NE-OD1 3.23Å; R168-D257 IonicContact NH1-OD1 2.67Å; R168-D257 PolarHBondContact NH1-OD1 2.87Å; R168-D258 IonicContact NH1-OD2 2.84Å; R168-P394 HydrophobicContact CG-CG 3.74Å
169	R	98.6	Very high	97.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.7	-43.7	177.9	-65.3	-166.9	-69.6	-82.5	8.2	111.4	S161 V162 A163 Q165 H166 V171 I172 R173 F191 E212	S161-R169 PolarHBondContact OG-NH1 3.43Å; V162-R169 PolarHBondContact O-NH1 3.43Å; A163-R169 PolarHBondContact O-NH2 3.48Å; Q165-R169 PolarHBondContact O-N 2.87Å; Q165-R169 PolarHBondContact O-NH1 3.18Å; H166-R169 PolarHBondContact CE1-NH2 3.19Å; H166-R169 PolarHBondContact ND1-NH2 2.96Å; H166-R169 PolarHBondContact O-N 2.67Å; R169-V171 PolarHBondContact O-N 3.3Å; R169-I172 WeakPolarHBondContact O-CB 3.42Å; R169-I172 PolarHBondContact O-N 2.99Å; R169-R173 WeakPolarHBondContact O-CG 2.95Å; R169-R173 PolarHBondContact O-N 3.29Å; R169-F191 HydrophobicContact CB-CD1 4.24Å; R169-F191 HydrophobicContact CB-CE1 3.92Å; R169-F191 HydrophobicContact CB-CE2 4.24Å; R169-F191 HydrophobicContact CB-CZ 3.92Å; R169-F191 HydrophobicContact CG-CD1 3.55Å; R169-F191 HydrophobicContact CG-CD2 4.4Å; R169-F191 HydrophobicContact CG-CE1 3.68Å; R169-F191 HydrophobicContact CG-CG 3.94Å; R169-F191 HydrophobicContact CG-CZ 4.16Å; R169-E212 IonicContact CZ-OE1 3.63Å; R169-E212 IonicContact CZ-OE2 2.73Å; R169-E212 IonicContact NE-OE1 2.76Å; R169-E212 PolarHBondContact NE-OE1 2.8Å; R169-E212 IonicContact NE-OE2 3.53Å; R169-E212 PolarHBondContact NE-OE2 2.87Å; R169-E212 IonicContact NH2-OE1 3.9Å; R169-E212 IonicContact NH2-OE2 3.84Å; R169-E212 PolarHBondContact NH2-OE2 3.22Å
170	E	98.5	Very high	97.8	Very high	46 Å²	46	40.1 Å²	40.1	22%	0.215	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-44.7	178.2	-177.7	60	-164	0	0	113	H166 D167 R168 I172 R173 K174 Y216	H166-E170 VanDerWaalsContact O-CB 3.3Å; H166-E170 WeakPolarHBondContact O-CB 3.42Å; H166-E170 PolarHBondContact O-N 2.96Å; D167-E170 PolarHBondContact O-N 3.2Å; R168-E170 VanDerWaalsContact C-N 3.3Å; R168-E170 PolarHBondContact O-N 3.44Å; E170-I172 VanDerWaalsContact C-N 3.34Å; E170-R173 PolarHBondContact O-N 3.26Å; E170-R173 IonicContact OE2-NH1 2.91Å; E170-K174 HydrophobicContact CG-CD 4.34Å; E170-K174 WeakPolarHBondContact O-CG 3.5Å; E170-K174 PolarHBondContact O-N 3.02Å; E170-K174 VanDerWaalsContact O-N 3.15Å; E170-K174 WeakPolarHBondContact OE1-CE 3.33Å; E170-K174 IonicContact OE1-NZ 3.54Å; E170-K174 PolarHBondContact OE1-NZ 3.27Å; E170-Y216 PolarHBondContact OE1-OH 3.34Å; E170-Y216 VanDerWaalsContact OE2-CZ 3.31Å; E170-Y216 PolarHBondContact OE2-OH 2.94Å
171	V	98.5	Very high	97.8	Very high	20 Å²	20	44.2 Å²	44.2	12%	0.121	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-38.5	175.6	171.9	0	0	0	0	111.1	D167 R168 R169 K174 T175 P394 L397 M398	D167-V171 WeakPolarHBondContact O-CG2 3Å; D167-V171 PolarHBondContact O-N 3.15Å; R168-V171 PolarHBondContact O-N 3.36Å; R169-V171 PolarHBondContact O-N 3.3Å; V171-K174 CarbonylContact O-C 3.57Å; V171-K174 PolarHBondContact O-N 2.93Å; V171-T175 HydrophobicContact CG1-CG2 4.14Å; V171-T175 WeakPolarHBondContact O-CB 3.47Å; V171-T175 WeakPolarHBondContact O-CG2 3.46Å; V171-T175 PolarHBondContact O-N 2.96Å; V171-T175 PolarHBondContact O-OG1 2.92Å; V171-P394 HydrophobicContact CB-CB 4.43Å; V171-P394 HydrophobicContact CG2-CB 3.82Å; V171-L397 HydrophobicContact CG1-CB 4.1Å; V171-L397 HydrophobicContact CG1-CD2 3.67Å; V171-L397 HydrophobicContact CG1-CG 3.85Å; V171-M398 HydrophobicContact CG1-CB 4.16Å; V171-M398 HydrophobicContact CG1-SD 4.17Å
172	I	98.8	Very high	97.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-47.4	176.2	-69.7	170.2	0	0	0	110.7	I159 R168 R169 E170 K174 T175 W176 G177 F191 D257 L397	I159-I172 HydrophobicContact CG2-CD1 4.1Å; R168-I172 VanDerWaalsContact O-CG1 3.24Å; R168-I172 WeakPolarHBondContact O-CG1 3.25Å; R168-I172 PolarHBondContact O-N 3.42Å; R169-I172 WeakPolarHBondContact O-CB 3.42Å; R169-I172 PolarHBondContact O-N 2.99Å; E170-I172 VanDerWaalsContact C-N 3.34Å; I172-K174 PolarHBondContact O-N 3.32Å; I172-T175 CarbonylContact O-C 3.49Å; I172-T175 PolarHBondContact O-N 3.21Å; I172-W176 HydrophobicContact CB-CZ2 4.27Å; I172-W176 HydrophobicContact CD1-CH2 3.86Å; I172-W176 HydrophobicContact CD1-CZ2 3.51Å; I172-W176 HydrophobicContact CG1-CH2 4.08Å; I172-W176 HydrophobicContact CG1-CZ2 3.45Å; I172-W176 VanDerWaalsContact CG1-CZ2 3.45Å; I172-W176 HydrophobicContact CG2-CD2 4.16Å; I172-W176 HydrophobicContact CG2-CE3 4.04Å; I172-W176 HydrophobicContact CG2-CH2 3.76Å; I172-W176 HydrophobicContact CG2-CZ2 3.88Å; I172-W176 HydrophobicContact CG2-CZ3 3.83Å; I172-G177 CarbonylContact O-C 3.57Å; I172-G177 VanDerWaalsContact O-CA 3.28Å; I172-G177 WeakPolarHBondContact O-CA 3.43Å; I172-G177 PolarHBondContact O-N 3.03Å; I172-F191 HydrophobicContact CB-CE1 4.22Å; I172-F191 HydrophobicContact CB-CZ 4.1Å; I172-F191 HydrophobicContact CD1-CE1 4.12Å; I172-F191 HydrophobicContact CG2-CE1 3.96Å; I172-F191 HydrophobicContact CG2-CZ 3.79Å; I172-D257 HydrophobicContact CD1-CB 3.95Å; I172-L397 HydrophobicContact CG1-CD2 4.23Å
173	R	98.6	Very high	97.5	Very high	28 Å²	28	50.3 Å²	50.3	11%	0.106	25%	0.252	C	S	.	.	H	α-helix	trans	-57.2	-36.6	175.6	-70.4	-180	-171	108.4	3.5	112.8	R169 E170 T175 K178 F191 E212 D218	R169-R173 WeakPolarHBondContact O-CG 2.95Å; R169-R173 PolarHBondContact O-N 3.29Å; E170-R173 PolarHBondContact O-N 3.26Å; E170-R173 IonicContact OE2-NH1 2.91Å; R173-T175 VanDerWaalsContact C-N 3.34Å; R173-K178 WeakPolarHBondContact O-CA 3.28Å; R173-K178 WeakPolarHBondContact O-CB 3.49Å; R173-F191 HydrophobicContact CG-CE2 4.07Å; R173-F191 HydrophobicContact CG-CZ 4.26Å; R173-E212 IonicContact CZ-OE1 2.64Å; R173-E212 VanDerWaalsContact CZ-OE1 3.22Å; R173-E212 IonicContact NH1-OE1 3.98Å; R173-E212 PolarHBondContact NH1-OE1 3.35Å; R173-E212 IonicContact NH2-OE1 3.46Å; R173-E212 PolarHBondContact NH2-OE1 3.47Å; R173-D218 IonicContact CZ-OD1 2.6Å; R173-D218 IonicContact CZ-OD2 2.75Å; R173-D218 IonicContact NE-OD1 2.68Å; R173-D218 IonicContact NE-OD2 3.84Å; R173-D218 PolarHBondContact NE-OD2 2.92Å; R173-D218 IonicContact NH2-OD1 2.8Å; R173-D218 PolarHBondContact NH2-OD1 3.39Å; R173-D218 IonicContact NH2-OD2 2.76Å; R173-D218 PolarHBondContact NH2-OD2 3Å
174	K	98.3	Very high	97.5	Very high	120 Å²	120	53.5 Å²	53.5	52%	0.522	29%	0.285	S	S	.	.	H	α-helix	trans	-80.1	-12.5	179	-76.4	169.9	164.7	153.8	0	114.3	E170 V171 I172 M398	E170-K174 HydrophobicContact CG-CD 4.34Å; E170-K174 WeakPolarHBondContact O-CG 3.5Å; E170-K174 PolarHBondContact O-N 3.02Å; E170-K174 VanDerWaalsContact O-N 3.15Å; E170-K174 WeakPolarHBondContact OE1-CE 3.33Å; E170-K174 IonicContact OE1-NZ 3.54Å; E170-K174 PolarHBondContact OE1-NZ 3.27Å; V171-K174 CarbonylContact O-C 3.57Å; V171-K174 PolarHBondContact O-N 2.93Å; I172-K174 PolarHBondContact O-N 3.32Å; K174-M398 HydrophobicContact CB-CE 4.26Å; K174-M398 HydrophobicContact CB-SD 4.42Å
175	T	98.5	Very high	97.5	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.031	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-116.3	-173.8	60	0	0	0	0	110.9	V171 I172 R173 G177 K178 M398 W401	V171-T175 HydrophobicContact CG1-CG2 4.14Å; V171-T175 WeakPolarHBondContact O-CB 3.47Å; V171-T175 WeakPolarHBondContact O-CG2 3.46Å; V171-T175 PolarHBondContact O-N 2.96Å; V171-T175 PolarHBondContact O-OG1 2.92Å; I172-T175 CarbonylContact O-C 3.49Å; I172-T175 PolarHBondContact O-N 3.21Å; R173-T175 VanDerWaalsContact C-N 3.34Å; T175-G177 VanDerWaalsContact C-N 3.33Å; T175-G177 PolarHBondContact O-N 3.32Å; T175-K178 WeakPolarHBondContact O-CB 3.38Å; T175-K178 PolarHBondContact O-N 2.92Å; T175-M398 HydrophobicContact CG2-SD 3.47Å; T175-M398 WeakPolarHBondContact CG2-SD 3.41Å; T175-W401 HydrophobicContact CG2-CB 3.77Å; T175-W401 HydrophobicContact CG2-CD2 4.2Å; T175-W401 HydrophobicContact CG2-CG 3.55Å
176	W	98.1	Very high	97.6	Very high	3 Å²	3	53.9 Å²	53.9	1%	0.011	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-18.1	-171	56.4	-100.8	0	0	0	114.2	M157 I159 I172 K178 F253 V259 V261 V263 W401	M157-W176 HydrophobicContact CE-CE3 3.8Å; M157-W176 HydrophobicContact CE-CZ3 3.87Å; I159-W176 HydrophobicContact CD1-CH2 4.27Å; I159-W176 HydrophobicContact CD1-CZ3 3.97Å; I159-W176 HydrophobicContact CG1-CH2 3.55Å; I159-W176 HydrophobicContact CG1-CZ3 3.79Å; I172-W176 HydrophobicContact CB-CZ2 4.27Å; I172-W176 HydrophobicContact CD1-CH2 3.86Å; I172-W176 HydrophobicContact CD1-CZ2 3.51Å; I172-W176 HydrophobicContact CG1-CH2 4.08Å; I172-W176 HydrophobicContact CG1-CZ2 3.45Å; I172-W176 VanDerWaalsContact CG1-CZ2 3.45Å; I172-W176 HydrophobicContact CG2-CD2 4.16Å; I172-W176 HydrophobicContact CG2-CE3 4.04Å; I172-W176 HydrophobicContact CG2-CH2 3.76Å; I172-W176 HydrophobicContact CG2-CZ2 3.88Å; I172-W176 HydrophobicContact CG2-CZ3 3.83Å; W176-K178 VanDerWaalsContact C-N 3.33Å; W176-F253 HydrophobicContact CZ3-CE1 4.35Å; W176-V259 HydrophobicContact CH2-CG2 4.47Å; W176-V259 HydrophobicContact CZ2-CG2 4.15Å; W176-V259 PolarHBondContact NE1-O 2.9Å; W176-V261 HydrophobicContact CB-CB 4.21Å; W176-V261 WeakPolarHBondContact CB-O 3.13Å; W176-V261 HydrophobicContact CD2-CB 3.74Å; W176-V261 HydrophobicContact CD2-CG2 3.79Å; W176-V261 HydrophobicContact CE3-CB 3.78Å; W176-V261 HydrophobicContact CE3-CG2 3.74Å; W176-V261 HydrophobicContact CG-CB 3.96Å; W176-V261 HydrophobicContact CG-CG2 4.44Å; W176-V261 HydrophobicContact CH2-CG2 3.96Å; W176-V261 HydrophobicContact CZ2-CG2 4Å; W176-V261 HydrophobicContact CZ3-CB 4.36Å; W176-V261 HydrophobicContact CZ3-CG2 3.84Å; W176-V263 HydrophobicContact CB-CG2 4.41Å; W176-V263 WeakPolarHBondContact O-CG2 3.18Å; W176-W401 HydrophobicContact CB-CE3 4.09Å; W176-W401 HydrophobicContact CB-CH2 3.88Å; W176-W401 HydrophobicContact CB-CZ3 3.53Å
177	G	98.1	Very high	97.7	Very high	2 Å²	2	51.7 Å²	51.7	2%	0.021	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	7.9	175.7	0	0	0	0	0	113.7	I172 T175 E179 T189	I172-G177 CarbonylContact O-C 3.57Å; I172-G177 VanDerWaalsContact O-CA 3.28Å; I172-G177 WeakPolarHBondContact O-CA 3.43Å; I172-G177 PolarHBondContact O-N 3.03Å; T175-G177 VanDerWaalsContact C-N 3.33Å; T175-G177 PolarHBondContact O-N 3.32Å; G177-E179 PolarHBondContact O-N 3.4Å; G177-T189 WeakPolarHBondContact O-CB 3.37Å; G177-T189 PolarHBondContact O-OG1 2.82Å
178	K	98.1	Very high	97.7	Very high	121 Å²	121	50.2 Å²	50.2	53%	0.526	26%	0.257	S	S	.	.			trans	-61.9	123.5	177.1	-175.8	-177.4	176.3	-173.5	0	110.3	R173 T175 W176 Q180	R173-K178 WeakPolarHBondContact O-CA 3.28Å; R173-K178 WeakPolarHBondContact O-CB 3.49Å; T175-K178 WeakPolarHBondContact O-CB 3.38Å; T175-K178 PolarHBondContact O-N 2.92Å; W176-K178 VanDerWaalsContact C-N 3.33Å; K178-Q180 PolarHBondContact O-N 3.5Å
179	E	97.7	Very high	97.7	Very high	63 Å²	63	48.2 Å²	48.2	29%	0.294	25%	0.249	S	C	.	.			trans	-64.5	131.5	172.8	-60.6	-163.7	165.4	0	0	110.8	K148 G177 K188 T189	K148-E179 WeakPolarHBondContact CE-OE1 3.24Å; K148-E179 IonicContact NZ-OE1 2.73Å; K148-E179 PolarHBondContact NZ-OE1 3.42Å; K148-E179 IonicContact NZ-OE2 3.77Å; G177-E179 PolarHBondContact O-N 3.4Å; E179-K188 HydrophobicContact CG-CD 4.22Å; E179-K188 WeakPolarHBondContact OE1-CD 3.48Å; E179-K188 WeakPolarHBondContact OE2-CD 3.01Å; E179-K188 IonicContact OE2-NZ 2.82Å; E179-K188 PolarHBondContact OE2-NZ 2.88Å; E179-T189 PolarHBondContact OE1-N 3.25Å
180	Q	97.3	Very high	97.7	Very high	75 Å²	75	48.2 Å²	48.2	35%	0.35	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	170.9	-175.3	60	-176.1	11.3	0	0	112.1	K178 V182 I187	K178-Q180 PolarHBondContact O-N 3.5Å; Q180-V182 HydrophobicContact CG-CG2 3.99Å; Q180-I187 HydrophobicContact CG-CD1 4.05Å; Q180-I187 PolarHBondContact N-O 3.02Å; Q180-I187 PolarHBondContact O-N 3.42Å
181	V	97.6	Very high	97.8	Very high	95 Å²	95	46 Å²	46	58%	0.576	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.7	169.2	-177	0	0	0	0	107.6	K185 R186	V181-K185 WeakPolarHBondContact CA-O 3.47Å; V181-R186 HydrophobicContact CG2-CB 4.4Å; V181-R186 HydrophobicContact CG2-CG 4.41Å
182	V	96	Very high	97.8	Very high	44 Å²	44	45 Å²	45	27%	0.267	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	119.6	179.1	-178.8	0	0	0	0	107.7	Q180 G184 K185 I187 L267	Q180-V182 HydrophobicContact CG-CG2 3.99Å; V182-G184 VanDerWaalsContact C-N 3.25Å; V182-G184 PolarHBondContact O-N 3.23Å; V182-K185 PolarHBondContact N-O 2.98Å; V182-K185 WeakPolarHBondContact O-CA 3.5Å; V182-K185 WeakPolarHBondContact O-CB 3.42Å; V182-K185 PolarHBondContact O-N 3.03Å; V182-I187 HydrophobicContact CG2-CD1 4.2Å; V182-L267 HydrophobicContact CB-CD1 3.75Å; V182-L267 HydrophobicContact CG1-CD1 3.74Å; V182-L267 HydrophobicContact CG2-CD1 4.39Å
183	D	94.1	Very high	97.7	Very high	138 Å²	138	45 Å²	45	74%	0.738	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	44.3	-177.5	-54.9	-37.2	0	0	0	113.6	K185	D183-K185 PolarHBondContact O-N 3.31Å
184	G	95.3	Very high	97.7	Very high	69 Å²	69	43.7 Å²	43.7	71%	0.711	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.2	-5.9	-176.9	0	0	0	0	0	115.1	V182 R186	V182-G184 VanDerWaalsContact C-N 3.25Å; V182-G184 PolarHBondContact O-N 3.23Å; G184-R186 PolarHBondContact O-N 3.46Å
185	K	96.5	Very high	97.5	Very high	30 Å²	30	38.7 Å²	38.7	13%	0.13	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	109.6	179.1	-53.8	-178.8	-173	83.1	0	110.2	Y154 V181 V182 D183 L267 E271	Y154-K185 HydrophobicContact CD1-CB 3.84Å; Y154-K185 HydrophobicContact CD1-CD 3.77Å; Y154-K185 HydrophobicContact CD1-CG 4.12Å; Y154-K185 HydrophobicContact CD2-CB 4.4Å; Y154-K185 HydrophobicContact CD2-CD 4.29Å; Y154-K185 HydrophobicContact CD2-CG 4.19Å; Y154-K185 HydrophobicContact CE1-CD 3.61Å; Y154-K185 HydrophobicContact CE1-CG 4.41Å; Y154-K185 HydrophobicContact CE2-CD 4.15Å; Y154-K185 HydrophobicContact CE2-CG 4.45Å; Y154-K185 HydrophobicContact CG-CB 3.75Å; Y154-K185 HydrophobicContact CG-CD 4.1Å; Y154-K185 HydrophobicContact CG-CG 3.99Å; V181-K185 WeakPolarHBondContact CA-O 3.47Å; V182-K185 PolarHBondContact N-O 2.98Å; V182-K185 WeakPolarHBondContact O-CA 3.5Å; V182-K185 WeakPolarHBondContact O-CB 3.42Å; V182-K185 PolarHBondContact O-N 3.03Å; D183-K185 PolarHBondContact O-N 3.31Å; K185-L267 HydrophobicContact CD-CD2 3.94Å; K185-E271 WeakPolarHBondContact CE-OE1 3.48Å; K185-E271 IonicContact NZ-OE1 2.74Å; K185-E271 PolarHBondContact NZ-OE1 3.37Å
186	R	98	Very high	97.2	Very high	97 Å²	97	38.8 Å²	38.8	37%	0.366	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.5	178.2	-174.8	-176.8	-60.9	177.1	0.7	111.2	T150 E152 Y154 L155 V181 G184 K188	T150-R186 PolarHBondContact O-NH1 2.73Å; E152-R186 WeakPolarHBondContact O-CD 3.37Å; E152-R186 PolarHBondContact O-NE 3.09Å; Y154-R186 PolarHBondContact N-O 3.47Å; L155-R186 PolarHBondContact N-O 3.24Å; V181-R186 HydrophobicContact CG2-CB 4.4Å; V181-R186 HydrophobicContact CG2-CG 4.41Å; G184-R186 PolarHBondContact O-N 3.46Å; R186-K188 HydrophobicContact CG-CG 4.5Å
187	I	98.5	Very high	96.5	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.7	178.2	-57.3	154.5	0	0	0	109.3	L155 M157 Q180 V182 V263 L267	L155-I187 HydrophobicContact CB-CG1 4.18Å; L155-I187 HydrophobicContact CD2-CG1 4.49Å; L155-I187 HydrophobicContact CD2-CG2 4.4Å; L155-I187 WeakPolarHBondContact O-CA 3.25Å; M157-I187 HydrophobicContact CG-CG2 3.84Å; Q180-I187 HydrophobicContact CG-CD1 4.05Å; Q180-I187 PolarHBondContact N-O 3.02Å; Q180-I187 PolarHBondContact O-N 3.42Å; V182-I187 HydrophobicContact CG2-CD1 4.2Å; I187-V263 HydrophobicContact CD1-CG1 3.54Å; I187-L267 HydrophobicContact CD1-CD1 4.26Å
188	K	98.4	Very high	95.8	Very high	54 Å²	54	45.4 Å²	45.4	24%	0.235	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	155.8	179.2	-70.7	-66.8	-176	172.8	0	110.6	I153 L155 L156 M157 E179 R186	I153-K188 HydrophobicContact CD1-CG 4.09Å; I153-K188 HydrophobicContact CG1-CG 4.18Å; I153-K188 HydrophobicContact CG2-CB 4.33Å; I153-K188 HydrophobicContact CG2-CG 4.33Å; L155-K188 PolarHBondContact O-N 2.92Å; L155-K188 VanDerWaalsContact O-N 3.07Å; L156-K188 HydrophobicContact CD1-CB 3.84Å; M157-K188 WeakPolarHBondContact CB-O 3.5Å; M157-K188 PolarHBondContact N-O 3.37Å; E179-K188 HydrophobicContact CG-CD 4.22Å; E179-K188 WeakPolarHBondContact OE1-CD 3.48Å; E179-K188 WeakPolarHBondContact OE2-CD 3.01Å; E179-K188 IonicContact OE2-NZ 2.82Å; E179-K188 PolarHBondContact OE2-NZ 2.88Å; R186-K188 HydrophobicContact CG-CG 4.5Å
189	T	98.7	Very high	95	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138.9	-176.7	-57.3	0	0	0	0	111	M157 I159 G177 E179 F191	M157-T189 HydrophobicContact CB-CG2 4.24Å; M157-T189 CarbonylContact O-C 3.59Å; M157-T189 WeakPolarHBondContact O-CA 3.35Å; I159-T189 HydrophobicContact CD1-CG2 3.85Å; G177-T189 WeakPolarHBondContact O-CB 3.37Å; G177-T189 PolarHBondContact O-OG1 2.82Å; E179-T189 PolarHBondContact OE1-N 3.25Å; T189-F191 HydrophobicContact CG2-CE2 4.15Å; T189-F191 HydrophobicContact CG2-CZ 4.17Å
190	L	98.8	Very high	94.5	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.4	174.4	-71.4	170.3	0	0	0	110	K148 L156 M157 V158 I159 D218 L220 W241	K148-L190 HydrophobicContact CB-CD2 4.13Å; K148-L190 HydrophobicContact CG-CD2 3.91Å; L156-L190 HydrophobicContact CD1-CD1 3.95Å; L156-L190 HydrophobicContact CD1-CG 4.27Å; L156-L190 HydrophobicContact CD2-CD1 4.17Å; L156-L190 HydrophobicContact CG-CD1 4.46Å; M157-L190 PolarHBondContact O-N 2.89Å; V158-L190 WeakPolarHBondContact CA-O 3.46Å; I159-L190 PolarHBondContact N-O 2.9Å; L190-D218 WeakPolarHBondContact CA-O 3.35Å; L190-L220 HydrophobicContact CD1-CD1 4.05Å; L190-L220 HydrophobicContact CD2-CD2 4.5Å; L190-L220 HydrophobicContact CD2-CG 4.29Å; L190-W241 HydrophobicContact CD1-CH2 3.56Å; L190-W241 HydrophobicContact CD1-CZ3 3.57Å
191	F	98.9	Very high	94	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137.9	171.8	-60.9	-83.4	0	0	0	110.6	I159 R169 I172 R173 T189 D218 L219 L220	I159-F191 HydrophobicContact CB-CD1 3.61Å; I159-F191 HydrophobicContact CB-CE1 3.85Å; I159-F191 HydrophobicContact CG1-CD1 4.42Å; I159-F191 HydrophobicContact CG1-CE1 4.2Å; I159-F191 HydrophobicContact CG2-CD1 3.75Å; I159-F191 HydrophobicContact CG2-CE1 3.87Å; I159-F191 CarbonylContact O-C 3.56Å; I159-F191 WeakPolarHBondContact O-CA 3.49Å; R169-F191 HydrophobicContact CB-CD1 4.24Å; R169-F191 HydrophobicContact CB-CE1 3.92Å; R169-F191 HydrophobicContact CB-CE2 4.24Å; R169-F191 HydrophobicContact CB-CZ 3.92Å; R169-F191 HydrophobicContact CG-CD1 3.55Å; R169-F191 HydrophobicContact CG-CD2 4.4Å; R169-F191 HydrophobicContact CG-CE1 3.68Å; R169-F191 HydrophobicContact CG-CG 3.94Å; R169-F191 HydrophobicContact CG-CZ 4.16Å; I172-F191 HydrophobicContact CB-CE1 4.22Å; I172-F191 HydrophobicContact CB-CZ 4.1Å; I172-F191 HydrophobicContact CD1-CE1 4.12Å; I172-F191 HydrophobicContact CG2-CE1 3.96Å; I172-F191 HydrophobicContact CG2-CZ 3.79Å; R173-F191 HydrophobicContact CG-CE2 4.07Å; R173-F191 HydrophobicContact CG-CZ 4.26Å; T189-F191 HydrophobicContact CG2-CE2 4.15Å; T189-F191 HydrophobicContact CG2-CZ 4.17Å; F191-D218 PolarHBondContact N-O 3.43Å; F191-L219 HydrophobicContact CB-CD2 3.74Å; F191-L219 HydrophobicContact CD2-CD2 4Å; F191-L219 HydrophobicContact CG-CD2 4.22Å; F191-L220 PolarHBondContact O-N 3.02Å
192	L	98.8	Very high	93.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.7	-178.6	-51.8	-175.1	0	0	0	110.6	V158 I159 S161 L220 W222 K234 F238	V158-L192 HydrophobicContact CG1-CD1 3.5Å; V158-L192 HydrophobicContact CG1-CD2 3.81Å; V158-L192 HydrophobicContact CG1-CG 3.65Å; I159-L192 PolarHBondContact O-N 3.36Å; S161-L192 PolarHBondContact N-O 3.1Å; S161-L192 VanDerWaalsContact N-O 3.08Å; L192-L220 HydrophobicContact CD2-CB 4.12Å; L192-L220 HydrophobicContact CD2-CD1 4.01Å; L192-L220 HydrophobicContact CD2-CG 4.48Å; L192-W222 HydrophobicContact CB-CZ3 4.28Å; L192-W222 HydrophobicContact CD2-CH2 3.92Å; L192-W222 HydrophobicContact CD2-CZ3 3.93Å; L192-K234 HydrophobicContact CB-CD 3.75Å; L192-K234 HydrophobicContact CB-CG 3.63Å; L192-K234 HydrophobicContact CD1-CG 4.04Å; L192-F238 HydrophobicContact CD1-CB 3.64Å; L192-F238 HydrophobicContact CD1-CD2 4.29Å; L192-F238 HydrophobicContact CD1-CG 3.9Å; L192-F238 HydrophobicContact CD2-CB 4.24Å; L192-F238 HydrophobicContact CD2-CD2 3.95Å; L192-F238 HydrophobicContact CD2-CG 4.35Å
193	L	98.4	Very high	93.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.8	-176.6	-61.2	177.3	0	0	0	111.5	V162 V209 L219 L220 Q221 W222	V162-L193 VanDerWaalsContact C-CD2 3.43Å; L193-V209 HydrophobicContact CD1-CG1 3.93Å; L193-V209 HydrophobicContact CD1-CG2 4.37Å; L193-L219 HydrophobicContact CD1-CB 4.3Å; L193-L219 HydrophobicContact CD1-CD1 4.04Å; L193-L219 HydrophobicContact CD1-CD2 4.26Å; L193-L219 HydrophobicContact CD1-CG 4.45Å; L193-L220 PolarHBondContact N-O 3.39Å; L193-Q221 HydrophobicContact CB-CB 4.23Å; L193-Q221 HydrophobicContact CB-CG 4Å; L193-Q221 WeakPolarHBondContact O-CA 3.41Å; L193-W222 PolarHBondContact O-N 3.49Å; L193-W222 VanDerWaalsContact O-N 3.15Å
194	G	97.1	Very high	93.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-170.3	155.3	0	0	0	0	0	111.2	Q221 F224 D226	G194-Q221 PolarHBondContact O-NE2 3.08Å; G194-F224 CarbonylContact C-O 3.57Å; G194-F224 WeakPolarHBondContact CA-O 3.4Å; G194-D226 PolarHBondContact N-OD2 3.33Å
195	T	94.8	Very high	93.3	Very high	14 Å²	14	47.6 Å²	47.6	9%	0.086	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	148.2	171.3	59.3	0	0	0	0	111.4	I142 S197 D223 F224 D226	I142-T195 HydrophobicContact CD1-CG2 3.48Å; I142-T195 VanDerWaalsContact CD1-CG2 3.48Å; T195-S197 PolarHBondContact O-N 3.48Å; T195-D223 WeakPolarHBondContact CG2-OD1 3.47Å; T195-F224 PolarHBondContact N-O 3.25Å; T195-F224 VanDerWaalsContact OG1-C 3.3Å; T195-F224 PolarHBondContact OG1-O 3.48Å; T195-F224 VanDerWaalsContact OG1-O 3.07Å; T195-D226 WeakPolarHBondContact O-CB 3.21Å; T195-D226 PolarHBondContact O-N 3.02Å
196	P	91.7	Very high	93.3	Very high	8 Å²	8	47.4 Å²	47.4	5%	0.052	25%	0.247	C	C	.	.			trans	-55.2	134.7	179.8	-22.2	27.8	0	0	0	113.1	A163 R202 H205	A163-P196 HydrophobicContact CB-CB 4.29Å; A163-P196 HydrophobicContact CB-CG 3.74Å; P196-R202 HydrophobicContact CB-CB 4.35Å; P196-R202 HydrophobicContact CB-CG 4.06Å; P196-R202 HydrophobicContact CG-CG 4.02Å; P196-R202 PolarHBondContact O-NE 3.49Å; P196-R202 PolarHBondContact O-NH2 2.88Å; P196-H205 HydrophobicContact CB-CB 4.06Å; P196-H205 HydrophobicContact CG-CB 3.72Å
197	S	82.9	Confident	93.2	Very high	78 Å²	78	49.3 Å²	49.3	55%	0.545	26%	0.257	S	S	.	.	S	Bend	trans	-71.3	-37.2	-177	54.8	0	0	0	0	113.7	T195 V199	T195-S197 PolarHBondContact O-N 3.48Å; S197-V199 PolarHBondContact O-N 3.46Å
198	N	84.8	Confident	93.1	Very high	65 Å²	65	53.6 Å²	53.6	35%	0.348	28%	0.28	S	S	.	.			trans	-73.3	111.7	176.2	-174.3	-14	0	0	0	110.4	E200 E201 R202	N198-E200 PolarHBondContact O-N 2.6Å; N198-E200 PolarHBondContact OD1-N 2.79Å; N198-E200 VanDerWaalsContact OD1-N 3.07Å; N198-E201 HydrophobicContact CB-CB 4.47Å; N198-E201 PolarHBondContact ND2-OE2 2.64Å; N198-R202 WeakPolarHBondContact O-CA 3.45Å; N198-R202 WeakPolarHBondContact O-CB 3.3Å; N198-R202 PolarHBondContact O-N 3.26Å
199	V	81.1	Confident	93.1	Very high	103 Å²	103	51 Å²	51	62%	0.624	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-40.7	-177.5	179.4	0	0	0	0	111.8	S197 R202	S197-V199 PolarHBondContact O-N 3.46Å; V199-R202 WeakPolarHBondContact O-CB 3.49Å; V199-R202 PolarHBondContact O-N 2.9Å
200	E	85.9	Confident	93.1	Very high	179 Å²	179	55.5 Å²	55.5	84%	0.836	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-38.2	-174.4	-62.5	-178	177	0	0	111.7	N198	N198-E200 PolarHBondContact O-N 2.6Å; N198-E200 PolarHBondContact OD1-N 2.79Å; N198-E200 VanDerWaalsContact OD1-N 3.07Å
201	E	87.4	Confident	93	Very high	91 Å²	91	63 Å²	63	43%	0.425	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-1.1	-178.3	-60.9	-178	162.2	0	0	113.2	N198 A203 N204 H205	N198-E201 HydrophobicContact CB-CB 4.47Å; N198-E201 PolarHBondContact ND2-OE2 2.64Å; E201-A203 VanDerWaalsContact C-N 3.3Å; E201-A203 PolarHBondContact O-N 3.46Å; E201-N204 PolarHBondContact O-N 3.13Å; E201-H205 VanDerWaalsContact CB-CD2 3.43Å; E201-H205 WeakPolarHBondContact CB-CD2 3.46Å; E201-H205 WeakPolarHBondContact CB-NE2 3.16Å; E201-H205 PolarHBondContact O-CD2 3.47Å; E201-H205 VanDerWaalsContact O-CD2 3.29Å; E201-H205 PolarHBondContact O-N 3.29Å; E201-H205 IonicContact OE2-CD2 2.8Å; E201-H205 IonicContact OE2-CE1 3.87Å; E201-H205 IonicContact OE2-NE2 3.22Å; E201-H205 PolarHBondContact OE2-NE2 2.77Å
202	R	89.3	Confident	93	Very high	82 Å²	82	63.5 Å²	63.5	31%	0.309	32%	0.321	S	S	.	.	H	α-helix	trans	-53.5	-46.4	-172.7	-176.2	176.2	-66.3	151.3	3.1	112.3	P196 N198 V199 N204 H205 Q206 L225	P196-R202 HydrophobicContact CB-CB 4.35Å; P196-R202 HydrophobicContact CB-CG 4.06Å; P196-R202 HydrophobicContact CG-CG 4.02Å; P196-R202 PolarHBondContact O-NE 3.49Å; P196-R202 PolarHBondContact O-NH2 2.88Å; N198-R202 WeakPolarHBondContact O-CA 3.45Å; N198-R202 WeakPolarHBondContact O-CB 3.3Å; N198-R202 PolarHBondContact O-N 3.26Å; V199-R202 WeakPolarHBondContact O-CB 3.49Å; V199-R202 PolarHBondContact O-N 2.9Å; R202-N204 VanDerWaalsContact C-N 3.3Å; R202-N204 PolarHBondContact O-N 3.03Å; R202-H205 PolarHBondContact O-N 2.88Å; R202-Q206 VanDerWaalsContact O-CB 3.22Å; R202-Q206 WeakPolarHBondContact O-CB 3.33Å; R202-Q206 PolarHBondContact O-N 2.86Å; R202-L225 VanDerWaalsContact NH2-CD1 3.27Å
203	A	91.6	Very high	93	Very high	64 Å²	64	64.5 Å²	64.5	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-35.7	-178.9	0	0	0	0	0	112.5	E201 K207	E201-A203 VanDerWaalsContact C-N 3.3Å; E201-A203 PolarHBondContact O-N 3.46Å; A203-K207 WeakPolarHBondContact O-CG 3.34Å; A203-K207 PolarHBondContact O-N 2.91Å
204	N	93.7	Very high	93	Very high	101 Å²	101	73.8 Å²	73.8	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-73.6	-46.6	179.2	-66.9	-26.3	0	0	0	110.9	E201 R202 Q206 K207 L208	E201-N204 PolarHBondContact O-N 3.13Å; R202-N204 VanDerWaalsContact C-N 3.3Å; R202-N204 PolarHBondContact O-N 3.03Å; N204-Q206 VanDerWaalsContact C-N 3.28Å; N204-Q206 PolarHBondContact O-N 3.24Å; N204-K207 PolarHBondContact O-N 2.68Å; N204-L208 PolarHBondContact O-N 2.72Å
205	H	94.4	Very high	93.1	Very high	32 Å²	32	77.7 Å²	77.7	15%	0.148	38%	0.383	C	S	.	.	H	α-helix	trans	-62.3	-37.4	176	-68.5	-47.5	0	0	0	111.8	P196 E201 R202 L208 V209	P196-H205 HydrophobicContact CB-CB 4.06Å; P196-H205 HydrophobicContact CG-CB 3.72Å; E201-H205 VanDerWaalsContact CB-CD2 3.43Å; E201-H205 WeakPolarHBondContact CB-CD2 3.46Å; E201-H205 WeakPolarHBondContact CB-NE2 3.16Å; E201-H205 PolarHBondContact O-CD2 3.47Å; E201-H205 VanDerWaalsContact O-CD2 3.29Å; E201-H205 PolarHBondContact O-N 3.29Å; E201-H205 IonicContact OE2-CD2 2.8Å; E201-H205 IonicContact OE2-CE1 3.87Å; E201-H205 IonicContact OE2-NE2 3.22Å; E201-H205 PolarHBondContact OE2-NE2 2.77Å; R202-H205 PolarHBondContact O-N 2.88Å; H205-L208 PolarHBondContact O-N 3.08Å; H205-V209 WeakPolarHBondContact O-CG2 3.4Å; H205-V209 PolarHBondContact O-N 2.9Å
206	Q	95.9	Very high	93.2	Very high	26 Å²	26	81.1 Å²	81.1	12%	0.121	40%	0.395	C	S	.	.	H	α-helix	trans	-63.3	-43.2	176.5	-173.1	59.7	31.8	0	0	112	R202 N204 L208 V209 E210	R202-Q206 VanDerWaalsContact O-CB 3.22Å; R202-Q206 WeakPolarHBondContact O-CB 3.33Å; R202-Q206 PolarHBondContact O-N 2.86Å; N204-Q206 VanDerWaalsContact C-N 3.28Å; N204-Q206 PolarHBondContact O-N 3.24Å; Q206-L208 VanDerWaalsContact C-N 3.29Å; Q206-L208 PolarHBondContact O-N 2.73Å; Q206-V209 PolarHBondContact O-N 3.41Å; Q206-V209 VanDerWaalsContact O-N 3.17Å; Q206-E210 WeakPolarHBondContact CG-OE1 3.4Å; Q206-E210 WeakPolarHBondContact O-CG 2.92Å; Q206-E210 PolarHBondContact O-N 3.43Å
207	K	96	Very high	93.5	Very high	136 Å²	136	81.5 Å²	81.5	59%	0.591	40%	0.401	S	S	*	.	H	α-helix	trans	-60.1	-37.6	174.7	-73.8	174.7	-178.7	178.8	0	112.8	A203 N204 Y211	A203-K207 WeakPolarHBondContact O-CG 3.34Å; A203-K207 PolarHBondContact O-N 2.91Å; N204-K207 PolarHBondContact O-N 2.68Å; K207-Y211 WeakPolarHBondContact O-CB 3.49Å; K207-Y211 PolarHBondContact O-N 3.39Å
208	L	96.8	Very high	94.3	Very high	92 Å²	92	78.2 Å²	78.2	48%	0.482	38%	0.377	S	S	.	.	H	α-helix	trans	-67.4	-40.5	176.2	-66.7	175	0	0	0	111.7	N204 H205 Q206 Y211 E212	N204-L208 PolarHBondContact O-N 2.72Å; H205-L208 PolarHBondContact O-N 3.08Å; Q206-L208 VanDerWaalsContact C-N 3.29Å; Q206-L208 PolarHBondContact O-N 2.73Å; L208-Y211 PolarHBondContact O-N 2.65Å; L208-E212 WeakPolarHBondContact O-CB 3.46Å; L208-E212 PolarHBondContact O-N 3.29Å
209	V	98.1	Very high	94.9	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-63.5	-43.8	174.4	168.3	0	0	0	0	111.3	L143 A163 L193 H205 Q206 Y211 E212 N213 L219	L143-V209 HydrophobicContact CD1-CG1 3.76Å; A163-V209 HydrophobicContact CB-CG2 3.74Å; L193-V209 HydrophobicContact CD1-CG1 3.93Å; L193-V209 HydrophobicContact CD1-CG2 4.37Å; H205-V209 WeakPolarHBondContact O-CG2 3.4Å; H205-V209 PolarHBondContact O-N 2.9Å; Q206-V209 PolarHBondContact O-N 3.41Å; Q206-V209 VanDerWaalsContact O-N 3.17Å; V209-Y211 PolarHBondContact O-N 3.41Å; V209-E212 PolarHBondContact O-N 3.28Å; V209-N213 WeakPolarHBondContact O-CB 3.36Å; V209-N213 PolarHBondContact O-N 3.49Å; V209-L219 HydrophobicContact CG1-CD1 3.91Å
210	E	98.1	Very high	95.8	Very high	94 Å²	94	70.2 Å²	70.2	44%	0.439	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-42.3	176.4	-73.1	165.5	-174.5	0	0	112	Q206 N213 Y214	Q206-E210 WeakPolarHBondContact CG-OE1 3.4Å; Q206-E210 WeakPolarHBondContact O-CG 2.92Å; Q206-E210 PolarHBondContact O-N 3.43Å; E210-N213 PolarHBondContact O-N 2.66Å; E210-Y214 WeakPolarHBondContact O-CB 3.07Å; E210-Y214 PolarHBondContact O-N 2.81Å
211	Y	98.3	Very high	96.4	Very high	157 Å²	157	61.7 Å²	61.7	62%	0.616	29%	0.29	S	S	*	.	H	α-helix	trans	-65.6	-42.9	176.3	-175.9	-108.1	0	0	0	112.1	K207 L208 V209 N213 Y214 I215	K207-Y211 WeakPolarHBondContact O-CB 3.49Å; K207-Y211 PolarHBondContact O-N 3.39Å; L208-Y211 PolarHBondContact O-N 2.65Å; V209-Y211 PolarHBondContact O-N 3.41Å; Y211-N213 VanDerWaalsContact C-N 3.31Å; Y211-N213 PolarHBondContact O-N 3.49Å; Y211-Y214 WeakPolarHBondContact O-CB 3.2Å; Y211-Y214 PolarHBondContact O-N 2.96Å; Y211-I215 HydrophobicContact CD1-CD1 3.92Å; Y211-I215 HydrophobicContact CE1-CD1 3.48Å; Y211-I215 VanDerWaalsContact CE1-CD1 3.48Å; Y211-I215 HydrophobicContact CE2-CD1 4.46Å; Y211-I215 WeakPolarHBondContact O-CG1 3.29Å; Y211-I215 PolarHBondContact O-N 3.29Å
212	E	98.6	Very high	96.9	Very high	11 Å²	11	57.3 Å²	57.3	5%	0.051	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-43.5	172.7	-177.1	-177	179.7	0	0	111.2	H166 R169 R173 L208 V209 Y214 I215 Y216 L219	H166-E212 IonicContact CE1-OE2 3.78Å; H166-E212 IonicContact CG-OE2 2.77Å; H166-E212 IonicContact ND1-OE2 3.71Å; H166-E212 PolarHBondContact ND1-OE2 2.92Å; R169-E212 IonicContact CZ-OE1 3.63Å; R169-E212 IonicContact CZ-OE2 2.73Å; R169-E212 IonicContact NE-OE1 2.76Å; R169-E212 PolarHBondContact NE-OE1 2.8Å; R169-E212 IonicContact NE-OE2 3.53Å; R169-E212 PolarHBondContact NE-OE2 2.87Å; R169-E212 IonicContact NH2-OE1 3.9Å; R169-E212 IonicContact NH2-OE2 3.84Å; R169-E212 PolarHBondContact NH2-OE2 3.22Å; R173-E212 IonicContact CZ-OE1 2.64Å; R173-E212 VanDerWaalsContact CZ-OE1 3.22Å; R173-E212 IonicContact NH1-OE1 3.98Å; R173-E212 PolarHBondContact NH1-OE1 3.35Å; R173-E212 IonicContact NH2-OE1 3.46Å; R173-E212 PolarHBondContact NH2-OE1 3.47Å; L208-E212 WeakPolarHBondContact O-CB 3.46Å; L208-E212 PolarHBondContact O-N 3.29Å; V209-E212 PolarHBondContact O-N 3.28Å; E212-Y214 VanDerWaalsContact C-N 3.33Å; E212-Y214 PolarHBondContact O-N 2.77Å; E212-I215 PolarHBondContact O-N 3.42Å; E212-I215 VanDerWaalsContact O-N 3.14Å; E212-Y216 HydrophobicContact CG-CD2 3.7Å; E212-Y216 HydrophobicContact CG-CE2 4.14Å; E212-Y216 WeakPolarHBondContact O-CD2 3.36Å; E212-Y216 PolarHBondContact O-N 3.12Å; E212-L219 HydrophobicContact CB-CD1 4.18Å; E212-L219 HydrophobicContact CG-CD1 4.04Å
213	N	98.5	Very high	97.2	Very high	21 Å²	21	57.1 Å²	57.1	11%	0.112	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-39.5	179	-163.2	55.9	0	0	0	112.5	L143 H145 V209 E210 Y211 I215 Y216 G217 L219	L143-N213 HydrophobicContact CD1-CB 3.84Å; H145-N213 PolarHBondContact NE2-ND2 3.06Å; H145-N213 PolarHBondContact NE2-OD1 3.22Å; V209-N213 WeakPolarHBondContact O-CB 3.36Å; V209-N213 PolarHBondContact O-N 3.49Å; E210-N213 PolarHBondContact O-N 2.66Å; Y211-N213 VanDerWaalsContact C-N 3.31Å; Y211-N213 PolarHBondContact O-N 3.49Å; N213-I215 PolarHBondContact O-N 2.66Å; N213-Y216 PolarHBondContact O-N 2.97Å; N213-G217 VanDerWaalsContact O-CA 3.3Å; N213-G217 WeakPolarHBondContact O-CA 3.09Å; N213-G217 PolarHBondContact O-N 3.01Å; N213-L219 HydrophobicContact CB-CD1 4.05Å; N213-L219 HydrophobicContact CB-CG 4.41Å; N213-L219 WeakPolarHBondContact OD1-CB 2.99Å; N213-L219 PolarHBondContact OD1-N 2.92Å
214	Y	98.3	Very high	97.3	Very high	195 Å²	195	54.4 Å²	54.4	77%	0.765	25%	0.251	S	S	*	.	H	α-helix	trans	-58.3	-35.6	174.6	173.5	-100.5	0	0	0	112.3	E210 Y211 E212	E210-Y214 WeakPolarHBondContact O-CB 3.07Å; E210-Y214 PolarHBondContact O-N 2.81Å; Y211-Y214 WeakPolarHBondContact O-CB 3.2Å; Y211-Y214 PolarHBondContact O-N 2.96Å; E212-Y214 VanDerWaalsContact C-N 3.33Å; E212-Y214 PolarHBondContact O-N 2.77Å
215	I	98.1	Very high	97.3	Very high	83 Å²	83	53 Å²	53	43%	0.426	24%	0.244	S	C	.	.	H	α-helix	trans	-78.9	-46.8	-179.6	-64	166.6	0	0	0	111.6	Y211 E212 N213	Y211-I215 HydrophobicContact CD1-CD1 3.92Å; Y211-I215 HydrophobicContact CE1-CD1 3.48Å; Y211-I215 VanDerWaalsContact CE1-CD1 3.48Å; Y211-I215 HydrophobicContact CE2-CD1 4.46Å; Y211-I215 WeakPolarHBondContact O-CG1 3.29Å; Y211-I215 PolarHBondContact O-N 3.29Å; E212-I215 PolarHBondContact O-N 3.42Å; E212-I215 VanDerWaalsContact O-N 3.14Å; N213-I215 PolarHBondContact O-N 2.66Å
216	Y	98.4	Very high	97.3	Very high	86 Å²	86	52 Å²	52	34%	0.337	24%	0.239	S	C	.	.	H	α-helix	trans	-106.9	-25.4	-165.6	-62.2	-67.7	0	0	0	114.7	E170 E212 N213 D218	E170-Y216 PolarHBondContact OE1-OH 3.34Å; E170-Y216 VanDerWaalsContact OE2-CZ 3.31Å; E170-Y216 PolarHBondContact OE2-OH 2.94Å; E212-Y216 HydrophobicContact CG-CD2 3.7Å; E212-Y216 HydrophobicContact CG-CE2 4.14Å; E212-Y216 WeakPolarHBondContact O-CD2 3.36Å; E212-Y216 PolarHBondContact O-N 3.12Å; N213-Y216 PolarHBondContact O-N 2.97Å; Y216-D218 WeakPolarHBondContact CB-OD1 3.4Å; Y216-D218 PolarHBondContact O-N 3.22Å
217	G	98.1	Very high	97.2	Very high	16 Å²	16	52.7 Å²	52.7	17%	0.165	25%	0.247	C	C	.	.			trans	53.6	37.7	-179.9	0	0	0	0	0	113.7	H145 K148 N213	H145-G217 VanDerWaalsContact CE1-CA 3.48Å; H145-G217 WeakPolarHBondContact CE1-CA 3.39Å; H145-G217 PolarHBondContact ND1-O 2.72Å; K148-G217 WeakPolarHBondContact CE-O 3.33Å; N213-G217 VanDerWaalsContact O-CA 3.3Å; N213-G217 WeakPolarHBondContact O-CA 3.09Å; N213-G217 PolarHBondContact O-N 3.01Å
218	D	98.4	Very high	97.1	Very high	8 Å²	8	48.6 Å²	48.6	4%	0.043	23%	0.229	C	C	.	.			trans	-127.5	14.2	-174.2	66.1	4.3	0	0	0	113.7	R173 L190 F191 Y216	R173-D218 IonicContact CZ-OD1 2.6Å; R173-D218 IonicContact CZ-OD2 2.75Å; R173-D218 IonicContact NE-OD1 2.68Å; R173-D218 IonicContact NE-OD2 3.84Å; R173-D218 PolarHBondContact NE-OD2 2.92Å; R173-D218 IonicContact NH2-OD1 2.8Å; R173-D218 PolarHBondContact NH2-OD1 3.39Å; R173-D218 IonicContact NH2-OD2 2.76Å; R173-D218 PolarHBondContact NH2-OD2 3Å; L190-D218 WeakPolarHBondContact CA-O 3.35Å; F191-D218 PolarHBondContact N-O 3.43Å; Y216-D218 WeakPolarHBondContact CB-OD1 3.4Å; Y216-D218 PolarHBondContact O-N 3.22Å
219	L	98.8	Very high	97	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.9	-179.6	-51.5	-175.2	0	0	0	110.9	L143 H145 F191 L193 V209 E212 N213	L143-L219 WeakPolarHBondContact CB-O 3.41Å; L143-L219 HydrophobicContact CD1-CB 4.24Å; H145-L219 PolarHBondContact CD2-O 2.85Å; H145-L219 VanDerWaalsContact CD2-O 3.24Å; F191-L219 HydrophobicContact CB-CD2 3.74Å; F191-L219 HydrophobicContact CD2-CD2 4Å; F191-L219 HydrophobicContact CG-CD2 4.22Å; L193-L219 HydrophobicContact CD1-CB 4.3Å; L193-L219 HydrophobicContact CD1-CD1 4.04Å; L193-L219 HydrophobicContact CD1-CD2 4.26Å; L193-L219 HydrophobicContact CD1-CG 4.45Å; V209-L219 HydrophobicContact CG1-CD1 3.91Å; E212-L219 HydrophobicContact CB-CD1 4.18Å; E212-L219 HydrophobicContact CG-CD1 4.04Å; N213-L219 HydrophobicContact CB-CD1 4.05Å; N213-L219 HydrophobicContact CB-CG 4.41Å; N213-L219 WeakPolarHBondContact OD1-CB 2.99Å; N213-L219 PolarHBondContact OD1-N 2.92Å
220	L	98.8	Very high	96.9	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.7	163.3	-58.1	-175.7	0	0	0	108.6	M141 H145 L190 F191 L192 L193 W222 W241	M141-L220 HydrophobicContact CE-CD2 4.42Å; H145-L220 HydrophobicContact CB-CD2 4.22Å; L190-L220 HydrophobicContact CD1-CD1 4.05Å; L190-L220 HydrophobicContact CD2-CD2 4.5Å; L190-L220 HydrophobicContact CD2-CG 4.29Å; F191-L220 PolarHBondContact O-N 3.02Å; L192-L220 HydrophobicContact CD2-CB 4.12Å; L192-L220 HydrophobicContact CD2-CD1 4.01Å; L192-L220 HydrophobicContact CD2-CG 4.48Å; L193-L220 PolarHBondContact N-O 3.39Å; L220-W222 HydrophobicContact CB-CH2 3.61Å; L220-W222 HydrophobicContact CB-CZ2 4.33Å; L220-W222 HydrophobicContact CB-CZ3 3.78Å; L220-W222 HydrophobicContact CD1-CH2 3.94Å; L220-W222 HydrophobicContact CD1-CZ2 4.5Å; L220-W222 HydrophobicContact CG-CH2 4.45Å; L220-W241 HydrophobicContact CD1-CD2 3.5Å; L220-W241 HydrophobicContact CD1-CE3 3.66Å; L220-W241 HydrophobicContact CD1-CG 4.02Å; L220-W241 HydrophobicContact CD1-CH2 4.12Å; L220-W241 HydrophobicContact CD1-CZ2 3.97Å; L220-W241 HydrophobicContact CD1-CZ3 3.95Å; L220-W241 HydrophobicContact CD2-CZ2 3.87Å
221	Q	98.4	Very high	96.9	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	132.8	-178.6	-168.9	-177.6	25.1	0	0	111.1	I142 L143 L193 G194	I142-Q221 HydrophobicContact CB-CB 4.28Å; I142-Q221 HydrophobicContact CB-CG 4.24Å; I142-Q221 HydrophobicContact CD1-CG 4.25Å; I142-Q221 PolarHBondContact N-O 3.38Å; L143-Q221 HydrophobicContact CB-CB 3.89Å; L143-Q221 HydrophobicContact CD1-CB 4.08Å; L143-Q221 HydrophobicContact CG-CB 4.01Å; L143-Q221 PolarHBondContact N-O 3.18Å; L143-Q221 PolarHBondContact O-N 3.35Å; L143-Q221 VanDerWaalsContact O-N 3.15Å; L193-Q221 HydrophobicContact CB-CB 4.23Å; L193-Q221 HydrophobicContact CB-CG 4Å; L193-Q221 WeakPolarHBondContact O-CA 3.41Å; G194-Q221 PolarHBondContact O-NE2 3.08Å
222	W	97.9	Very high	96.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	152.7	175.1	-66.3	-87.4	0	0	0	112	W101 P140 M141 L192 L193 L220 F224 H237 F238 W241	W101-W222 AromaticContact CH2-NE1 3.46Å; W101-W222 AromaticContact CZ2-CD1 3.82Å; W101-W222 AromaticContact CZ2-NE1 3.54Å; W101-W222 AromaticContact CZ3-NE1 3.99Å; P140-W222 WeakPolarHBondContact O-CA 3.49Å; M141-W222 VanDerWaalsContact SD-CD1 3.59Å; M141-W222 HydrophobicContact SD-CD2 4.12Å; M141-W222 HydrophobicContact SD-CG 4.29Å; M141-W222 HydrophobicContact SD-CZ2 3.66Å; M141-W222 PolarHBondContact SD-NE1 3.3Å; L192-W222 HydrophobicContact CB-CZ3 4.28Å; L192-W222 HydrophobicContact CD2-CH2 3.92Å; L192-W222 HydrophobicContact CD2-CZ3 3.93Å; L193-W222 PolarHBondContact O-N 3.49Å; L193-W222 VanDerWaalsContact O-N 3.15Å; L220-W222 HydrophobicContact CB-CH2 3.61Å; L220-W222 HydrophobicContact CB-CZ2 4.33Å; L220-W222 HydrophobicContact CB-CZ3 3.78Å; L220-W222 HydrophobicContact CD1-CH2 3.94Å; L220-W222 HydrophobicContact CD1-CZ2 4.5Å; L220-W222 HydrophobicContact CG-CH2 4.45Å; W222-F224 HydrophobicContact CB-CD1 3.61Å; W222-F224 HydrophobicContact CB-CE1 3.54Å; W222-F224 HydrophobicContact CG-CE1 4.22Å; W222-F224 PolarHBondContact O-N 3.23Å; W222-H237 AromaticContact CD1-CD2 3.23Å; W222-H237 AromaticContact CD1-CG 3.92Å; W222-H237 HydrophobicContact CD2-CB 3.7Å; W222-H237 VanDerWaalsContact CE2-CB 3.47Å; W222-H237 HydrophobicContact CE3-CB 4.26Å; W222-H237 HydrophobicContact CG-CB 4.05Å; W222-H237 AromaticContact CG-CD2 3.61Å; W222-H237 HydrophobicContact CH2-CB 4.37Å; W222-H237 HydrophobicContact CZ2-CB 3.83Å; W222-H237 AromaticContact NE1-CD2 3.53Å; W222-H237 AromaticContact NE1-CG 3.94Å; W222-F238 HydrophobicContact CH2-CB 4.41Å; W222-W241 HydrophobicContact CZ2-CB 4Å; W222-W241 HydrophobicContact CZ2-CG 4.34Å
223	D	95.5	Very high	96.7	Very high	77 Å²	77	36.4 Å²	36.4	41%	0.412	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	58.6	-177.9	-166.7	20.3	0	0	0	112.8	F139 P140 I142 T195	F139-D223 WeakPolarHBondContact CD1-O 3.34Å; P140-D223 PolarHBondContact O-N 2.79Å; I142-D223 HydrophobicContact CD1-CB 3.97Å; I142-D223 HydrophobicContact CG1-CB 3.98Å; T195-D223 WeakPolarHBondContact CG2-OD1 3.47Å
224	F	94.9	Very high	96.7	Very high	7 Å²	7	35.4 Å²	35.4	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.6	168.2	66.9	-103.7	0	0	0	110.4	F139 G194 T195 W222 D226 N230 L233 K234	F139-F224 HydrophobicContact CB-CB 4.44Å; F139-F224 HydrophobicContact CB-CD1 4.37Å; F139-F224 HydrophobicContact CD1-CB 3.97Å; F139-F224 HydrophobicContact CD2-CB 3.91Å; F139-F224 HydrophobicContact CD2-CD1 4.16Å; F139-F224 HydrophobicContact CD2-CG 4.43Å; F139-F224 HydrophobicContact CE1-CB 4.18Å; F139-F224 HydrophobicContact CE2-CB 4.15Å; F139-F224 HydrophobicContact CG-CB 3.84Å; F139-F224 HydrophobicContact CG-CD1 4.37Å; F139-F224 HydrophobicContact CZ-CB 4.27Å; G194-F224 CarbonylContact C-O 3.57Å; G194-F224 WeakPolarHBondContact CA-O 3.4Å; T195-F224 PolarHBondContact N-O 3.25Å; T195-F224 VanDerWaalsContact OG1-C 3.3Å; T195-F224 PolarHBondContact OG1-O 3.48Å; T195-F224 VanDerWaalsContact OG1-O 3.07Å; W222-F224 HydrophobicContact CB-CD1 3.61Å; W222-F224 HydrophobicContact CB-CE1 3.54Å; W222-F224 HydrophobicContact CG-CE1 4.22Å; W222-F224 PolarHBondContact O-N 3.23Å; F224-D226 PolarHBondContact O-N 3.11Å; F224-N230 HydrophobicContact CD2-CB 4.06Å; F224-N230 HydrophobicContact CE2-CB 4.2Å; F224-L233 HydrophobicContact CB-CD1 4.24Å; F224-L233 HydrophobicContact CD1-CB 4.11Å; F224-L233 HydrophobicContact CD2-CB 4.29Å; F224-L233 HydrophobicContact CD2-CD1 4.22Å; F224-L233 HydrophobicContact CE1-CB 3.93Å; F224-L233 HydrophobicContact CE2-CB 4.15Å; F224-L233 HydrophobicContact CG-CB 4.3Å; F224-L233 HydrophobicContact CG-CD1 4.09Å; F224-L233 HydrophobicContact CZ-CB 3.98Å; F224-K234 HydrophobicContact CZ-CB 3.94Å
225	L	93.6	Very high	96.6	Very high	72 Å²	72	26.2 Å²	26.2	38%	0.377	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	120.1	179.2	-168.7	76.8	0	0	0	111.3	R202 S227 N230	R202-L225 VanDerWaalsContact NH2-CD1 3.27Å; L225-S227 PolarHBondContact O-N 3.46Å; L225-S227 VanDerWaalsContact O-N 3.09Å; L225-N230 WeakPolarHBondContact O-CB 3.49Å; L225-N230 PolarHBondContact O-ND2 3.36Å
226	D	94.2	Very high	96.6	Very high	10 Å²	10	22.4 Å²	22.4	5%	0.053	12%	0.117	C	C	.	.			trans	-73.6	105.6	178.9	-151	-25.7	0	0	0	110.6	G194 T195 F224 K234	G194-D226 PolarHBondContact N-OD2 3.33Å; T195-D226 WeakPolarHBondContact O-CB 3.21Å; T195-D226 PolarHBondContact O-N 3.02Å; F224-D226 PolarHBondContact O-N 3.11Å; D226-K234 IonicContact OD1-NZ 3.68Å; D226-K234 PolarHBondContact OD1-NZ 2.03Å; D226-K234 WeakPolarHBondContact OD2-CE 3.25Å; D226-K234 IonicContact OD2-NZ 2.72Å; D226-K234 PolarHBondContact OD2-NZ 3.44Å
227	S	93.7	Very high	96.6	Very high	41 Å²	41	18.3 Å²	18.3	29%	0.287	10%	0.101	S	C	.	.			trans	-143.3	163.5	-178.2	77.6	0	0	0	0	110.4	L225 F229 N230 L231	L225-S227 PolarHBondContact O-N 3.46Å; L225-S227 VanDerWaalsContact O-N 3.09Å; S227-F229 VanDerWaalsContact C-N 3.31Å; S227-F229 PolarHBondContact O-N 3.23Å; S227-N230 CarbonylContact O-C 3.52Å; S227-N230 PolarHBondContact O-N 3.48Å; S227-N230 PolarHBondContact OG-N 2.95Å; S227-N230 PolarHBondContact OG-ND2 3.2Å; S227-L231 PolarHBondContact O-N 2.75Å
228	F	93.4	Very high	96.6	Very high	51 Å²	51	17.5 Å²	17.5	22%	0.224	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-56.3	-42.8	-178.7	-179.9	-110.1	0	0	0	112.9	N230 L231 K297 Y298	F228-N230 VanDerWaalsContact C-N 3.27Å; F228-N230 PolarHBondContact O-N 2.79Å; F228-L231 HydrophobicContact CD2-CD1 3.72Å; F228-L231 HydrophobicContact CE2-CD1 4.08Å; F228-L231 WeakPolarHBondContact O-CB 3.44Å; F228-L231 WeakPolarHBondContact O-CG 3.47Å; F228-L231 PolarHBondContact O-N 2.92Å; F228-K297 VanDerWaalsContact CD2-CE 3.49Å; F228-K297 HydrophobicContact CE1-CG 4.43Å; F228-K297 HydrophobicContact CZ-CG 4.46Å; F228-Y298 HydrophobicContact CE1-CD1 4.43Å; F228-Y298 HydrophobicContact CE2-CD1 4.45Å; F228-Y298 AromaticContact CE2-CE1 3.98Å; F228-Y298 HydrophobicContact CE2-CE1 3.98Å; F228-Y298 AromaticContact CZ-CD1 3.63Å; F228-Y298 HydrophobicContact CZ-CD1 3.63Å; F228-Y298 AromaticContact CZ-CE1 3.6Å; F228-Y298 HydrophobicContact CZ-CE1 3.6Å
229	F	95.3	Very high	96.6	Very high	21 Å²	21	17.2 Å²	17.2	9%	0.092	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-75.4	-16	178.8	-72.8	1.1	0	0	0	113.7	N126 F127 F130 S227 P340	N126-F229 HydrophobicContact CB-CD2 4.37Å; N126-F229 HydrophobicContact CB-CE2 3.96Å; N126-F229 VanDerWaalsContact ND2-CE2 3.26Å; N126-F229 WeakPolarHBondContact ND2-CE2 3.45Å; N126-F229 WeakPolarHBondContact ND2-CZ 3.46Å; F127-F229 AromaticContact CD1-CE2 3.59Å; F127-F229 HydrophobicContact CD1-CE2 3.59Å; F127-F229 AromaticContact CD1-CZ 3.93Å; F127-F229 HydrophobicContact CD1-CZ 3.93Å; F127-F229 HydrophobicContact CD2-CE2 4.35Å; F127-F229 HydrophobicContact CD2-CZ 4.48Å; F127-F229 HydrophobicContact CE1-CE1 4.44Å; F127-F229 AromaticContact CE1-CE2 3.58Å; F127-F229 HydrophobicContact CE1-CE2 3.58Å; F127-F229 AromaticContact CE1-CZ 3.4Å; F127-F229 HydrophobicContact CE1-CZ 3.4Å; F127-F229 VanDerWaalsContact CE1-CZ 3.4Å; F127-F229 HydrophobicContact CE2-CE2 4.32Å; F127-F229 HydrophobicContact CE2-CZ 4Å; F127-F229 HydrophobicContact CG-CE2 4Å; F127-F229 HydrophobicContact CG-CZ 4.45Å; F127-F229 HydrophobicContact CZ-CE1 4.49Å; F127-F229 AromaticContact CZ-CE2 3.96Å; F127-F229 HydrophobicContact CZ-CE2 3.96Å; F127-F229 AromaticContact CZ-CZ 3.45Å; F127-F229 HydrophobicContact CZ-CZ 3.45Å; F127-F229 VanDerWaalsContact CZ-CZ 3.45Å; F130-F229 HydrophobicContact CB-CD2 3.94Å; F130-F229 HydrophobicContact CD2-CB 4.01Å; F130-F229 HydrophobicContact CD2-CD2 4.42Å; F130-F229 HydrophobicContact CG-CD2 4.35Å; S227-F229 VanDerWaalsContact C-N 3.31Å; S227-F229 PolarHBondContact O-N 3.23Å; F229-P340 HydrophobicContact CB-CB 4.34Å; F229-P340 HydrophobicContact CD1-CB 3.65Å; F229-P340 HydrophobicContact CD2-CB 4.25Å; F229-P340 HydrophobicContact CE1-CB 3.92Å; F229-P340 HydrophobicContact CE2-CB 4.46Å; F229-P340 HydrophobicContact CG-CB 3.84Å; F229-P340 HydrophobicContact CZ-CB 4.33Å
230	N	96.4	Very high	96.5	Very high	37 Å²	37	17.8 Å²	17.8	20%	0.198	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-95	3.6	175.5	-69	-14.2	0	0	0	112.7	F224 L225 S227 F228 T232 L233 K234	F224-N230 HydrophobicContact CD2-CB 4.06Å; F224-N230 HydrophobicContact CE2-CB 4.2Å; L225-N230 WeakPolarHBondContact O-CB 3.49Å; L225-N230 PolarHBondContact O-ND2 3.36Å; S227-N230 CarbonylContact O-C 3.52Å; S227-N230 PolarHBondContact O-N 3.48Å; S227-N230 PolarHBondContact OG-N 2.95Å; S227-N230 PolarHBondContact OG-ND2 3.2Å; F228-N230 VanDerWaalsContact C-N 3.27Å; F228-N230 PolarHBondContact O-N 2.79Å; N230-T232 PolarHBondContact O-N 2.88Å; N230-L233 HydrophobicContact CB-CD1 4.03Å; N230-L233 WeakPolarHBondContact O-CB 3.39Å; N230-L233 PolarHBondContact O-N 2.77Å; N230-K234 PolarHBondContact O-N 3.27Å
231	L	96.4	Very high	96.5	Very high	30 Å²	30	17.8 Å²	17.8	16%	0.157	9%	0.094	C	C	.	.	H	α-helix	trans	-57.4	-35.1	171.6	-71.3	176.7	0	0	0	111.2	S227 F228 L233 K234 E235 D342	S227-L231 PolarHBondContact O-N 2.75Å; F228-L231 HydrophobicContact CD2-CD1 3.72Å; F228-L231 HydrophobicContact CE2-CD1 4.08Å; F228-L231 WeakPolarHBondContact O-CB 3.44Å; F228-L231 WeakPolarHBondContact O-CG 3.47Å; F228-L231 PolarHBondContact O-N 2.92Å; L231-L233 VanDerWaalsContact C-N 3.28Å; L231-L233 PolarHBondContact O-N 2.99Å; L231-K234 WeakPolarHBondContact O-CA 3.15Å; L231-K234 WeakPolarHBondContact O-CB 3.5Å; L231-K234 PolarHBondContact O-N 3.22Å; L231-E235 PolarHBondContact O-N 3.27Å; L231-D342 HydrophobicContact CB-CB 3.86Å
232	T	97.1	Very high	96.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.3	-32.6	175	-52.6	0	0	0	0	112.6	N230 K234 E235 T236 I338 Y339 D342 F345	N230-T232 PolarHBondContact O-N 2.88Å; T232-K234 VanDerWaalsContact C-N 3.35Å; T232-E235 WeakPolarHBondContact O-CB 3.15Å; T232-E235 PolarHBondContact O-N 3.37Å; T232-T236 HydrophobicContact CG2-CG2 4.48Å; T232-T236 WeakPolarHBondContact O-CG2 3.32Å; T232-T236 PolarHBondContact O-N 3.14Å; T232-I338 HydrophobicContact CG2-CG2 3.74Å; T232-Y339 VanDerWaalsContact CB-O 3.29Å; T232-Y339 WeakPolarHBondContact CB-O 3.47Å; T232-Y339 PolarHBondContact OG1-O 3.16Å; T232-D342 VanDerWaalsContact OG1-CA 3.29Å; T232-D342 WeakPolarHBondContact OG1-CA 3.31Å; T232-D342 PolarHBondContact OG1-N 3.44Å; T232-F345 HydrophobicContact CG2-CB 3.72Å; T232-F345 HydrophobicContact CG2-CD1 3.36Å; T232-F345 HydrophobicContact CG2-CD2 3.91Å; T232-F345 HydrophobicContact CG2-CE1 3.86Å; T232-F345 HydrophobicContact CG2-CE2 4.36Å; T232-F345 HydrophobicContact CG2-CG 3.36Å; T232-F345 HydrophobicContact CG2-CZ 4.33Å
233	L	97.2	Very high	96.4	Very high	9 Å²	9	18.6 Å²	18.6	5%	0.047	10%	0.097	C	C	.	.	H	α-helix	trans	-62.9	-45.5	170.3	-66.2	173	0	0	0	110	C136 F139 F224 N230 L231 E235 T236 H237 I338	C136-L233 WeakPolarHBondContact O-CD2 3.3Å; F139-L233 HydrophobicContact CD2-CD1 4.35Å; F139-L233 HydrophobicContact CD2-CD2 4.47Å; F139-L233 HydrophobicContact CE2-CD1 3.67Å; F139-L233 HydrophobicContact CE2-CD2 3.94Å; F139-L233 HydrophobicContact CE2-CG 4.43Å; F139-L233 HydrophobicContact CZ-CD1 4.31Å; F224-L233 HydrophobicContact CB-CD1 4.24Å; F224-L233 HydrophobicContact CD1-CB 4.11Å; F224-L233 HydrophobicContact CD2-CB 4.29Å; F224-L233 HydrophobicContact CD2-CD1 4.22Å; F224-L233 HydrophobicContact CE1-CB 3.93Å; F224-L233 HydrophobicContact CE2-CB 4.15Å; F224-L233 HydrophobicContact CG-CB 4.3Å; F224-L233 HydrophobicContact CG-CD1 4.09Å; F224-L233 HydrophobicContact CZ-CB 3.98Å; N230-L233 HydrophobicContact CB-CD1 4.03Å; N230-L233 WeakPolarHBondContact O-CB 3.39Å; N230-L233 PolarHBondContact O-N 2.77Å; L231-L233 VanDerWaalsContact C-N 3.28Å; L231-L233 PolarHBondContact O-N 2.99Å; L233-E235 PolarHBondContact O-N 3.02Å; L233-E235 VanDerWaalsContact O-N 3.14Å; L233-T236 PolarHBondContact O-N 3.08Å; L233-T236 VanDerWaalsContact O-N 3.17Å; L233-T236 PolarHBondContact O-OG1 3.06Å; L233-T236 VanDerWaalsContact O-OG1 3.07Å; L233-H237 WeakPolarHBondContact O-CB 3.32Å; L233-H237 VanDerWaalsContact O-CG 3.32Å; L233-H237 PolarHBondContact O-N 2.82Å; L233-H237 PolarHBondContact O-ND1 3.36Å; L233-I338 HydrophobicContact CD2-CD1 3.48Å; L233-I338 VanDerWaalsContact CD2-CD1 3.48Å
234	K	97.3	Very high	96.4	Very high	1 Å²	1	15.6 Å²	15.6	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-53	-39	175.1	-163.2	172.2	-72.6	176.4	0	111.9	K160 S161 L192 F224 D226 N230 L231 T232 F238	K160-K234 HydrophobicContact CB-CD 4.24Å; K160-K234 HydrophobicContact CG-CD 3.97Å; S161-K234 PolarHBondContact O-NZ 3.03Å; L192-K234 HydrophobicContact CB-CD 3.75Å; L192-K234 HydrophobicContact CB-CG 3.63Å; L192-K234 HydrophobicContact CD1-CG 4.04Å; F224-K234 HydrophobicContact CZ-CB 3.94Å; D226-K234 IonicContact OD1-NZ 3.68Å; D226-K234 PolarHBondContact OD1-NZ 2.03Å; D226-K234 WeakPolarHBondContact OD2-CE 3.25Å; D226-K234 IonicContact OD2-NZ 2.72Å; D226-K234 PolarHBondContact OD2-NZ 3.44Å; N230-K234 PolarHBondContact O-N 3.27Å; L231-K234 WeakPolarHBondContact O-CA 3.15Å; L231-K234 WeakPolarHBondContact O-CB 3.5Å; L231-K234 PolarHBondContact O-N 3.22Å; T232-K234 VanDerWaalsContact C-N 3.35Å; K234-F238 WeakPolarHBondContact O-CB 3.48Å; K234-F238 PolarHBondContact O-N 3.05Å; K234-F238 VanDerWaalsContact O-N 3.11Å
235	E	97.3	Very high	96.5	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.009	9%	0.085	C	C	.	.	H	α-helix	trans	-65.5	-55.3	174.2	-61.1	-47.6	139.2	0	0	114	K160 L231 T232 L233 H237 F238 L239 K254 D342 L346	K160-E235 WeakPolarHBondContact CD-OE1 3.33Å; L231-E235 PolarHBondContact O-N 3.27Å; T232-E235 WeakPolarHBondContact O-CB 3.15Å; T232-E235 PolarHBondContact O-N 3.37Å; L233-E235 PolarHBondContact O-N 3.02Å; L233-E235 VanDerWaalsContact O-N 3.14Å; E235-H237 PolarHBondContact O-N 2.73Å; E235-F238 PolarHBondContact O-N 3.41Å; E235-L239 WeakPolarHBondContact O-CG 3.34Å; E235-L239 PolarHBondContact O-N 3.33Å; E235-K254 WeakPolarHBondContact OE1-CE 3.17Å; E235-K254 IonicContact OE1-NZ 3.98Å; E235-K254 PolarHBondContact OE1-NZ 2.73Å; E235-K254 WeakPolarHBondContact OE2-CD 3.29Å; E235-K254 WeakPolarHBondContact OE2-CE 3.42Å; E235-K254 IonicContact OE2-NZ 3.24Å; E235-K254 PolarHBondContact OE2-NZ 3.4Å; E235-D342 HydrophobicContact CG-CB 3.75Å; E235-L346 HydrophobicContact CG-CD1 4.47Å
236	T	97.3	Very high	96.7	Very high	2 Å²	2	13 Å²	13	1%	0.012	7%	0.067	C	C	.	.	H	α-helix	trans	-61.4	-37.5	-175.8	60.7	0	0	0	0	111.2	T232 L233 L239 K240 A333 F345	T232-T236 HydrophobicContact CG2-CG2 4.48Å; T232-T236 WeakPolarHBondContact O-CG2 3.32Å; T232-T236 PolarHBondContact O-N 3.14Å; L233-T236 PolarHBondContact O-N 3.08Å; L233-T236 VanDerWaalsContact O-N 3.17Å; L233-T236 PolarHBondContact O-OG1 3.06Å; L233-T236 VanDerWaalsContact O-OG1 3.07Å; T236-L239 PolarHBondContact O-N 3.19Å; T236-K240 PolarHBondContact O-N 3.18Å; T236-A333 HydrophobicContact CG2-CB 4.02Å; T236-F345 HydrophobicContact CG2-CE1 3.7Å; T236-F345 HydrophobicContact CG2-CZ 4.11Å
237	H	97.9	Very high	96.7	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-69.2	-43.7	178.7	-72.9	72.2	0	0	0	112.2	W101 H137 F138 F139 W222 L233 E235 K240 W241	W101-H237 HydrophobicContact CH2-CB 4.29Å; W101-H237 AromaticContact CH2-CD2 3.78Å; W101-H237 AromaticContact CZ2-CD2 3.79Å; H137-H237 PolarHBondContact O-CE1 2.74Å; F138-H237 WeakPolarHBondContact CA-NE2 3.33Å; F139-H237 AromaticContact CD2-CE1 3.64Å; F139-H237 AromaticContact CD2-NE2 3.57Å; F139-H237 PolarHBondContact N-NE2 2.84Å; W222-H237 AromaticContact CD1-CD2 3.23Å; W222-H237 AromaticContact CD1-CG 3.92Å; W222-H237 HydrophobicContact CD2-CB 3.7Å; W222-H237 VanDerWaalsContact CE2-CB 3.47Å; W222-H237 HydrophobicContact CE3-CB 4.26Å; W222-H237 HydrophobicContact CG-CB 4.05Å; W222-H237 AromaticContact CG-CD2 3.61Å; W222-H237 HydrophobicContact CH2-CB 4.37Å; W222-H237 HydrophobicContact CZ2-CB 3.83Å; W222-H237 AromaticContact NE1-CD2 3.53Å; W222-H237 AromaticContact NE1-CG 3.94Å; L233-H237 WeakPolarHBondContact O-CB 3.32Å; L233-H237 VanDerWaalsContact O-CG 3.32Å; L233-H237 PolarHBondContact O-N 2.82Å; L233-H237 PolarHBondContact O-ND1 3.36Å; E235-H237 PolarHBondContact O-N 2.73Å; H237-K240 PolarHBondContact O-N 2.84Å; H237-W241 VanDerWaalsContact O-CB 3.3Å; H237-W241 WeakPolarHBondContact O-CB 3.42Å; H237-W241 PolarHBondContact O-N 3.39Å
238	F	98.3	Very high	96.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.9	-44.2	173.7	167.2	-105.7	0	0	0	111.7	L156 V158 L192 W222 K234 E235 K240 W241 F242 V252 M321	L156-F238 HydrophobicContact CD2-CE2 4.48Å; V158-F238 HydrophobicContact CB-CE2 4.2Å; V158-F238 HydrophobicContact CB-CZ 4.14Å; V158-F238 HydrophobicContact CG1-CD1 4.21Å; V158-F238 HydrophobicContact CG1-CD2 3.7Å; V158-F238 HydrophobicContact CG1-CE1 4.15Å; V158-F238 HydrophobicContact CG1-CE2 3.64Å; V158-F238 HydrophobicContact CG1-CG 4.01Å; V158-F238 HydrophobicContact CG1-CZ 3.9Å; V158-F238 HydrophobicContact CG2-CD2 4.45Å; V158-F238 HydrophobicContact CG2-CE1 4.35Å; V158-F238 HydrophobicContact CG2-CE2 3.56Å; V158-F238 HydrophobicContact CG2-CZ 3.52Å; L192-F238 HydrophobicContact CD1-CB 3.64Å; L192-F238 HydrophobicContact CD1-CD2 4.29Å; L192-F238 HydrophobicContact CD1-CG 3.9Å; L192-F238 HydrophobicContact CD2-CB 4.24Å; L192-F238 HydrophobicContact CD2-CD2 3.95Å; L192-F238 HydrophobicContact CD2-CG 4.35Å; W222-F238 HydrophobicContact CH2-CB 4.41Å; K234-F238 WeakPolarHBondContact O-CB 3.48Å; K234-F238 PolarHBondContact O-N 3.05Å; K234-F238 VanDerWaalsContact O-N 3.11Å; E235-F238 PolarHBondContact O-N 3.41Å; F238-K240 VanDerWaalsContact C-N 3.34Å; F238-K240 PolarHBondContact O-N 2.85Å; F238-W241 HydrophobicContact CE2-CE3 4.42Å; F238-W241 PolarHBondContact O-N 2.74Å; F238-F242 HydrophobicContact CE1-CB 4.47Å; F238-F242 HydrophobicContact CE2-CB 4.07Å; F238-F242 HydrophobicContact CE2-CD2 4.3Å; F238-F242 HydrophobicContact CZ-CB 3.95Å; F238-F242 AromaticContact CZ-CD2 3.92Å; F238-F242 HydrophobicContact CZ-CD2 3.92Å; F238-F242 HydrophobicContact CZ-CG 4.13Å; F238-F242 VanDerWaalsContact O-CB 3.25Å; F238-F242 WeakPolarHBondContact O-CB 3.49Å; F238-F242 PolarHBondContact O-N 3.08Å; F238-V252 HydrophobicContact CE1-CG1 4.15Å; F238-V252 HydrophobicContact CZ-CG1 3.95Å; F238-M321 HydrophobicContact CE1-CE 4.03Å
239	L	98.3	Very high	96.9	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-61	-42.5	178.7	-70.5	173.8	0	0	0	111.8	E235 T236 H243 M321 A326 L329 H330 A333 L346	E235-L239 WeakPolarHBondContact O-CG 3.34Å; E235-L239 PolarHBondContact O-N 3.33Å; T236-L239 PolarHBondContact O-N 3.19Å; L239-H243 WeakPolarHBondContact O-CB 3.41Å; L239-H243 PolarHBondContact O-N 3.41Å; L239-M321 HydrophobicContact CD2-CE 4.37Å; L239-A326 HydrophobicContact CD2-CB 4.46Å; L239-L329 HydrophobicContact CD1-CB 3.97Å; L239-L329 HydrophobicContact CD2-CB 4.05Å; L239-H330 HydrophobicContact CB-CB 4.09Å; L239-A333 HydrophobicContact CD1-CB 4.12Å; L239-L346 HydrophobicContact CD1-CD2 4.04Å
240	K	97.4	Very high	97	Very high	13 Å²	13	22 Å²	22	6%	0.057	11%	0.106	C	C	.	.	H	α-helix	trans	-62	-50.4	173.1	-179.4	169.8	172.2	164.6	0	111.3	W101 D102 F138 T236 H237 F238 F242 H243 T244 H330	W101-K240 HydrophobicContact CE3-CD 4.34Å; W101-K240 HydrophobicContact CE3-CG 4.17Å; W101-K240 HydrophobicContact CH2-CB 4.15Å; W101-K240 HydrophobicContact CH2-CD 3.77Å; W101-K240 HydrophobicContact CH2-CG 4.04Å; W101-K240 HydrophobicContact CZ2-CD 4.49Å; W101-K240 HydrophobicContact CZ3-CB 3.77Å; W101-K240 HydrophobicContact CZ3-CD 3.7Å; W101-K240 HydrophobicContact CZ3-CG 3.51Å; D102-K240 VanDerWaalsContact OD1-CE 3.25Å; D102-K240 WeakPolarHBondContact OD1-CE 3.44Å; D102-K240 IonicContact OD1-NZ 2.77Å; D102-K240 PolarHBondContact OD1-NZ 3.24Å; D102-K240 IonicContact OD2-NZ 2.66Å; F138-K240 HydrophobicContact CD1-CD 3.73Å; F138-K240 HydrophobicContact CE1-CB 4.13Å; F138-K240 HydrophobicContact CE1-CD 3.42Å; F138-K240 VanDerWaalsContact CE1-CD 3.42Å; F138-K240 HydrophobicContact CE1-CG 4.37Å; F138-K240 HydrophobicContact CG-CD 4.49Å; F138-K240 HydrophobicContact CZ-CD 3.96Å; T236-K240 PolarHBondContact O-N 3.18Å; H237-K240 PolarHBondContact O-N 2.84Å; F238-K240 VanDerWaalsContact C-N 3.34Å; F238-K240 PolarHBondContact O-N 2.85Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.86Å; K240-H243 WeakPolarHBondContact O-CB 3.43Å; K240-H243 PolarHBondContact O-N 2.98Å; K240-H243 VanDerWaalsContact O-N 3.14Å; K240-T244 PolarHBondContact O-N 3.44Å; K240-T244 PolarHBondContact O-OG1 3.42Å; K240-H330 WeakPolarHBondContact CA-ND1 3.49Å; K240-H330 VanDerWaalsContact CB-CE1 3.45Å; K240-H330 WeakPolarHBondContact CB-CE1 3.24Å
241	W	98	Very high	97.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-58.8	-43	179.7	-177.3	95.8	0	0	0	112.1	W101 N144 H145 L190 L220 W222 H237 F238 T244 Y245 C246	W101-W241 HydrophobicContact CE3-CB 4.46Å; W101-W241 HydrophobicContact CZ3-CB 4.12Å; N144-W241 PolarHBondContact OD1-NE1 2.99Å; H145-W241 WeakPolarHBondContact O-CZ2 3.39Å; L190-W241 HydrophobicContact CD1-CH2 3.56Å; L190-W241 HydrophobicContact CD1-CZ3 3.57Å; L220-W241 HydrophobicContact CD1-CD2 3.5Å; L220-W241 HydrophobicContact CD1-CE3 3.66Å; L220-W241 HydrophobicContact CD1-CG 4.02Å; L220-W241 HydrophobicContact CD1-CH2 4.12Å; L220-W241 HydrophobicContact CD1-CZ2 3.97Å; L220-W241 HydrophobicContact CD1-CZ3 3.95Å; L220-W241 HydrophobicContact CD2-CZ2 3.87Å; W222-W241 HydrophobicContact CZ2-CB 4Å; W222-W241 HydrophobicContact CZ2-CG 4.34Å; H237-W241 VanDerWaalsContact O-CB 3.3Å; H237-W241 WeakPolarHBondContact O-CB 3.42Å; H237-W241 PolarHBondContact O-N 3.39Å; F238-W241 HydrophobicContact CE2-CE3 4.42Å; F238-W241 PolarHBondContact O-N 2.74Å; W241-T244 PolarHBondContact O-N 2.67Å; W241-Y245 AromaticContact CD1-CD2 3.4Å; W241-Y245 AromaticContact CD1-CE2 3.45Å; W241-Y245 VanDerWaalsContact CD1-CE2 3.45Å; W241-Y245 AromaticContact CD2-CD2 3.87Å; W241-Y245 HydrophobicContact CD2-CD2 3.87Å; W241-Y245 AromaticContact CE2-CD2 3.55Å; W241-Y245 AromaticContact CG-CD2 3.75Å; W241-Y245 HydrophobicContact CG-CD2 3.75Å; W241-Y245 HydrophobicContact CG-CE2 4.18Å; W241-Y245 HydrophobicContact CZ2-CD2 4.24Å; W241-Y245 AromaticContact NE1-CD2 3.25Å; W241-Y245 AromaticContact NE1-CE2 3.46Å; W241-Y245 WeakPolarHBondContact O-CD2 3.35Å; W241-Y245 PolarHBondContact O-N 2.99Å; W241-C246 VanDerWaalsContact CH2-SG 3.59Å; W241-C246 WeakPolarHBondContact CZ3-SG 3.25Å
242	F	98.2	Very high	97.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-41.9	176.7	-177.6	-95.5	0	0	0	112	L156 F238 K240 C246 V249 V252 A326 R327	L156-F242 HydrophobicContact CD2-CD2 3.93Å; L156-F242 HydrophobicContact CD2-CE2 3.96Å; F238-F242 HydrophobicContact CE1-CB 4.47Å; F238-F242 HydrophobicContact CE2-CB 4.07Å; F238-F242 HydrophobicContact CE2-CD2 4.3Å; F238-F242 HydrophobicContact CZ-CB 3.95Å; F238-F242 AromaticContact CZ-CD2 3.92Å; F238-F242 HydrophobicContact CZ-CD2 3.92Å; F238-F242 HydrophobicContact CZ-CG 4.13Å; F238-F242 VanDerWaalsContact O-CB 3.25Å; F238-F242 WeakPolarHBondContact O-CB 3.49Å; F238-F242 PolarHBondContact O-N 3.08Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.86Å; F242-C246 HydrophobicContact CD2-CB 3.54Å; F242-C246 HydrophobicContact CE2-CB 3.67Å; F242-C246 HydrophobicContact CG-CB 4.11Å; F242-C246 HydrophobicContact CZ-CB 4.34Å; F242-C246 WeakPolarHBondContact O-CA 3.49Å; F242-C246 VanDerWaalsContact O-CB 3.29Å; F242-C246 WeakPolarHBondContact O-CB 3.5Å; F242-C246 PolarHBondContact O-N 3.01Å; F242-V249 HydrophobicContact CE2-CB 3.59Å; F242-V249 HydrophobicContact CE2-CG1 3.7Å; F242-V249 HydrophobicContact CE2-CG2 3.94Å; F242-V249 HydrophobicContact CZ-CB 3.68Å; F242-V249 HydrophobicContact CZ-CG1 3.89Å; F242-V249 HydrophobicContact CZ-CG2 4.48Å; F242-V252 HydrophobicContact CD2-CG2 4.14Å; F242-V252 HydrophobicContact CE1-CG2 4.32Å; F242-V252 HydrophobicContact CE2-CG2 3.42Å; F242-V252 VanDerWaalsContact CE2-CG2 3.42Å; F242-V252 HydrophobicContact CZ-CG2 3.52Å; F242-A326 HydrophobicContact CD1-CB 3.85Å; F242-A326 HydrophobicContact CE1-CB 3.66Å; F242-A326 HydrophobicContact CZ-CB 4.43Å; F242-R327 HydrophobicContact CD1-CG 4.15Å; F242-R327 HydrophobicContact CE1-CG 4.05Å
243	H	97	Very high	97.3	Very high	16 Å²	16	19.2 Å²	19.2	7%	0.074	9%	0.091	C	C	.	.	H	α-helix	trans	-61.6	-43.6	174.3	175.8	72.4	0	0	0	111.9	S97 L239 K240 H330 W331	S97-H243 PolarHBondContact OG-CE1 2.82Å; S97-H243 PolarHBondContact OG-NE2 2.73Å; L239-H243 WeakPolarHBondContact O-CB 3.41Å; L239-H243 PolarHBondContact O-N 3.41Å; K240-H243 WeakPolarHBondContact O-CB 3.43Å; K240-H243 PolarHBondContact O-N 2.98Å; K240-H243 VanDerWaalsContact O-N 3.14Å; H243-H330 HydrophobicContact CB-CB 4.25Å; H243-H330 AromaticContact CD2-CD2 3.51Å; H243-H330 AromaticContact CD2-NE2 3.76Å; H243-H330 AromaticContact CG-CD2 3.47Å; H243-H330 VanDerWaalsContact CG-CD2 3.47Å; H243-W331 AromaticContact CE1-CZ2 3.84Å; H243-W331 AromaticContact NE2-CZ2 3.74Å
244	T	96	Very high	97.3	Very high	15 Å²	15	18.9 Å²	18.9	9%	0.092	9%	0.089	C	C	.	.	H	α-helix	trans	-66.9	-47.9	179.8	-58.5	0	0	0	0	112.9	P98 K240 W241	P98-T244 WeakPolarHBondContact O-CG2 3.32Å; K240-T244 PolarHBondContact O-N 3.44Å; K240-T244 PolarHBondContact O-OG1 3.42Å; W241-T244 PolarHBondContact O-N 2.67Å
245	Y	96.8	Very high	97.3	Very high	25 Å²	25	18.9 Å²	18.9	10%	0.098	9%	0.089	C	C	.	.	H	α-helix	trans	-111.3	-13.5	-164.5	-61.2	-65.5	0	0	0	115.2	N100 W101 N144 P146 C149 W241 P247	N100-Y245 PolarHBondContact OD1-OH 2.95Å; W101-Y245 HydrophobicContact CB-CE2 4.3Å; W101-Y245 WeakPolarHBondContact CB-OH 3.3Å; W101-Y245 PolarHBondContact N-OH 3.08Å; N144-Y245 PolarHBondContact ND2-OH 3.23Å; N144-Y245 VanDerWaalsContact ND2-OH 3.11Å; P146-Y245 HydrophobicContact CB-CD1 3.48Å; P146-Y245 VanDerWaalsContact CB-CD1 3.48Å; P146-Y245 HydrophobicContact CB-CE1 3.74Å; P146-Y245 HydrophobicContact CB-CG 3.91Å; C149-Y245 WeakPolarHBondContact CB-O 3.24Å; W241-Y245 AromaticContact CD1-CD2 3.4Å; W241-Y245 AromaticContact CD1-CE2 3.45Å; W241-Y245 VanDerWaalsContact CD1-CE2 3.45Å; W241-Y245 AromaticContact CD2-CD2 3.87Å; W241-Y245 HydrophobicContact CD2-CD2 3.87Å; W241-Y245 AromaticContact CE2-CD2 3.55Å; W241-Y245 AromaticContact CG-CD2 3.75Å; W241-Y245 HydrophobicContact CG-CD2 3.75Å; W241-Y245 HydrophobicContact CG-CE2 4.18Å; W241-Y245 HydrophobicContact CZ2-CD2 4.24Å; W241-Y245 AromaticContact NE1-CD2 3.25Å; W241-Y245 AromaticContact NE1-CE2 3.46Å; W241-Y245 WeakPolarHBondContact O-CD2 3.35Å; W241-Y245 PolarHBondContact O-N 2.99Å; Y245-P247 VanDerWaalsContact O-CD 3.24Å; Y245-P247 WeakPolarHBondContact O-CD 3.35Å
246	C	96.9	Very high	97.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.098	C	C	.	.			trans	-122.4	54.7	-168.5	-51.5	0	0	0	0	114	C149 W241 F242 R248 V249 R327	C149-C246 HydrophobicContact CB-CB 3.78Å; C149-C246 WeakPolarHBondContact CB-SG 3.39Å; C149-C246 WeakPolarHBondContact SG-CB 3.38Å; C149-C246 CovalentContact SG-SG 2.03Å; C149-C246 PolarHBondContact SG-SG 2.75Å; W241-C246 VanDerWaalsContact CH2-SG 3.59Å; W241-C246 WeakPolarHBondContact CZ3-SG 3.25Å; F242-C246 HydrophobicContact CD2-CB 3.54Å; F242-C246 HydrophobicContact CE2-CB 3.67Å; F242-C246 HydrophobicContact CG-CB 4.11Å; F242-C246 HydrophobicContact CZ-CB 4.34Å; F242-C246 WeakPolarHBondContact O-CA 3.49Å; F242-C246 VanDerWaalsContact O-CB 3.29Å; F242-C246 WeakPolarHBondContact O-CB 3.5Å; F242-C246 PolarHBondContact O-N 3.01Å; C246-R248 PolarHBondContact O-N 2.82Å; C246-V249 HydrophobicContact CB-CB 4.42Å; C246-V249 HydrophobicContact CB-CG2 3.73Å; C246-V249 PolarHBondContact O-N 2.99Å; C246-R327 PolarHBondContact O-NH1 3.01Å
247	P	94	Very high	97.3	Very high	82 Å²	82	21 Å²	21	53%	0.532	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.7	-175.4	27	-34.8	0	0	0	113	Y245 R327	Y245-P247 VanDerWaalsContact O-CD 3.24Å; Y245-P247 WeakPolarHBondContact O-CD 3.35Å; P247-R327 PolarHBondContact O-NH1 3.29Å
248	R	94.9	Very high	97.3	Very high	141 Å²	141	22 Å²	22	53%	0.532	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	5.3	-173	-65.6	-172.1	-65.5	-154.2	-11.4	115.3	G151 C246 Q250	G151-R248 PolarHBondContact O-NE 3.48Å; C246-R248 PolarHBondContact O-N 2.82Å; R248-Q250 PolarHBondContact O-N 3.13Å
249	V	97.8	Very high	97.2	Very high	2 Å²	2	22 Å²	22	1%	0.012	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	128.1	173.8	175.9	0	0	0	0	109.4	I153 L156 F242 C246 Y251 V252	I153-V249 HydrophobicContact CB-CG2 3.96Å; I153-V249 HydrophobicContact CD1-CG2 4.15Å; I153-V249 HydrophobicContact CG2-CG1 4.42Å; I153-V249 HydrophobicContact CG2-CG2 4.19Å; I153-V249 WeakPolarHBondContact O-CA 3.29Å; L156-V249 HydrophobicContact CB-CG1 3.75Å; L156-V249 HydrophobicContact CB-CG2 4.48Å; L156-V249 HydrophobicContact CD2-CG2 4.44Å; F242-V249 HydrophobicContact CE2-CB 3.59Å; F242-V249 HydrophobicContact CE2-CG1 3.7Å; F242-V249 HydrophobicContact CE2-CG2 3.94Å; F242-V249 HydrophobicContact CZ-CB 3.68Å; F242-V249 HydrophobicContact CZ-CG1 3.89Å; F242-V249 HydrophobicContact CZ-CG2 4.48Å; C246-V249 HydrophobicContact CB-CB 4.42Å; C246-V249 HydrophobicContact CB-CG2 3.73Å; C246-V249 PolarHBondContact O-N 2.99Å; V249-Y251 VanDerWaalsContact CG1-O 3.25Å; V249-Y251 WeakPolarHBondContact CG1-O 3.25Å; V249-V252 HydrophobicContact CG1-CG2 4.22Å
250	Q	96.8	Very high	97.2	Very high	85 Å²	85	22 Å²	22	40%	0.397	11%	0.106	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-48.3	-179.1	-63.6	-172.2	23.8	0	0	112.9	I153 R248 G323	I153-Q250 PolarHBondContact O-N 3.49Å; I153-Q250 VanDerWaalsContact O-N 3.08Å; R248-Q250 PolarHBondContact O-N 3.13Å; Q250-G323 PolarHBondContact O-N 3.33Å
251	Y	98.3	Very high	97.2	Very high	10 Å²	10	21.4 Å²	21.4	4%	0.039	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.8	-178.9	-60.2	-80.2	0	0	0	111.5	Y154 L155 L156 V249 L270 L279 M321 H322	Y154-Y251 HydrophobicContact CD1-CD2 4.45Å; Y154-Y251 HydrophobicContact CE1-CD2 4.02Å; Y154-Y251 HydrophobicContact CE1-CE2 4.31Å; Y154-Y251 HydrophobicContact CE2-CD2 4.17Å; Y154-Y251 AromaticContact CE2-CE2 3.9Å; Y154-Y251 HydrophobicContact CE2-CE2 3.9Å; Y154-Y251 AromaticContact CZ-CD2 3.89Å; Y154-Y251 AromaticContact CZ-CE2 3.72Å; Y154-Y251 PolarHBondContact O-N 2.76Å; L155-Y251 WeakPolarHBondContact CA-O 3.42Å; L156-Y251 PolarHBondContact N-O 3.44Å; V249-Y251 VanDerWaalsContact CG1-O 3.25Å; V249-Y251 WeakPolarHBondContact CG1-O 3.25Å; Y251-L270 HydrophobicContact CD1-CD1 4.3Å; Y251-L270 HydrophobicContact CD1-CD2 3.57Å; Y251-L270 HydrophobicContact CD2-CD1 3.83Å; Y251-L270 HydrophobicContact CD2-CD2 4.34Å; Y251-L270 HydrophobicContact CE1-CD2 3.66Å; Y251-L270 HydrophobicContact CE2-CD1 4.41Å; Y251-L270 HydrophobicContact CE2-CD2 4.42Å; Y251-L270 HydrophobicContact CG-CD1 3.76Å; Y251-L270 HydrophobicContact CG-CD2 3.92Å; Y251-L270 HydrophobicContact CG-CG 4.45Å; Y251-L279 HydrophobicContact CD1-CD2 4.2Å; Y251-L279 HydrophobicContact CE1-CD2 3.9Å; Y251-M321 WeakPolarHBondContact CA-O 3.38Å; Y251-H322 HydrophobicContact CD1-CB 4.4Å; Y251-H322 HydrophobicContact CE1-CB 4.36Å; Y251-H322 AromaticContact CE1-CD2 3.61Å
252	V	98.6	Very high	97.2	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.2	174.1	-177.6	0	0	0	0	108.2	L156 V158 F238 F242 V249 L320 M321	L156-V252 WeakPolarHBondContact O-CA 3.24Å; V158-V252 HydrophobicContact CB-CG1 4.33Å; V158-V252 HydrophobicContact CG2-CG1 3.8Å; F238-V252 HydrophobicContact CE1-CG1 4.15Å; F238-V252 HydrophobicContact CZ-CG1 3.95Å; F242-V252 HydrophobicContact CD2-CG2 4.14Å; F242-V252 HydrophobicContact CE1-CG2 4.32Å; F242-V252 HydrophobicContact CE2-CG2 3.42Å; F242-V252 VanDerWaalsContact CE2-CG2 3.42Å; F242-V252 HydrophobicContact CZ-CG2 3.52Å; V249-V252 HydrophobicContact CG1-CG2 4.22Å; V252-L320 WeakPolarHBondContact O-CA 3.23Å; V252-M321 HydrophobicContact CB-CE 3.8Å; V252-M321 HydrophobicContact CB-CG 3.95Å; V252-M321 HydrophobicContact CG1-CE 3.65Å; V252-M321 HydrophobicContact CG2-CE 4.35Å; V252-M321 PolarHBondContact N-O 3.29Å; V252-M321 PolarHBondContact O-N 3.26Å
253	F	98.6	Very high	97.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.1	160.4	173.3	-99.6	0	0	0	108	L155 L156 M157 V158 W176 V261 I266 F319 L320 V388	L155-F253 HydrophobicContact CD1-CB 4.05Å; L156-F253 PolarHBondContact O-N 3.14Å; M157-F253 HydrophobicContact CE-CB 4.18Å; M157-F253 HydrophobicContact CE-CD1 3.34Å; M157-F253 HydrophobicContact CE-CE1 3.9Å; M157-F253 HydrophobicContact CE-CG 3.87Å; M157-F253 HydrophobicContact SD-CB 3.59Å; M157-F253 VanDerWaalsContact SD-CB 3.59Å; M157-F253 HydrophobicContact SD-CD1 3.88Å; M157-F253 HydrophobicContact SD-CG 3.97Å; V158-F253 PolarHBondContact N-O 3.47Å; W176-F253 HydrophobicContact CZ3-CE1 4.35Å; F253-V261 HydrophobicContact CE1-CG1 4.31Å; F253-V261 HydrophobicContact CE1-CG2 3.77Å; F253-V261 HydrophobicContact CE2-CG1 4.27Å; F253-V261 HydrophobicContact CE2-CG2 4.5Å; F253-V261 HydrophobicContact CZ-CB 4.49Å; F253-V261 HydrophobicContact CZ-CG1 4.04Å; F253-V261 HydrophobicContact CZ-CG2 3.57Å; F253-I266 HydrophobicContact CD2-CD1 3.95Å; F253-I266 HydrophobicContact CE2-CD1 4.45Å; F253-I266 HydrophobicContact CG-CD1 4.24Å; F253-F319 WeakPolarHBondContact CD2-O 3.45Å; F253-L320 HydrophobicContact CB-CD2 3.65Å; F253-L320 HydrophobicContact CD2-CD2 3.84Å; F253-L320 HydrophobicContact CD2-CG 4.21Å; F253-L320 HydrophobicContact CG-CD2 4.24Å; F253-V388 HydrophobicContact CE2-CG2 3.56Å; F253-V388 HydrophobicContact CZ-CG2 3.81Å
254	K	98.2	Very high	97.1	Very high	1 Å²	1	28.3 Å²	28.3	0%	0.004	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.7	170.1	-141.7	-165.4	98.2	-144.4	0	109.8	V158 E235 G318 F319	V158-K254 HydrophobicContact CB-CG 4.14Å; V158-K254 HydrophobicContact CG1-CG 4.17Å; V158-K254 VanDerWaalsContact O-CA 3.29Å; V158-K254 WeakPolarHBondContact O-CA 3.43Å; V158-K254 WeakPolarHBondContact O-CG 3.33Å; E235-K254 WeakPolarHBondContact OE1-CE 3.17Å; E235-K254 IonicContact OE1-NZ 3.98Å; E235-K254 PolarHBondContact OE1-NZ 2.73Å; E235-K254 WeakPolarHBondContact OE2-CD 3.29Å; E235-K254 WeakPolarHBondContact OE2-CE 3.42Å; E235-K254 IonicContact OE2-NZ 3.24Å; E235-K254 PolarHBondContact OE2-NZ 3.4Å; K254-G318 CarbonylContact O-C 3.29Å; K254-G318 WeakPolarHBondContact O-CA 3.47Å; K254-F319 HydrophobicContact CB-CD2 4.16Å; K254-F319 HydrophobicContact CB-CE1 4.31Å; K254-F319 HydrophobicContact CB-CE2 3.61Å; K254-F319 HydrophobicContact CB-CZ 3.71Å; K254-F319 HydrophobicContact CD-CE2 4.28Å; K254-F319 HydrophobicContact CD-CZ 3.75Å; K254-F319 HydrophobicContact CG-CZ 4.36Å; K254-F319 PolarHBondContact N-O 3.24Å; K254-F319 VanDerWaalsContact NZ-CZ 3.34Å; K254-F319 PolarHBondContact O-N 2.97Å
255	G	97.1	Very high	97.1	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.01	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	175	179.3	0	0	0	0	0	113.8	V158 I159 K160 G317	V158-G255 PolarHBondContact O-N 3.39Å; V158-G255 VanDerWaalsContact O-N 3.08Å; I159-G255 WeakPolarHBondContact CA-O 3.35Å; K160-G255 PolarHBondContact N-O 3.26Å; G255-G317 WeakPolarHBondContact CA-O 3.26Å
256	D	97.4	Very high	97.1	Very high	37 Å²	37	27 Å²	27	20%	0.198	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	165.4	173.9	-71.7	-22	0	0	0	111.2	K160 D258 V259 G316 G317	K160-D256 WeakPolarHBondContact CE-OD1 3.35Å; K160-D256 IonicContact NZ-OD1 3.71Å; K160-D256 PolarHBondContact NZ-OD1 2.86Å; D256-D258 VanDerWaalsContact C-N 3.29Å; D256-D258 PolarHBondContact O-N 3.43Å; D256-V259 WeakPolarHBondContact O-CG2 3.09Å; D256-G316 VanDerWaalsContact OD2-O 3.06Å; D256-G317 PolarHBondContact N-O 2.57Å
257	D	97.6	Very high	97.1	Very high	13 Å²	13	27.5 Å²	27.5	7%	0.07	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	5	179.3	67.6	8.9	0	0	0	114.6	I159 K160 S161 Q165 R168 I172	I159-D257 HydrophobicContact CG2-CB 3.8Å; K160-D257 WeakPolarHBondContact O-CB 3.37Å; K160-D257 PolarHBondContact O-N 3.38Å; S161-D257 WeakPolarHBondContact CA-OD2 3.41Å; S161-D257 VanDerWaalsContact CB-OD2 3.32Å; S161-D257 WeakPolarHBondContact CB-OD2 3.32Å; S161-D257 PolarHBondContact OG-OD2 2.83Å; Q165-D257 WeakPolarHBondContact CB-OD2 3.08Å; R168-D257 HydrophobicContact CB-CB 4.13Å; R168-D257 WeakPolarHBondContact CD-OD1 3.16Å; R168-D257 IonicContact CZ-OD1 3.36Å; R168-D257 IonicContact NE-OD1 3.23Å; R168-D257 IonicContact NH1-OD1 2.67Å; R168-D257 PolarHBondContact NH1-OD1 2.87Å; I172-D257 HydrophobicContact CD1-CB 3.95Å
258	D	96.8	Very high	97.1	Very high	21 Å²	21	27.3 Å²	27.3	11%	0.112	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	25.2	177.9	66.9	-7.2	0	0	0	114.2	R168 D256 H390 K391 L392	R168-D258 IonicContact NH1-OD2 2.84Å; D256-D258 VanDerWaalsContact C-N 3.29Å; D256-D258 PolarHBondContact O-N 3.43Å; D258-H390 IonicContact OD1-CD2 3.08Å; D258-H390 PolarHBondContact OD1-CD2 3.42Å; D258-H390 VanDerWaalsContact OD1-CD2 3.24Å; D258-H390 IonicContact OD1-NE2 3.18Å; D258-H390 PolarHBondContact OD1-NE2 2.98Å; D258-H390 VanDerWaalsContact OD1-NE2 3.08Å; D258-H390 IonicContact OD2-CE1 3.97Å; D258-H390 IonicContact OD2-NE2 3.99Å; D258-H390 PolarHBondContact OD2-NE2 3.25Å; D258-K391 HydrophobicContact CB-CB 4.34Å; D258-K391 CarbonylContact O-C 3.58Å; D258-K391 WeakPolarHBondContact O-CA 3.41Å; D258-K391 VanDerWaalsContact O-CB 3.32Å; D258-K391 WeakPolarHBondContact O-CB 3.34Å; D258-L392 PolarHBondContact O-N 2.84Å
259	V	96.9	Very high	97.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	157	175.9	-60.3	0	0	0	0	113.5	W176 D256 V261 G317 V388 V389 H390	W176-V259 HydrophobicContact CH2-CG2 4.47Å; W176-V259 HydrophobicContact CZ2-CG2 4.15Å; W176-V259 PolarHBondContact NE1-O 2.9Å; D256-V259 WeakPolarHBondContact O-CG2 3.09Å; V259-V261 HydrophobicContact CG2-CG2 3.7Å; V259-G317 WeakPolarHBondContact CG1-O 3.43Å; V259-V388 HydrophobicContact CB-CG1 4.03Å; V259-V388 HydrophobicContact CG1-CG1 4.06Å; V259-V388 HydrophobicContact CG2-CG1 4.34Å; V259-V389 WeakPolarHBondContact CA-O 3.22Å; V259-H390 HydrophobicContact CG1-CB 4.12Å
260	F	97.4	Very high	97	Very high	1 Å²	1	21.8 Å²	21.8	0%	0.004	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	136.9	158.5	178.4	-87.5	0	0	0	109.5	F383 V388 V389 L392 L397 M400 W401 V404	F260-F383 HydrophobicContact CB-CD1 3.91Å; F260-F383 HydrophobicContact CB-CE1 3.88Å; F260-F383 AromaticContact CD1-CD1 3.69Å; F260-F383 HydrophobicContact CD1-CD1 3.69Å; F260-F383 HydrophobicContact CD1-CE1 4.48Å; F260-F383 HydrophobicContact CD2-CD1 4.08Å; F260-F383 HydrophobicContact CE1-CB 4.25Å; F260-F383 HydrophobicContact CE1-CD1 4.19Å; F260-F383 AromaticContact CG-CD1 3.62Å; F260-F383 HydrophobicContact CG-CD1 3.62Å; F260-F383 HydrophobicContact CG-CE1 4.1Å; F260-F383 HydrophobicContact CZ-CB 4.48Å; F260-V388 WeakPolarHBondContact O-CA 3.38Å; F260-V389 HydrophobicContact CB-CB 4.43Å; F260-V389 PolarHBondContact N-O 3.3Å; F260-V389 PolarHBondContact O-N 3.39Å; F260-L392 HydrophobicContact CB-CD1 3.91Å; F260-L392 HydrophobicContact CD2-CD1 4.34Å; F260-L397 HydrophobicContact CB-CD1 4.12Å; F260-L397 HydrophobicContact CD2-CD1 4.02Å; F260-M400 HydrophobicContact CD2-CG 4.11Å; F260-M400 HydrophobicContact CE2-CG 4.22Å; F260-W401 HydrophobicContact CD2-CE3 4.48Å; F260-W401 AromaticContact CE2-CE3 3.71Å; F260-W401 HydrophobicContact CE2-CE3 3.71Å; F260-W401 HydrophobicContact CE2-CZ3 4.32Å; F260-W401 HydrophobicContact CZ-CE3 4.14Å; F260-W401 HydrophobicContact CZ-CZ3 4.33Å; F260-V404 HydrophobicContact CE2-CG2 4.39Å; F260-V404 HydrophobicContact CZ-CB 4.25Å; F260-V404 HydrophobicContact CZ-CG1 4.08Å; F260-V404 HydrophobicContact CZ-CG2 4.2Å
261	V	97.9	Very high	96.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.6	174.2	-170.8	0	0	0	0	110.9	M157 W176 F253 V259 I266 I387	M157-V261 HydrophobicContact CE-CG1 4Å; W176-V261 HydrophobicContact CB-CB 4.21Å; W176-V261 WeakPolarHBondContact CB-O 3.13Å; W176-V261 HydrophobicContact CD2-CB 3.74Å; W176-V261 HydrophobicContact CD2-CG2 3.79Å; W176-V261 HydrophobicContact CE3-CB 3.78Å; W176-V261 HydrophobicContact CE3-CG2 3.74Å; W176-V261 HydrophobicContact CG-CB 3.96Å; W176-V261 HydrophobicContact CG-CG2 4.44Å; W176-V261 HydrophobicContact CH2-CG2 3.96Å; W176-V261 HydrophobicContact CZ2-CG2 4Å; W176-V261 HydrophobicContact CZ3-CB 4.36Å; W176-V261 HydrophobicContact CZ3-CG2 3.84Å; F253-V261 HydrophobicContact CE1-CG1 4.31Å; F253-V261 HydrophobicContact CE1-CG2 3.77Å; F253-V261 HydrophobicContact CE2-CG1 4.27Å; F253-V261 HydrophobicContact CE2-CG2 4.5Å; F253-V261 HydrophobicContact CZ-CB 4.49Å; F253-V261 HydrophobicContact CZ-CG1 4.04Å; F253-V261 HydrophobicContact CZ-CG2 3.57Å; V259-V261 HydrophobicContact CG2-CG2 3.7Å; V261-I266 HydrophobicContact CG1-CD1 3.47Å; V261-I266 VanDerWaalsContact CG1-CD1 3.47Å; V261-I266 HydrophobicContact CG1-CG1 4.47Å; V261-I387 CarbonylContact C-O 3.6Å; V261-I387 VanDerWaalsContact CA-O 3.27Å; V261-I387 WeakPolarHBondContact CA-O 3.42Å
262	S	97.6	Very high	95.9	Very high	12 Å²	12	25.6 Å²	25.6	8%	0.084	14%	0.143	C	C	.	.			trans	-95.3	103.6	169.8	178.7	0	0	0	0	110.2	E264 N265 I266 M386 I387	S262-E264 VanDerWaalsContact C-N 3.31Å; S262-E264 PolarHBondContact O-N 3.32Å; S262-N265 WeakPolarHBondContact CB-ND2 3.44Å; S262-N265 PolarHBondContact O-N 3.39Å; S262-N265 WeakPolarHBondContact OG-CB 3.35Å; S262-N265 PolarHBondContact OG-N 3.47Å; S262-N265 PolarHBondContact OG-ND2 2.86Å; S262-N265 VanDerWaalsContact OG-ND2 3.12Å; S262-I266 WeakPolarHBondContact O-CG1 3.44Å; S262-I266 PolarHBondContact O-N 2.84Å; S262-I266 VanDerWaalsContact O-N 3.08Å; S262-M386 WeakPolarHBondContact CB-O 3.38Å; S262-I387 PolarHBondContact N-O 3.28Å
263	V	97.4	Very high	94.8	Very high	7 Å²	7	26.9 Å²	26.9	4%	0.042	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-39.7	177.7	178.3	0	0	0	0	111.1	W176 I187 N265 I266 L267	W176-V263 HydrophobicContact CB-CG2 4.41Å; W176-V263 WeakPolarHBondContact O-CG2 3.18Å; I187-V263 HydrophobicContact CD1-CG1 3.54Å; V263-N265 PolarHBondContact O-N 2.88Å; V263-I266 WeakPolarHBondContact O-CB 3.31Å; V263-I266 PolarHBondContact O-N 3.39Å; V263-L267 HydrophobicContact CG1-CD1 4.47Å; V263-L267 HydrophobicContact CG1-CG 4.48Å; V263-L267 WeakPolarHBondContact O-CG 3.23Å; V263-L267 PolarHBondContact O-N 3.43Å
264	E	95.6	Very high	93.1	Very high	141 Å²	141	29.8 Å²	29.8	66%	0.659	17%	0.172	S	C	*	.	H	α-helix	trans	-58.3	-47.8	176.7	-174.1	178.4	-175.2	0	0	111.3	S262 I266 L267 E268	S262-E264 VanDerWaalsContact C-N 3.31Å; S262-E264 PolarHBondContact O-N 3.32Å; E264-I266 VanDerWaalsContact C-N 3.3Å; E264-I266 PolarHBondContact O-N 2.88Å; E264-L267 PolarHBondContact O-N 3.31Å; E264-L267 VanDerWaalsContact O-N 3.14Å; E264-E268 PolarHBondContact O-N 2.93Å
265	N	96.6	Very high	91.9	Very high	13 Å²	13	37.7 Å²	37.7	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-67.6	-30.5	178.8	-65.2	-18.1	0	0	0	112.3	W72 S262 V263 F269 K384 M386 I387	W72-N265 HydrophobicContact CZ2-CB 4.32Å; S262-N265 WeakPolarHBondContact CB-ND2 3.44Å; S262-N265 PolarHBondContact O-N 3.39Å; S262-N265 WeakPolarHBondContact OG-CB 3.35Å; S262-N265 PolarHBondContact OG-N 3.47Å; S262-N265 PolarHBondContact OG-ND2 2.86Å; S262-N265 VanDerWaalsContact OG-ND2 3.12Å; V263-N265 PolarHBondContact O-N 2.88Å; N265-F269 VanDerWaalsContact O-CB 3.24Å; N265-F269 WeakPolarHBondContact O-CB 3.32Å; N265-F269 PolarHBondContact O-N 3.45Å; N265-K384 PolarHBondContact ND2-O 3.41Å; N265-M386 PolarHBondContact ND2-O 3.2Å; N265-I387 HydrophobicContact CB-CG1 3.8Å
266	I	97.4	Very high	91.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-50	170.7	-69	173.7	0	0	0	109.9	L155 M157 F253 V261 S262 V263 E264 F269 L270 L320 I387	L155-I266 HydrophobicContact CD1-CG2 4.38Å; L155-I266 HydrophobicContact CD2-CG2 3.68Å; M157-I266 HydrophobicContact CE-CD1 4.38Å; F253-I266 HydrophobicContact CD2-CD1 3.95Å; F253-I266 HydrophobicContact CE2-CD1 4.45Å; F253-I266 HydrophobicContact CG-CD1 4.24Å; V261-I266 HydrophobicContact CG1-CD1 3.47Å; V261-I266 VanDerWaalsContact CG1-CD1 3.47Å; V261-I266 HydrophobicContact CG1-CG1 4.47Å; S262-I266 WeakPolarHBondContact O-CG1 3.44Å; S262-I266 PolarHBondContact O-N 2.84Å; S262-I266 VanDerWaalsContact O-N 3.08Å; V263-I266 WeakPolarHBondContact O-CB 3.31Å; V263-I266 PolarHBondContact O-N 3.39Å; E264-I266 VanDerWaalsContact C-N 3.3Å; E264-I266 PolarHBondContact O-N 2.88Å; I266-F269 PolarHBondContact O-N 3.46Å; I266-L270 HydrophobicContact CG2-CD1 3.68Å; I266-L270 HydrophobicContact CG2-CG 4.17Å; I266-L270 WeakPolarHBondContact O-CB 3.34Å; I266-L270 VanDerWaalsContact O-CG 3.27Å; I266-L270 WeakPolarHBondContact O-CG 3.44Å; I266-L270 PolarHBondContact O-N 3.37Å; I266-L320 HydrophobicContact CD1-CD2 4.31Å; I266-L320 HydrophobicContact CG1-CD1 4.27Å; I266-L320 HydrophobicContact CG1-CD2 4.46Å; I266-L320 HydrophobicContact CG2-CD1 3.96Å; I266-L320 HydrophobicContact CG2-CD2 3.77Å; I266-I387 HydrophobicContact CD1-CG2 4.17Å; I266-I387 HydrophobicContact CG1-CG2 3.51Å
267	L	96.3	Very high	91.5	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-44.4	-177.9	-64.1	-178.2	0	0	0	111.5	Y154 V182 K185 I187 V263 E264 F269 L270 E271	Y154-L267 HydrophobicContact CD1-CD2 3.93Å; Y154-L267 HydrophobicContact CE1-CD2 3.82Å; V182-L267 HydrophobicContact CB-CD1 3.75Å; V182-L267 HydrophobicContact CG1-CD1 3.74Å; V182-L267 HydrophobicContact CG2-CD1 4.39Å; K185-L267 HydrophobicContact CD-CD2 3.94Å; I187-L267 HydrophobicContact CD1-CD1 4.26Å; V263-L267 HydrophobicContact CG1-CD1 4.47Å; V263-L267 HydrophobicContact CG1-CG 4.48Å; V263-L267 WeakPolarHBondContact O-CG 3.23Å; V263-L267 PolarHBondContact O-N 3.43Å; E264-L267 PolarHBondContact O-N 3.31Å; E264-L267 VanDerWaalsContact O-N 3.14Å; L267-F269 VanDerWaalsContact C-N 3.34Å; L267-F269 PolarHBondContact O-N 2.91Å; L267-L270 PolarHBondContact O-N 2.9Å; L267-E271 WeakPolarHBondContact O-CG 3.11Å; L267-E271 PolarHBondContact O-N 3.41Å
268	E	94.6	Very high	91.4	Very high	79 Å²	79	48.4 Å²	48.4	37%	0.369	26%	0.26	S	S	.	.	H	α-helix	trans	-60.9	-43.2	176.5	-165.4	-170.9	170.1	0	0	111.5	W72 E264 E271 G272	W72-E268 PolarHBondContact NE1-OE1 3.37Å; W72-E268 PolarHBondContact NE1-OE2 3.2Å; E264-E268 PolarHBondContact O-N 2.93Å; E268-E271 PolarHBondContact O-N 2.91Å; E268-G272 PolarHBondContact O-N 3.41Å
269	F	95.1	Very high	91.4	Very high	26 Å²	26	47.9 Å²	47.9	11%	0.114	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-44.5	175.4	171.7	-93.1	0	0	0	112	N265 I266 L267 E271 G272 S273 L279 V281 L320 H360 I387	N265-F269 VanDerWaalsContact O-CB 3.24Å; N265-F269 WeakPolarHBondContact O-CB 3.32Å; N265-F269 PolarHBondContact O-N 3.45Å; I266-F269 PolarHBondContact O-N 3.46Å; L267-F269 VanDerWaalsContact C-N 3.34Å; L267-F269 PolarHBondContact O-N 2.91Å; F269-E271 VanDerWaalsContact C-N 3.35Å; F269-E271 PolarHBondContact O-N 2.96Å; F269-G272 PolarHBondContact O-N 2.87Å; F269-S273 PolarHBondContact O-N 3.47Å; F269-S273 PolarHBondContact O-OG 3.41Å; F269-L279 HydrophobicContact CE1-CD1 4.42Å; F269-L279 HydrophobicContact CE1-CD2 4.37Å; F269-L279 HydrophobicContact CZ-CD1 4.38Å; F269-V281 HydrophobicContact CE1-CG1 3.68Å; F269-V281 HydrophobicContact CZ-CB 4.31Å; F269-V281 HydrophobicContact CZ-CG1 3.81Å; F269-V281 HydrophobicContact CZ-CG2 3.99Å; F269-L320 HydrophobicContact CD1-CD1 3.96Å; F269-L320 HydrophobicContact CE1-CD1 4.29Å; F269-H360 AromaticContact CD2-NE2 3.75Å; F269-H360 AromaticContact CE2-CD2 3.75Å; F269-H360 AromaticContact CE2-NE2 3.84Å; F269-I387 HydrophobicContact CB-CD1 4.09Å; F269-I387 HydrophobicContact CG-CD1 4.28Å
270	L	94.6	Very high	91.5	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-69.3	-29	-178.2	-70.9	178.6	0	0	0	113.2	Y154 L155 Y251 I266 L267 S273 L279	Y154-L270 HydrophobicContact CE1-CB 4.28Å; Y154-L270 HydrophobicContact CE1-CD1 3.85Å; Y154-L270 WeakPolarHBondContact OH-CB 3.36Å; L155-L270 HydrophobicContact CD1-CD1 4.49Å; Y251-L270 HydrophobicContact CD1-CD1 4.3Å; Y251-L270 HydrophobicContact CD1-CD2 3.57Å; Y251-L270 HydrophobicContact CD2-CD1 3.83Å; Y251-L270 HydrophobicContact CD2-CD2 4.34Å; Y251-L270 HydrophobicContact CE1-CD2 3.66Å; Y251-L270 HydrophobicContact CE2-CD1 4.41Å; Y251-L270 HydrophobicContact CE2-CD2 4.42Å; Y251-L270 HydrophobicContact CG-CD1 3.76Å; Y251-L270 HydrophobicContact CG-CD2 3.92Å; Y251-L270 HydrophobicContact CG-CG 4.45Å; I266-L270 HydrophobicContact CG2-CD1 3.68Å; I266-L270 HydrophobicContact CG2-CG 4.17Å; I266-L270 WeakPolarHBondContact O-CB 3.34Å; I266-L270 VanDerWaalsContact O-CG 3.27Å; I266-L270 WeakPolarHBondContact O-CG 3.44Å; I266-L270 PolarHBondContact O-N 3.37Å; L267-L270 PolarHBondContact O-N 2.9Å; L270-S273 WeakPolarHBondContact CA-OG 3.39Å; L270-S273 PolarHBondContact O-N 2.96Å; L270-L279 HydrophobicContact CD2-CD2 3.9Å
271	E	90.1	Very high	91.5	Very high	106 Å²	106	47.9 Å²	47.9	50%	0.495	26%	0.257	S	S	.	.	H	α-helix	trans	-65	-40.5	171.8	-75.4	-179.6	179.2	0	0	112.3	K185 L267 E268 F269 S273	K185-E271 WeakPolarHBondContact CE-OE1 3.48Å; K185-E271 IonicContact NZ-OE1 2.74Å; K185-E271 PolarHBondContact NZ-OE1 3.37Å; L267-E271 WeakPolarHBondContact O-CG 3.11Å; L267-E271 PolarHBondContact O-N 3.41Å; E268-E271 PolarHBondContact O-N 2.91Å; F269-E271 VanDerWaalsContact C-N 3.35Å; F269-E271 PolarHBondContact O-N 2.96Å; E271-S273 VanDerWaalsContact C-N 3.34Å
272	G	82.4	Confident	91.5	Very high	70 Å²	70	47.9 Å²	47.9	72%	0.722	26%	0.257	S	S	*	.	H	α-helix	trans	-78	-15.2	179.6	0	0	0	0	0	114.9	E268 F269	E268-G272 PolarHBondContact O-N 3.41Å; F269-G272 PolarHBondContact O-N 2.87Å
273	S	76	Confident	91.4	Very high	27 Å²	27	48.6 Å²	48.6	19%	0.189	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	12.3	-175.3	46.9	0	0	0	0	113.7	F269 L270 E271 H275	F269-S273 PolarHBondContact O-N 3.47Å; F269-S273 PolarHBondContact O-OG 3.41Å; L270-S273 WeakPolarHBondContact CA-OG 3.39Å; L270-S273 PolarHBondContact O-N 2.96Å; E271-S273 VanDerWaalsContact C-N 3.34Å; S273-H275 PolarHBondContact O-N 3.45Å
274	S	63.3	Low	91.4	Very high	61 Å²	61	48.4 Å²	48.4	43%	0.427	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	131.5	-172.6	62.1	0	0	0	0	112.4
275	H	72.1	Confident	91.5	Very high	167 Å²	167	43.7 Å²	43.7	77%	0.773	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.2	-4.7	172.2	-46.3	-64.1	0	0	0	119.1	S273 K277	S273-H275 PolarHBondContact O-N 3.45Å; H275-K277 PolarHBondContact O-N 3.38Å; H275-K277 VanDerWaalsContact O-N 3.12Å
276	D	90.7	Very high	91.5	Very high	78 Å²	78	48 Å²	48	42%	0.417	26%	0.256	S	S	.	.			trans	-79.3	98.9	171.4	-168.6	-2.5	0	0	0	111.8	N278 L279	D276-N278 PolarHBondContact O-N 3.39Å; D276-N278 WeakPolarHBondContact OD1-CA 3.34Å; D276-N278 WeakPolarHBondContact OD1-CB 3.42Å; D276-N278 PolarHBondContact OD1-N 3.12Å; D276-L279 HydrophobicContact CB-CB 4.34Å; D276-L279 VanDerWaalsContact O-CB 3.25Å; D276-L279 WeakPolarHBondContact O-CB 3.39Å; D276-L279 PolarHBondContact O-N 3.04Å
277	K	94.4	Very high	91.4	Very high	130 Å²	130	55.8 Å²	55.8	57%	0.565	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-13	175.9	-67.8	-174.8	179.3	-179.3	0	113.5	H275 T324	H275-K277 PolarHBondContact O-N 3.38Å; H275-K277 VanDerWaalsContact O-N 3.12Å; K277-T324 HydrophobicContact CB-CG2 4.36Å
278	N	96	Very high	91.5	Very high	68 Å²	68	56 Å²	56	36%	0.364	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	11.4	174.6	-63.7	-39.2	0	0	0	112.8	D276 F280 L325 R328 V355	D276-N278 PolarHBondContact O-N 3.39Å; D276-N278 WeakPolarHBondContact OD1-CA 3.34Å; D276-N278 WeakPolarHBondContact OD1-CB 3.42Å; D276-N278 PolarHBondContact OD1-N 3.12Å; N278-F280 PolarHBondContact O-N 3.39Å; N278-F280 VanDerWaalsContact O-N 3.12Å; N278-L325 WeakPolarHBondContact O-CD2 3.5Å; N278-R328 PolarHBondContact OD1-NH1 3.09Å; N278-V355 HydrophobicContact CB-CG1 4.24Å; N278-V355 HydrophobicContact CB-CG2 4.35Å
279	L	97.3	Very high	91.6	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.047	30%	0.302	C	S	.	.			trans	-56.1	120.8	178	179.9	70	0	0	0	110.7	Y251 F269 L270 D276 V281 M321 H322 L325	Y251-L279 HydrophobicContact CD1-CD2 4.2Å; Y251-L279 HydrophobicContact CE1-CD2 3.9Å; F269-L279 HydrophobicContact CE1-CD1 4.42Å; F269-L279 HydrophobicContact CE1-CD2 4.37Å; F269-L279 HydrophobicContact CZ-CD1 4.38Å; L270-L279 HydrophobicContact CD2-CD2 3.9Å; D276-L279 HydrophobicContact CB-CB 4.34Å; D276-L279 VanDerWaalsContact O-CB 3.25Å; D276-L279 WeakPolarHBondContact O-CB 3.39Å; D276-L279 PolarHBondContact O-N 3.04Å; L279-V281 HydrophobicContact CD1-CB 4.2Å; L279-V281 HydrophobicContact CD1-CG1 4.05Å; L279-V281 HydrophobicContact CG-CG1 4.35Å; L279-M321 CarbonylContact O-C 3.54Å; L279-M321 VanDerWaalsContact O-CA 3.22Å; L279-M321 WeakPolarHBondContact O-CA 3.34Å; L279-H322 HydrophobicContact CB-CB 4.09Å; L279-H322 PolarHBondContact O-N 3.17Å; L279-L325 WeakPolarHBondContact O-CD2 3.35Å
280	F	98.1	Very high	91.7	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.009	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	113.2	164.9	-164.3	-76.8	0	0	0	107.4	N278 A314 F319 L320 M321 L325 L329 L350 P357 V358	N278-F280 PolarHBondContact O-N 3.39Å; N278-F280 VanDerWaalsContact O-N 3.12Å; F280-A314 HydrophobicContact CE1-CB 3.8Å; F280-F319 HydrophobicContact CE1-CB 4.24Å; F280-F319 HydrophobicContact CE1-CD2 4.05Å; F280-F319 HydrophobicContact CE1-CG 4.04Å; F280-F319 AromaticContact CE2-CD2 3.91Å; F280-F319 HydrophobicContact CE2-CD2 3.91Å; F280-F319 AromaticContact CE2-CE2 3.82Å; F280-F319 HydrophobicContact CE2-CE2 3.82Å; F280-F319 HydrophobicContact CZ-CD1 4.26Å; F280-F319 AromaticContact CZ-CD2 3.51Å; F280-F319 HydrophobicContact CZ-CD2 3.51Å; F280-F319 HydrophobicContact CZ-CE1 4.32Å; F280-F319 AromaticContact CZ-CE2 3.6Å; F280-F319 HydrophobicContact CZ-CE2 3.6Å; F280-F319 AromaticContact CZ-CG 3.86Å; F280-F319 HydrophobicContact CZ-CG 3.86Å; F280-F319 HydrophobicContact CZ-CZ 4.01Å; F280-L320 CarbonylContact C-O 3.55Å; F280-L320 WeakPolarHBondContact CA-O 3.21Å; F280-M321 HydrophobicContact CD2-CB 3.84Å; F280-M321 HydrophobicContact CD2-SD 4.44Å; F280-M321 HydrophobicContact CE2-CB 4.34Å; F280-M321 HydrophobicContact CE2-SD 4.16Å; F280-L325 HydrophobicContact CB-CD2 3.65Å; F280-L325 HydrophobicContact CD2-CD2 3.94Å; F280-L325 HydrophobicContact CG-CD2 4.29Å; F280-L329 HydrophobicContact CD2-CD1 4.22Å; F280-L329 HydrophobicContact CE2-CD1 4.04Å; F280-L350 HydrophobicContact CB-CD2 4.27Å; F280-L350 HydrophobicContact CD1-CD1 3.84Å; F280-L350 HydrophobicContact CD2-CD1 4.05Å; F280-L350 HydrophobicContact CD2-CD2 3.89Å; F280-L350 HydrophobicContact CD2-CG 4.47Å; F280-L350 HydrophobicContact CE1-CD1 3.89Å; F280-L350 HydrophobicContact CE2-CD1 4.1Å; F280-L350 HydrophobicContact CE2-CD2 4.45Å; F280-L350 HydrophobicContact CG-CD1 3.92Å; F280-L350 HydrophobicContact CG-CD2 4.08Å; F280-L350 HydrophobicContact CZ-CD1 4.02Å; F280-P357 HydrophobicContact CB-CB 4.48Å; F280-P357 HydrophobicContact CD1-CB 3.7Å; F280-P357 HydrophobicContact CE1-CB 4.41Å; F280-P357 HydrophobicContact CG-CB 4.44Å; F280-P357 CarbonylContact O-C 3.47Å; F280-P357 WeakPolarHBondContact O-CA 3.25Å; F280-V358 PolarHBondContact O-N 2.87Å
281	V	97.6	Very high	91.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	137.9	-169.9	62.3	0	0	0	0	112	F269 L279 F319 L320 V358 H360 F363	F269-V281 HydrophobicContact CE1-CG1 3.68Å; F269-V281 HydrophobicContact CZ-CB 4.31Å; F269-V281 HydrophobicContact CZ-CG1 3.81Å; F269-V281 HydrophobicContact CZ-CG2 3.99Å; L279-V281 HydrophobicContact CD1-CB 4.2Å; L279-V281 HydrophobicContact CD1-CG1 4.05Å; L279-V281 HydrophobicContact CG-CG1 4.35Å; V281-F319 CarbonylContact O-C 3.59Å; V281-F319 VanDerWaalsContact O-CA 3.26Å; V281-F319 WeakPolarHBondContact O-CA 3.41Å; V281-F319 VanDerWaalsContact O-CB 3.27Å; V281-F319 WeakPolarHBondContact O-CB 3.49Å; V281-L320 HydrophobicContact CG1-CB 3.67Å; V281-L320 HydrophobicContact CG1-CD1 4.34Å; V281-L320 PolarHBondContact N-O 3Å; V281-L320 PolarHBondContact O-N 3.41Å; V281-V358 VanDerWaalsContact CA-O 3.29Å; V281-V358 WeakPolarHBondContact CA-O 3.2Å; V281-V358 HydrophobicContact CB-CB 4.27Å; V281-V358 HydrophobicContact CG2-CB 4.25Å; V281-V358 HydrophobicContact CG2-CG1 4.34Å; V281-V358 WeakPolarHBondContact CG2-O 3.32Å; V281-H360 HydrophobicContact CG2-CB 3.46Å; V281-H360 VanDerWaalsContact CG2-CB 3.46Å; V281-F363 HydrophobicContact CG2-CE2 4.37Å
282	G	97.6	Very high	92.1	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	-158.2	178.9	0	0	0	0	0	112.5	V284 V358 K359 H360	G282-V284 PolarHBondContact O-N 3.32Å; G282-V284 VanDerWaalsContact O-N 3.12Å; G282-V358 PolarHBondContact N-O 3.36Å; G282-V358 VanDerWaalsContact N-O 3.12Å; G282-K359 CarbonylContact O-C 3.45Å; G282-K359 WeakPolarHBondContact O-CA 3.22Å; G282-H360 PolarHBondContact O-N 3.39Å
283	D	96.8	Very high	92.8	Very high	27 Å²	27	61.4 Å²	61.4	14%	0.144	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	83.4	171.3	-168.7	6.6	0	0	0	109.6	A314 G315 F363 T365	D283-A314 WeakPolarHBondContact O-CA 3.37Å; D283-G315 PolarHBondContact O-N 3.09Å; D283-F363 HydrophobicContact CB-CB 3.91Å; D283-T365 HydrophobicContact CB-CG2 3.64Å; D283-T365 PolarHBondContact OD2-N 3.33Å; D283-T365 PolarHBondContact OD2-OG1 2.72Å
284	V	97.8	Very high	93.6	Very high	3 Å²	3	65.6 Å²	65.6	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.7	-172.8	-178	0	0	0	0	111.7	G282 F286 P312 Y313 A314 P357 V358 K359	G282-V284 PolarHBondContact O-N 3.32Å; G282-V284 VanDerWaalsContact O-N 3.12Å; V284-F286 HydrophobicContact CB-CE2 3.93Å; V284-F286 HydrophobicContact CB-CZ 4.3Å; V284-F286 HydrophobicContact CG1-CD2 4.03Å; V284-F286 HydrophobicContact CG1-CE1 4.13Å; V284-F286 HydrophobicContact CG1-CE2 3.48Å; V284-F286 VanDerWaalsContact CG1-CE2 3.48Å; V284-F286 HydrophobicContact CG1-CZ 3.53Å; V284-P312 HydrophobicContact CG1-CB 4.14Å; V284-Y313 CarbonylContact C-O 3.58Å; V284-Y313 WeakPolarHBondContact CA-O 3.35Å; V284-A314 HydrophobicContact CG2-CB 4.37Å; V284-P357 HydrophobicContact CG1-CB 4.35Å; V284-P357 HydrophobicContact CG1-CG 3.89Å; V284-P357 HydrophobicContact CG2-CB 3.85Å; V284-P357 HydrophobicContact CG2-CG 4.3Å; V284-V358 VanDerWaalsContact CG2-O 3.3Å; V284-V358 WeakPolarHBondContact CG2-O 3.27Å; V284-K359 HydrophobicContact CB-CB 4Å; V284-K359 HydrophobicContact CB-CG 4.47Å; V284-K359 HydrophobicContact CG2-CB 4.4Å
285	I	96.3	Very high	95.1	Very high	42 Å²	42	69.8 Å²	69.8	22%	0.215	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.8	178.5	-49.7	174	0	0	0	108.8	A288 Y313 F366	I285-A288 HydrophobicContact CG2-CB 3.83Å; I285-Y313 HydrophobicContact CB-CE1 4.39Å; I285-Y313 HydrophobicContact CD1-CE2 3.84Å; I285-Y313 PolarHBondContact N-O 2.79Å; I285-F366 HydrophobicContact CD1-CE2 3.94Å; I285-F366 HydrophobicContact CD1-CZ 3.99Å
286	F	96.8	Very high	96.2	Very high	103 Å²	103	63.6 Å²	63.6	45%	0.452	30%	0.295	S	S	.	.			trans	-97.8	146.5	175.4	-64.8	-88.5	0	0	0	110.8	V284 A288 P312 K359	V284-F286 HydrophobicContact CB-CE2 3.93Å; V284-F286 HydrophobicContact CB-CZ 4.3Å; V284-F286 HydrophobicContact CG1-CD2 4.03Å; V284-F286 HydrophobicContact CG1-CE1 4.13Å; V284-F286 HydrophobicContact CG1-CE2 3.48Å; V284-F286 VanDerWaalsContact CG1-CE2 3.48Å; V284-F286 HydrophobicContact CG1-CZ 3.53Å; F286-A288 PolarHBondContact O-N 3.32Å; F286-A288 VanDerWaalsContact O-N 3.14Å; F286-P312 HydrophobicContact CD1-CB 3.77Å; F286-P312 HydrophobicContact CD1-CG 3.7Å; F286-P312 HydrophobicContact CE1-CB 3.7Å; F286-P312 HydrophobicContact CE1-CG 3.84Å; F286-K359 HydrophobicContact CE2-CB 4.3Å
287	K	96.5	Very high	96.3	Very high	163 Å²	163	66.2 Å²	66.2	71%	0.709	30%	0.303	S	S	*	.	S	Bend	trans	53.9	33.4	176.3	-56.3	180	179.4	178.6	0	112.8	Y309	K287-Y309 HydrophobicContact CB-CD1 3.88Å; K287-Y309 HydrophobicContact CB-CE1 3.95Å; K287-Y309 HydrophobicContact CB-CG 4.44Å; K287-Y309 WeakPolarHBondContact O-CD1 3.36Å; K287-Y309 WeakPolarHBondContact O-CE1 3.43Å
288	A	96.6	Very high	96.4	Very high	15 Å²	15	65.2 Å²	65.2	12%	0.124	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-64	138.5	171	0	0	0	0	0	109.9	I285 F286 Y309 Y310 Y313	I285-A288 HydrophobicContact CG2-CB 3.83Å; F286-A288 PolarHBondContact O-N 3.32Å; F286-A288 VanDerWaalsContact O-N 3.14Å; A288-Y309 CarbonylContact O-C 3.59Å; A288-Y309 VanDerWaalsContact O-CA 3.24Å; A288-Y309 WeakPolarHBondContact O-CA 3.48Å; A288-Y310 HydrophobicContact CB-CD2 4.06Å; A288-Y310 PolarHBondContact O-N 3.14Å; A288-Y313 HydrophobicContact CB-CE1 3.72Å
289	K	97.4	Very high	96.4	Very high	127 Å²	127	63.5 Å²	63.5	55%	0.552	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-102.1	143.1	174.1	-63	-170.4	176	-176.5	0	109.7	I291 T308 Y309	K289-I291 PolarHBondContact O-N 3.21Å; K289-T308 WeakPolarHBondContact CG-O 3.3Å; K289-Y309 HydrophobicContact CD-CE1 4.11Å; K289-Y309 HydrophobicContact CG-CD1 3.68Å; K289-Y309 HydrophobicContact CG-CE1 3.65Å
290	P	97.5	Very high	96.4	Very high	10 Å²	10	63.1 Å²	63.1	7%	0.065	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-55.4	132.1	167.2	-18.3	27.1	0	0	0	110.5	I300 Y305 Y310	P290-I300 HydrophobicContact CB-CB 4.36Å; P290-Y305 HydrophobicContact CG-CD1 3.47Å; P290-Y305 VanDerWaalsContact CG-CD1 3.47Å; P290-Y305 HydrophobicContact CG-CE1 3.97Å; P290-Y305 HydrophobicContact CG-CG 4.36Å; P290-Y310 WeakPolarHBondContact CA-OH 3.36Å; P290-Y310 HydrophobicContact CB-CE1 4.2Å; P290-Y310 HydrophobicContact CB-CE2 4.25Å; P290-Y310 WeakPolarHBondContact CB-OH 3.45Å; P290-Y310 HydrophobicContact CG-CD1 4.31Å; P290-Y310 HydrophobicContact CG-CE1 3.67Å; P290-Y310 HydrophobicContact CG-CE2 4.21Å
291	I	97.2	Very high	96.3	Very high	63 Å²	63	63.2 Å²	63.2	32%	0.323	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-76.6	128.3	177.5	-59.1	-176.9	0	0	0	108.3	K289 K293 N296 Y299 I300	K289-I291 PolarHBondContact O-N 3.21Å; I291-K293 HydrophobicContact CG2-CB 4.26Å; I291-N296 WeakPolarHBondContact CD1-OD1 3.44Å; I291-N296 HydrophobicContact CG2-CB 3.66Å; I291-Y299 CarbonylContact O-C 3.59Å; I291-Y299 WeakPolarHBondContact O-CA 3.29Å; I291-Y299 WeakPolarHBondContact O-CD2 3.29Å; I291-I300 PolarHBondContact O-N 3.36Å
292	R	96.2	Very high	96.2	Very high	74 Å²	74	69.2 Å²	69.2	28%	0.279	31%	0.312	S	S	.	.			trans	-105.6	3	-176.8	-54.4	-55.4	-173.8	-180	4.6	114.2	Y299 I300 P301 Y305	R292-Y299 WeakPolarHBondContact O-CE2 3.46Å; R292-I300 WeakPolarHBondContact CD-O 3.48Å; R292-I300 PolarHBondContact NH1-O 3.11Å; R292-P301 VanDerWaalsContact NH1-C 3.3Å; R292-P301 PolarHBondContact NH1-O 3.5Å; R292-Y305 PolarHBondContact NH1-O 2.99Å; R292-Y305 PolarHBondContact NH2-O 2.93Å
293	K	96.5	Very high	96.1	Very high	121 Å²	121	72.9 Å²	72.9	53%	0.526	33%	0.334	S	S	.	.			trans	-87.4	118.6	175.5	-63.9	-174.7	178.2	-172.9	0	109.1	I291 E295 N296 Y299	I291-K293 HydrophobicContact CG2-CB 4.26Å; K293-E295 PolarHBondContact O-N 3Å; K293-N296 WeakPolarHBondContact O-CB 3.38Å; K293-N296 PolarHBondContact O-N 3.04Å; K293-N296 VanDerWaalsContact O-N 3.13Å; K293-Y299 WeakPolarHBondContact O-CB 3.44Å
294	K	94.1	Very high	95.9	Very high	114 Å²	114	72.3 Å²	72.3	50%	0.496	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.5	-173	-67.8	-172.1	173.5	-167.3	0	113.4	N296 Y299	K294-N296 PolarHBondContact O-N 3.29Å; K294-Y299 HydrophobicContact CB-CD1 4.5Å; K294-Y299 HydrophobicContact CG-CD1 4.34Å; K294-Y299 HydrophobicContact CG-CD2 4.46Å; K294-Y299 HydrophobicContact CG-CE1 3.95Å; K294-Y299 HydrophobicContact CG-CE2 4.05Å
295	E	93.6	Very high	95.8	Very high	149 Å²	149	73.2 Å²	73.2	70%	0.696	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-12.9	-178	-48.7	72.1	-152.3	0	0	112.1	K293	K293-E295 PolarHBondContact O-N 3Å
296	N	95.3	Very high	95.8	Very high	38 Å²	38	77.7 Å²	77.7	20%	0.203	36%	0.359	C	S	.	.	S	Bend	trans	-83.9	133.3	179.7	-165.7	-75.8	0	0	0	110.7	I291 K293 K294 Y298 Y299	I291-N296 WeakPolarHBondContact CD1-OD1 3.44Å; I291-N296 HydrophobicContact CG2-CB 3.66Å; K293-N296 WeakPolarHBondContact O-CB 3.38Å; K293-N296 PolarHBondContact O-N 3.04Å; K293-N296 VanDerWaalsContact O-N 3.13Å; K294-N296 PolarHBondContact O-N 3.29Å; N296-Y298 PolarHBondContact O-N 2.87Å; N296-Y298 PolarHBondContact OD1-N 3.02Å; N296-Y299 WeakPolarHBondContact O-CB 3.4Å; N296-Y299 PolarHBondContact O-N 3.44Å
297	K	93.1	Very high	95.8	Very high	132 Å²	132	78.4 Å²	78.4	57%	0.574	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-32.5	175.4	-179	-176.8	174.7	-171.5	0	113.8	F228	F228-K297 VanDerWaalsContact CD2-CE 3.49Å; F228-K297 HydrophobicContact CE1-CG 4.43Å; F228-K297 HydrophobicContact CZ-CG 4.46Å
298	Y	95.3	Very high	95.8	Very high	109 Å²	109	75 Å²	75	43%	0.427	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	21.1	-179.3	-52.8	-83	0	0	0	112.8	F228 N296 I300 I341	F228-Y298 HydrophobicContact CE1-CD1 4.43Å; F228-Y298 HydrophobicContact CE2-CD1 4.45Å; F228-Y298 AromaticContact CE2-CE1 3.98Å; F228-Y298 HydrophobicContact CE2-CE1 3.98Å; F228-Y298 AromaticContact CZ-CD1 3.63Å; F228-Y298 HydrophobicContact CZ-CD1 3.63Å; F228-Y298 AromaticContact CZ-CE1 3.6Å; F228-Y298 HydrophobicContact CZ-CE1 3.6Å; N296-Y298 PolarHBondContact O-N 2.87Å; N296-Y298 PolarHBondContact OD1-N 3.02Å; Y298-I300 PolarHBondContact O-N 3.19Å; Y298-I341 HydrophobicContact CD1-CD1 4.47Å
299	Y	97.2	Very high	95.8	Very high	32 Å²	32	79.3 Å²	79.3	13%	0.125	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-52.8	137.9	170.6	171.7	-121.3	0	0	0	110.3	F127 I291 R292 K293 K294 N296 P301	F127-Y299 AromaticContact CE2-CD1 3.57Å; F127-Y299 HydrophobicContact CE2-CD1 3.57Å; F127-Y299 AromaticContact CE2-CE1 3.78Å; F127-Y299 HydrophobicContact CE2-CE1 3.78Å; F127-Y299 AromaticContact CZ-CD1 3.91Å; F127-Y299 HydrophobicContact CZ-CD1 3.91Å; F127-Y299 HydrophobicContact CZ-CE1 4.3Å; F127-Y299 WeakPolarHBondContact CZ-O 3.32Å; I291-Y299 CarbonylContact O-C 3.59Å; I291-Y299 WeakPolarHBondContact O-CA 3.29Å; I291-Y299 WeakPolarHBondContact O-CD2 3.29Å; R292-Y299 WeakPolarHBondContact O-CE2 3.46Å; K293-Y299 WeakPolarHBondContact O-CB 3.44Å; K294-Y299 HydrophobicContact CB-CD1 4.5Å; K294-Y299 HydrophobicContact CG-CD1 4.34Å; K294-Y299 HydrophobicContact CG-CD2 4.46Å; K294-Y299 HydrophobicContact CG-CE1 3.95Å; K294-Y299 HydrophobicContact CG-CE2 4.05Å; N296-Y299 WeakPolarHBondContact O-CB 3.4Å; N296-Y299 PolarHBondContact O-N 3.44Å; Y299-P301 HydrophobicContact CE1-CB 4.47Å
300	I	97.7	Very high	95.9	Very high	1 Å²	1	73.9 Å²	73.9	1%	0.005	34%	0.344	C	S	.	.			trans	-135.4	126.4	170.6	-66.6	-66.1	0	0	0	108.8	F127 P290 I291 R292 Y298 L304 Y310 Y339 P340 I341	F127-I300 HydrophobicContact CE1-CD1 4.14Å; P290-I300 HydrophobicContact CB-CB 4.36Å; I291-I300 PolarHBondContact O-N 3.36Å; R292-I300 WeakPolarHBondContact CD-O 3.48Å; R292-I300 PolarHBondContact NH1-O 3.11Å; Y298-I300 PolarHBondContact O-N 3.19Å; I300-L304 HydrophobicContact CG2-CB 3.95Å; I300-Y310 WeakPolarHBondContact CG1-OH 3.45Å; I300-Y339 HydrophobicContact CD1-CE1 4.46Å; I300-Y339 WeakPolarHBondContact CG2-OH 3.34Å; I300-P340 HydrophobicContact CD1-CB 4.23Å; I300-P340 HydrophobicContact CD1-CG 4.11Å; I300-I341 HydrophobicContact CD1-CD1 3.99Å; I300-I341 HydrophobicContact CD1-CG1 4.2Å; I300-I341 HydrophobicContact CG1-CD1 3.84Å
301	P	96.3	Very high	95.9	Very high	5 Å²	5	73.6 Å²	73.6	3%	0.032	34%	0.343	C	S	.	.			trans	-70	153.2	175.8	29.6	-35.3	0	0	0	111.8	L123 F127 R292 Y299 V303 L304 Y305	L123-P301 HydrophobicContact CD2-CB 3.86Å; L123-P301 HydrophobicContact CD2-CG 3.74Å; F127-P301 HydrophobicContact CD1-CG 4.11Å; F127-P301 VanDerWaalsContact CE1-CD 3.45Å; F127-P301 HydrophobicContact CE1-CG 4.16Å; F127-P301 HydrophobicContact CG-CG 4.31Å; F127-P301 HydrophobicContact CZ-CG 4.45Å; R292-P301 VanDerWaalsContact NH1-C 3.3Å; R292-P301 PolarHBondContact NH1-O 3.5Å; Y299-P301 HydrophobicContact CE1-CB 4.47Å; P301-V303 HydrophobicContact CB-CG2 4.21Å; P301-V303 HydrophobicContact CG-CG2 4.15Å; P301-V303 PolarHBondContact O-N 3Å; P301-L304 HydrophobicContact CG-CB 4.11Å; P301-L304 HydrophobicContact CG-CD1 3.79Å; P301-L304 HydrophobicContact CG-CG 4.1Å; P301-L304 PolarHBondContact O-N 3.43Å; P301-L304 VanDerWaalsContact O-N 3.11Å; P301-Y305 PolarHBondContact O-N 3.41Å
302	H	95.4	Very high	95.9	Very high	126 Å²	126	72.6 Å²	72.6	58%	0.583	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.6	-179.8	-82	-83.7	0	0	0	113.5	L304 Y305	H302-L304 PolarHBondContact O-N 2.78Å; H302-Y305 CarbonylContact O-C 3.51Å; H302-Y305 VanDerWaalsContact O-C 3.29Å; H302-Y305 PolarHBondContact O-N 3.45Å
303	V	94	Very high	96	Very high	76 Å²	76	70.6 Å²	70.6	46%	0.461	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.8	179.9	-48.2	0	0	0	0	112.7	W119 L123 P301	W119-V303 HydrophobicContact CB-CG1 4.13Å; W119-V303 HydrophobicContact CE3-CB 4.14Å; W119-V303 HydrophobicContact CE3-CG1 4.33Å; W119-V303 HydrophobicContact CE3-CG2 3.94Å; W119-V303 HydrophobicContact CZ3-CG2 4.29Å; L123-V303 HydrophobicContact CD1-CG2 4.28Å; L123-V303 HydrophobicContact CD2-CG2 3.84Å; L123-V303 HydrophobicContact CG-CG2 4.5Å; P301-V303 HydrophobicContact CB-CG2 4.21Å; P301-V303 HydrophobicContact CG-CG2 4.15Å; P301-V303 PolarHBondContact O-N 3Å
304	L	94.1	Very high	96.1	Very high	16 Å²	16	65 Å²	65	8%	0.084	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-30.3	179.5	-91	176.7	0	0	0	112.8	F127 F130 M131 I300 P301 H302 P340	F127-L304 HydrophobicContact CD1-CD1 3.36Å; F127-L304 HydrophobicContact CE1-CD1 3.63Å; F127-L304 HydrophobicContact CG-CD1 4.46Å; F130-L304 HydrophobicContact CD1-CD2 4.41Å; F130-L304 HydrophobicContact CE1-CD2 4.12Å; M131-L304 HydrophobicContact CE-CD2 4.44Å; M131-L304 HydrophobicContact SD-CD2 3.34Å; M131-L304 WeakPolarHBondContact SD-CD2 3.43Å; M131-L304 HydrophobicContact SD-CG 4.15Å; I300-L304 HydrophobicContact CG2-CB 3.95Å; P301-L304 HydrophobicContact CG-CB 4.11Å; P301-L304 HydrophobicContact CG-CD1 3.79Å; P301-L304 HydrophobicContact CG-CG 4.1Å; P301-L304 PolarHBondContact O-N 3.43Å; P301-L304 VanDerWaalsContact O-N 3.11Å; H302-L304 PolarHBondContact O-N 2.78Å; L304-P340 HydrophobicContact CD1-CG 4.02Å
305	Y	95.9	Very high	95.8	Very high	22 Å²	22	59.8 Å²	59.8	9%	0.086	29%	0.287	C	S	.	.			trans	-154.2	112	-179.7	-162.5	-90.1	0	0	0	109.8	P290 R292 P301 H302 K307 Y309 Y310 Y339 M348	P290-Y305 HydrophobicContact CG-CD1 3.47Å; P290-Y305 VanDerWaalsContact CG-CD1 3.47Å; P290-Y305 HydrophobicContact CG-CE1 3.97Å; P290-Y305 HydrophobicContact CG-CG 4.36Å; R292-Y305 PolarHBondContact NH1-O 2.99Å; R292-Y305 PolarHBondContact NH2-O 2.93Å; P301-Y305 PolarHBondContact O-N 3.41Å; H302-Y305 CarbonylContact O-C 3.51Å; H302-Y305 VanDerWaalsContact O-C 3.29Å; H302-Y305 PolarHBondContact O-N 3.45Å; Y305-K307 HydrophobicContact CD1-CB 4.25Å; Y305-K307 HydrophobicContact CE1-CB 3.53Å; Y305-K307 HydrophobicContact CE1-CG 4.34Å; Y305-Y309 PolarHBondContact OH-O 3.29Å; Y305-Y310 HydrophobicContact CD1-CD1 4.06Å; Y305-Y310 AromaticContact CD1-CE1 3.73Å; Y305-Y310 HydrophobicContact CD1-CE1 3.73Å; Y305-Y310 HydrophobicContact CD2-CD1 4.32Å; Y305-Y310 HydrophobicContact CD2-CE1 4.02Å; Y305-Y310 AromaticContact CE1-CD1 3.58Å; Y305-Y310 HydrophobicContact CE1-CD1 3.58Å; Y305-Y310 AromaticContact CE1-CE1 3.76Å; Y305-Y310 HydrophobicContact CE1-CE1 3.76Å; Y305-Y310 AromaticContact CE2-CD1 3.93Å; Y305-Y310 HydrophobicContact CE2-CD1 3.93Å; Y305-Y310 HydrophobicContact CE2-CE1 4.1Å; Y305-Y310 HydrophobicContact CG-CD1 4.38Å; Y305-Y310 AromaticContact CG-CE1 3.83Å; Y305-Y310 HydrophobicContact CG-CE1 3.83Å; Y305-Y310 AromaticContact CZ-CD1 3.53Å; Y305-Y310 AromaticContact CZ-CE1 3.98Å; Y305-Y339 HydrophobicContact CD2-CE2 4.05Å; Y305-M348 HydrophobicContact CD2-CE 3.93Å; Y305-M348 HydrophobicContact CE2-CE 3.65Å
306	N	95	Very high	95.1	Very high	136 Å²	136	53.3 Å²	53.3	73%	0.727	26%	0.261	S	S	*	.			trans	-100.9	-12.6	-175.3	67.2	-1.1	0	0	0	114
307	K	96.1	Very high	94.7	Very high	118 Å²	118	51.7 Å²	51.7	51%	0.513	25%	0.253	S	S	.	.	S	Bend	trans	-69.7	156.8	177.7	-53.9	178.6	-179.4	177	0	110.9	Y305	Y305-K307 HydrophobicContact CD1-CB 4.25Å; Y305-K307 HydrophobicContact CE1-CB 3.53Å; Y305-K307 HydrophobicContact CE1-CG 4.34Å
308	T	96.8	Very high	94.8	Very high	90 Å²	90	45.4 Å²	45.4	55%	0.552	23%	0.226	S	C	*	.	S	Bend	trans	-70.2	-40.4	-178.4	-59.5	0	0	0	0	112.2	K289	K289-T308 WeakPolarHBondContact CG-O 3.3Å
309	Y	98.2	Very high	94.9	Very high	107 Å²	107	40.3 Å²	40.3	42%	0.42	21%	0.206	S	C	.	.	S	Bend	trans	-128.9	143.7	-174	-60.9	-69.9	0	0	0	110.6	K287 A288 K289 Y305	K287-Y309 HydrophobicContact CB-CD1 3.88Å; K287-Y309 HydrophobicContact CB-CE1 3.95Å; K287-Y309 HydrophobicContact CB-CG 4.44Å; K287-Y309 WeakPolarHBondContact O-CD1 3.36Å; K287-Y309 WeakPolarHBondContact O-CE1 3.43Å; A288-Y309 CarbonylContact O-C 3.59Å; A288-Y309 VanDerWaalsContact O-CA 3.24Å; A288-Y309 WeakPolarHBondContact O-CA 3.48Å; K289-Y309 HydrophobicContact CD-CE1 4.11Å; K289-Y309 HydrophobicContact CG-CD1 3.68Å; K289-Y309 HydrophobicContact CG-CE1 3.65Å; Y305-Y309 PolarHBondContact OH-O 3.29Å
310	Y	98.3	Very high	95	Very high	12 Å²	12	38.8 Å²	38.8	5%	0.047	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-68.4	154.1	164.3	-66.6	-44.4	0	0	0	111.4	A288 P290 I300 Y305 Y313 Y339 V344	A288-Y310 HydrophobicContact CB-CD2 4.06Å; A288-Y310 PolarHBondContact O-N 3.14Å; P290-Y310 WeakPolarHBondContact CA-OH 3.36Å; P290-Y310 HydrophobicContact CB-CE1 4.2Å; P290-Y310 HydrophobicContact CB-CE2 4.25Å; P290-Y310 WeakPolarHBondContact CB-OH 3.45Å; P290-Y310 HydrophobicContact CG-CD1 4.31Å; P290-Y310 HydrophobicContact CG-CE1 3.67Å; P290-Y310 HydrophobicContact CG-CE2 4.21Å; I300-Y310 WeakPolarHBondContact CG1-OH 3.45Å; Y305-Y310 HydrophobicContact CD1-CD1 4.06Å; Y305-Y310 AromaticContact CD1-CE1 3.73Å; Y305-Y310 HydrophobicContact CD1-CE1 3.73Å; Y305-Y310 HydrophobicContact CD2-CD1 4.32Å; Y305-Y310 HydrophobicContact CD2-CE1 4.02Å; Y305-Y310 AromaticContact CE1-CD1 3.58Å; Y305-Y310 HydrophobicContact CE1-CD1 3.58Å; Y305-Y310 AromaticContact CE1-CE1 3.76Å; Y305-Y310 HydrophobicContact CE1-CE1 3.76Å; Y305-Y310 AromaticContact CE2-CD1 3.93Å; Y305-Y310 HydrophobicContact CE2-CD1 3.93Å; Y305-Y310 HydrophobicContact CE2-CE1 4.1Å; Y305-Y310 HydrophobicContact CG-CD1 4.38Å; Y305-Y310 AromaticContact CG-CE1 3.83Å; Y305-Y310 HydrophobicContact CG-CE1 3.83Å; Y305-Y310 AromaticContact CZ-CD1 3.53Å; Y305-Y310 AromaticContact CZ-CE1 3.98Å; Y310-Y313 HydrophobicContact CD2-CE1 4.13Å; Y310-Y339 HydrophobicContact CE1-CE1 4.18Å; Y310-Y339 AromaticContact CE1-CZ 3.91Å; Y310-Y339 WeakPolarHBondContact CE1-OH 3.41Å; Y310-Y339 PolarHBondContact OH-OH 3.17Å; Y310-V344 HydrophobicContact CD1-CG1 3.53Å; Y310-V344 HydrophobicContact CD2-CG1 4.16Å; Y310-V344 HydrophobicContact CD2-CG2 4Å; Y310-V344 HydrophobicContact CE1-CG1 3.86Å; Y310-V344 HydrophobicContact CE2-CG1 4.42Å; Y310-V344 HydrophobicContact CE2-CG2 4.07Å; Y310-V344 HydrophobicContact CG-CG1 3.7Å; Y310-V344 HydrophobicContact CG-CG2 4.36Å
311	P	97.9	Very high	95	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.032	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-59.1	157.1	163.8	28.1	-34.8	0	0	0	110.1	Y313 M348 E351	P311-Y313 WeakPolarHBondContact O-CD1 3.29Å; P311-Y313 PolarHBondContact O-N 3.14Å; P311-M348 HydrophobicContact CG-CB 4.46Å; P311-M348 HydrophobicContact CG-CG 3.86Å; P311-E351 HydrophobicContact CB-CB 3.99Å; P311-E351 HydrophobicContact CB-CG 4.45Å
312	P	98.1	Very high	95	Very high	41 Å²	41	39.8 Å²	39.8	27%	0.266	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-56.7	133.8	173.8	-23.3	34.4	0	0	0	111.6	V284 F286 G347 P357	V284-P312 HydrophobicContact CG1-CB 4.14Å; F286-P312 HydrophobicContact CD1-CB 3.77Å; F286-P312 HydrophobicContact CD1-CG 3.7Å; F286-P312 HydrophobicContact CE1-CB 3.7Å; F286-P312 HydrophobicContact CE1-CG 3.84Å; P312-G347 WeakPolarHBondContact O-CA 3.34Å; P312-P357 HydrophobicContact CB-CG 3.91Å
313	Y	98.1	Very high	95.1	Very high	32 Å²	32	33.8 Å²	33.8	13%	0.125	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	153.5	178.7	68.3	-88.7	0	0	0	111.3	V284 I285 A288 Y310 P311 D343 V344	V284-Y313 CarbonylContact C-O 3.58Å; V284-Y313 WeakPolarHBondContact CA-O 3.35Å; I285-Y313 HydrophobicContact CB-CE1 4.39Å; I285-Y313 HydrophobicContact CD1-CE2 3.84Å; I285-Y313 PolarHBondContact N-O 2.79Å; A288-Y313 HydrophobicContact CB-CE1 3.72Å; Y310-Y313 HydrophobicContact CD2-CE1 4.13Å; P311-Y313 WeakPolarHBondContact O-CD1 3.29Å; P311-Y313 PolarHBondContact O-N 3.14Å; Y313-D343 WeakPolarHBondContact CB-O 3.3Å; Y313-D343 HydrophobicContact CD2-CB 3.74Å; Y313-D343 HydrophobicContact CE2-CB 4.14Å; Y313-V344 HydrophobicContact CD1-CG2 4.09Å; Y313-V344 HydrophobicContact CD2-CG2 4.41Å; Y313-V344 HydrophobicContact CE1-CG2 3.84Å; Y313-V344 HydrophobicContact CE2-CG2 4.16Å; Y313-V344 HydrophobicContact CG-CG2 4.38Å
314	A	96.8	Very high	95.3	Very high	4 Å²	4	32.2 Å²	32.2	3%	0.033	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	136.4	171.9	0	0	0	0	0	110.5	F280 D283 V284 F319 D343	F280-A314 HydrophobicContact CE1-CB 3.8Å; D283-A314 WeakPolarHBondContact O-CA 3.37Å; V284-A314 HydrophobicContact CG2-CB 4.37Å; A314-F319 HydrophobicContact CB-CB 4Å; A314-F319 HydrophobicContact CB-CD1 4.22Å; A314-F319 HydrophobicContact CB-CG 4.4Å; A314-D343 WeakPolarHBondContact O-CB 3.35Å
315	G	89.6	Confident	95.5	Very high	4 Å²	4	31.4 Å²	31.4	4%	0.041	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	156.7	179.8	0	0	0	0	0	114.8	D283 G317 G318	D283-G315 PolarHBondContact O-N 3.09Å; G315-G317 VanDerWaalsContact C-N 3.29Å; G315-G317 PolarHBondContact O-N 3Å; G315-G317 VanDerWaalsContact O-N 3.09Å; G315-G318 PolarHBondContact O-N 3.35Å
316	G	77.4	Confident	95.6	Very high	14 Å²	14	30.4 Å²	30.4	14%	0.144	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	-13.9	-163.5	0	0	0	0	0	118.6	D256 G318 D343	D256-G316 VanDerWaalsContact OD2-O 3.06Å; G316-G318 VanDerWaalsContact C-N 3.27Å; G316-G318 PolarHBondContact O-N 2.98Å; G316-D343 VanDerWaalsContact CA-CG 3.45Å; G316-D343 VanDerWaalsContact CA-OD1 3.32Å; G316-D343 WeakPolarHBondContact CA-OD1 3.18Å; G316-D343 WeakPolarHBondContact CA-OD2 3.24Å; G316-D343 PolarHBondContact N-OD2 2.9Å
317	G	87.2	Confident	95.7	Very high	4 Å²	4	26.3 Å²	26.3	4%	0.041	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	-33.7	177.8	0	0	0	0	0	113	G255 D256 V259 G315	G255-G317 WeakPolarHBondContact CA-O 3.26Å; D256-G317 PolarHBondContact N-O 2.57Å; V259-G317 WeakPolarHBondContact CG1-O 3.43Å; G315-G317 VanDerWaalsContact C-N 3.29Å; G315-G317 PolarHBondContact O-N 3Å; G315-G317 VanDerWaalsContact O-N 3.09Å
318	G	95.4	Very high	95.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.4	161.7	166.5	0	0	0	0	0	115.4	K254 G315 G316 F363	K254-G318 CarbonylContact O-C 3.29Å; K254-G318 WeakPolarHBondContact O-CA 3.47Å; G315-G318 PolarHBondContact O-N 3.35Å; G316-G318 VanDerWaalsContact C-N 3.27Å; G316-G318 PolarHBondContact O-N 2.98Å; G318-F363 VanDerWaalsContact O-CD1 3.26Å; G318-F363 WeakPolarHBondContact O-CD1 3.41Å
319	F	98	Very high	95.9	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.009	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	161	-179	53.5	-99.8	0	0	0	111	F253 K254 F280 V281 A314 M321 L346	F253-F319 WeakPolarHBondContact CD2-O 3.45Å; K254-F319 HydrophobicContact CB-CD2 4.16Å; K254-F319 HydrophobicContact CB-CE1 4.31Å; K254-F319 HydrophobicContact CB-CE2 3.61Å; K254-F319 HydrophobicContact CB-CZ 3.71Å; K254-F319 HydrophobicContact CD-CE2 4.28Å; K254-F319 HydrophobicContact CD-CZ 3.75Å; K254-F319 HydrophobicContact CG-CZ 4.36Å; K254-F319 PolarHBondContact N-O 3.24Å; K254-F319 VanDerWaalsContact NZ-CZ 3.34Å; K254-F319 PolarHBondContact O-N 2.97Å; F280-F319 HydrophobicContact CE1-CB 4.24Å; F280-F319 HydrophobicContact CE1-CD2 4.05Å; F280-F319 HydrophobicContact CE1-CG 4.04Å; F280-F319 AromaticContact CE2-CD2 3.91Å; F280-F319 HydrophobicContact CE2-CD2 3.91Å; F280-F319 AromaticContact CE2-CE2 3.82Å; F280-F319 HydrophobicContact CE2-CE2 3.82Å; F280-F319 HydrophobicContact CZ-CD1 4.26Å; F280-F319 AromaticContact CZ-CD2 3.51Å; F280-F319 HydrophobicContact CZ-CD2 3.51Å; F280-F319 HydrophobicContact CZ-CE1 4.32Å; F280-F319 AromaticContact CZ-CE2 3.6Å; F280-F319 HydrophobicContact CZ-CE2 3.6Å; F280-F319 AromaticContact CZ-CG 3.86Å; F280-F319 HydrophobicContact CZ-CG 3.86Å; F280-F319 HydrophobicContact CZ-CZ 4.01Å; V281-F319 CarbonylContact O-C 3.59Å; V281-F319 VanDerWaalsContact O-CA 3.26Å; V281-F319 WeakPolarHBondContact O-CA 3.41Å; V281-F319 VanDerWaalsContact O-CB 3.27Å; V281-F319 WeakPolarHBondContact O-CB 3.49Å; A314-F319 HydrophobicContact CB-CB 4Å; A314-F319 HydrophobicContact CB-CD1 4.22Å; A314-F319 HydrophobicContact CB-CG 4.4Å; F319-M321 HydrophobicContact CE2-CE 4.49Å; F319-M321 HydrophobicContact CE2-SD 4.2Å; F319-L346 HydrophobicContact CE1-CD1 3.99Å; F319-L346 HydrophobicContact CE2-CD1 4.39Å; F319-L346 HydrophobicContact CZ-CD1 3.47Å; F319-L346 VanDerWaalsContact CZ-CD1 3.47Å
320	L	97.9	Very high	95.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	144	172.2	-69	165	0	0	0	109.9	L155 V252 F253 I266 F269 F280 V281 F363	L155-L320 HydrophobicContact CD1-CD2 4.15Å; V252-L320 WeakPolarHBondContact O-CA 3.23Å; F253-L320 HydrophobicContact CB-CD2 3.65Å; F253-L320 HydrophobicContact CD2-CD2 3.84Å; F253-L320 HydrophobicContact CD2-CG 4.21Å; F253-L320 HydrophobicContact CG-CD2 4.24Å; I266-L320 HydrophobicContact CD1-CD2 4.31Å; I266-L320 HydrophobicContact CG1-CD1 4.27Å; I266-L320 HydrophobicContact CG1-CD2 4.46Å; I266-L320 HydrophobicContact CG2-CD1 3.96Å; I266-L320 HydrophobicContact CG2-CD2 3.77Å; F269-L320 HydrophobicContact CD1-CD1 3.96Å; F269-L320 HydrophobicContact CE1-CD1 4.29Å; F280-L320 CarbonylContact C-O 3.55Å; F280-L320 WeakPolarHBondContact CA-O 3.21Å; V281-L320 HydrophobicContact CG1-CB 3.67Å; V281-L320 HydrophobicContact CG1-CD1 4.34Å; V281-L320 PolarHBondContact N-O 3Å; V281-L320 PolarHBondContact O-N 3.41Å; L320-F363 HydrophobicContact CD1-CZ 3.95Å; L320-F363 HydrophobicContact CG-CZ 4.08Å
321	M	97.7	Very high	95.7	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	150.9	172	60.2	-175.8	174	0	0	111.9	F238 L239 Y251 V252 L279 F280 F319 A326 L329	F238-M321 HydrophobicContact CE1-CE 4.03Å; L239-M321 HydrophobicContact CD2-CE 4.37Å; Y251-M321 WeakPolarHBondContact CA-O 3.38Å; V252-M321 HydrophobicContact CB-CE 3.8Å; V252-M321 HydrophobicContact CB-CG 3.95Å; V252-M321 HydrophobicContact CG1-CE 3.65Å; V252-M321 HydrophobicContact CG2-CE 4.35Å; V252-M321 PolarHBondContact N-O 3.29Å; V252-M321 PolarHBondContact O-N 3.26Å; L279-M321 CarbonylContact O-C 3.54Å; L279-M321 VanDerWaalsContact O-CA 3.22Å; L279-M321 WeakPolarHBondContact O-CA 3.34Å; F280-M321 HydrophobicContact CD2-CB 3.84Å; F280-M321 HydrophobicContact CD2-SD 4.44Å; F280-M321 HydrophobicContact CE2-CB 4.34Å; F280-M321 HydrophobicContact CE2-SD 4.16Å; F319-M321 HydrophobicContact CE2-CE 4.49Å; F319-M321 HydrophobicContact CE2-SD 4.2Å; M321-A326 HydrophobicContact CE-CB 3.76Å; M321-A326 HydrophobicContact CG-CB 4.34Å; M321-A326 HydrophobicContact SD-CB 3.84Å; M321-L329 HydrophobicContact SD-CD1 3.96Å
322	H	98.1	Very high	95.7	Very high	25 Å²	25	20.9 Å²	20.9	12%	0.116	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	143.3	170.7	-173.5	-89.5	0	0	0	110.5	Y251 L279 T324 L325 A326	Y251-H322 HydrophobicContact CD1-CB 4.4Å; Y251-H322 HydrophobicContact CE1-CB 4.36Å; Y251-H322 AromaticContact CE1-CD2 3.61Å; L279-H322 HydrophobicContact CB-CB 4.09Å; L279-H322 PolarHBondContact O-N 3.17Å; H322-T324 VanDerWaalsContact C-N 3.27Å; H322-T324 PolarHBondContact CE1-OG1 2.92Å; H322-T324 WeakPolarHBondContact ND1-CB 3.43Å; H322-T324 PolarHBondContact ND1-N 3.07Å; H322-T324 PolarHBondContact ND1-OG1 3.17Å; H322-T324 PolarHBondContact O-N 2.95Å; H322-L325 WeakPolarHBondContact O-CB 3.38Å; H322-L325 PolarHBondContact O-N 3.11Å; H322-A326 PolarHBondContact O-N 3.25Å
323	G	97.3	Very high	95.6	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.6	-34.6	-176.4	0	0	0	0	0	113.3	Q250 L325 A326 R327	Q250-G323 PolarHBondContact O-N 3.33Å; G323-L325 VanDerWaalsContact C-N 3.33Å; G323-L325 PolarHBondContact O-N 2.65Å; G323-A326 PolarHBondContact O-N 2.87Å; G323-R327 VanDerWaalsContact C-NH2 3.28Å; G323-R327 WeakPolarHBondContact O-CG 3.38Å; G323-R327 VanDerWaalsContact O-CZ 3.25Å; G323-R327 PolarHBondContact O-N 3.25Å; G323-R327 PolarHBondContact O-NE 3.14Å
324	T	97.3	Very high	95.3	Very high	42 Å²	42	20.7 Å²	20.7	26%	0.258	10%	0.097	S	C	.	.	H	α-helix	trans	-61.8	-41.1	173.4	-60	0	0	0	0	111.8	K277 H322 R327 R328	K277-T324 HydrophobicContact CB-CG2 4.36Å; H322-T324 VanDerWaalsContact C-N 3.27Å; H322-T324 PolarHBondContact CE1-OG1 2.92Å; H322-T324 WeakPolarHBondContact ND1-CB 3.43Å; H322-T324 PolarHBondContact ND1-N 3.07Å; H322-T324 PolarHBondContact ND1-OG1 3.17Å; H322-T324 PolarHBondContact O-N 2.95Å; T324-R327 VanDerWaalsContact N-NH2 3.18Å; T324-R327 PolarHBondContact O-N 2.79Å; T324-R328 WeakPolarHBondContact O-CG 3.48Å; T324-R328 PolarHBondContact O-N 3.31Å; T324-R328 VanDerWaalsContact O-N 3.11Å
325	L	98.1	Very high	95.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.6	-41.6	176.4	-179.4	60.5	0	0	0	111.2	N278 L279 F280 H322 G323 R327 R328 L329 L350 L353 V355	N278-L325 WeakPolarHBondContact O-CD2 3.5Å; L279-L325 WeakPolarHBondContact O-CD2 3.35Å; F280-L325 HydrophobicContact CB-CD2 3.65Å; F280-L325 HydrophobicContact CD2-CD2 3.94Å; F280-L325 HydrophobicContact CG-CD2 4.29Å; H322-L325 WeakPolarHBondContact O-CB 3.38Å; H322-L325 PolarHBondContact O-N 3.11Å; G323-L325 VanDerWaalsContact C-N 3.33Å; G323-L325 PolarHBondContact O-N 2.65Å; L325-R327 VanDerWaalsContact C-N 3.28Å; L325-R327 PolarHBondContact O-N 3.44Å; L325-R328 CarbonylContact O-C 3.56Å; L325-R328 WeakPolarHBondContact O-CA 3.42Å; L325-R328 PolarHBondContact O-N 3.17Å; L325-L329 HydrophobicContact CD1-CG 4.31Å; L325-L329 HydrophobicContact CG-CD1 4.1Å; L325-L329 HydrophobicContact CG-CG 4.24Å; L325-L329 WeakPolarHBondContact O-CB 3.42Å; L325-L329 WeakPolarHBondContact O-CG 3.38Å; L325-L329 PolarHBondContact O-N 2.89Å; L325-L350 HydrophobicContact CD1-CD2 4.43Å; L325-L350 HydrophobicContact CD2-CD2 4.04Å; L325-L353 HydrophobicContact CD1-CD1 4.12Å; L325-V355 HydrophobicContact CD1-CB 4.47Å; L325-V355 HydrophobicContact CD1-CG1 4.38Å; L325-V355 HydrophobicContact CD1-CG2 3.97Å; L325-V355 HydrophobicContact CD2-CG1 4.07Å
326	A	98	Very high	95.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-55.9	-42.8	175.2	0	0	0	0	0	112	L239 F242 M321 H322 G323 R328 L329 H330	L239-A326 HydrophobicContact CD2-CB 4.46Å; F242-A326 HydrophobicContact CD1-CB 3.85Å; F242-A326 HydrophobicContact CE1-CB 3.66Å; F242-A326 HydrophobicContact CZ-CB 4.43Å; M321-A326 HydrophobicContact CE-CB 3.76Å; M321-A326 HydrophobicContact CG-CB 4.34Å; M321-A326 HydrophobicContact SD-CB 3.84Å; H322-A326 PolarHBondContact O-N 3.25Å; G323-A326 PolarHBondContact O-N 2.87Å; A326-R328 PolarHBondContact O-N 3.2Å; A326-L329 WeakPolarHBondContact O-CB 3.36Å; A326-L329 PolarHBondContact O-N 3.19Å; A326-H330 PolarHBondContact O-N 3.15Å
327	R	97.3	Very high	96.2	Very high	51 Å²	51	33.4 Å²	33.4	19%	0.192	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-34.8	174.2	-71.8	178.7	-73.9	-90.8	4.6	113.2	F242 C246 P247 G323 T324 L325 H330 W331	F242-R327 HydrophobicContact CD1-CG 4.15Å; F242-R327 HydrophobicContact CE1-CG 4.05Å; C246-R327 PolarHBondContact O-NH1 3.01Å; P247-R327 PolarHBondContact O-NH1 3.29Å; G323-R327 VanDerWaalsContact C-NH2 3.28Å; G323-R327 WeakPolarHBondContact O-CG 3.38Å; G323-R327 VanDerWaalsContact O-CZ 3.25Å; G323-R327 PolarHBondContact O-N 3.25Å; G323-R327 PolarHBondContact O-NE 3.14Å; T324-R327 VanDerWaalsContact N-NH2 3.18Å; T324-R327 PolarHBondContact O-N 2.79Å; L325-R327 VanDerWaalsContact C-N 3.28Å; L325-R327 PolarHBondContact O-N 3.44Å; R327-H330 WeakPolarHBondContact O-CB 3.45Å; R327-W331 VanDerWaalsContact O-CD1 3.27Å
328	R	97.9	Very high	96.5	Very high	85 Å²	85	33.4 Å²	33.4	32%	0.321	16%	0.159	S	C	.	.	H	α-helix	trans	-71.9	-36.3	173.7	-71.3	175.9	63	-150.5	-3.6	112.5	N278 T324 L325 A326 H330 W331 A332 L353	N278-R328 PolarHBondContact OD1-NH1 3.09Å; T324-R328 WeakPolarHBondContact O-CG 3.48Å; T324-R328 PolarHBondContact O-N 3.31Å; T324-R328 VanDerWaalsContact O-N 3.11Å; L325-R328 CarbonylContact O-C 3.56Å; L325-R328 WeakPolarHBondContact O-CA 3.42Å; L325-R328 PolarHBondContact O-N 3.17Å; A326-R328 PolarHBondContact O-N 3.2Å; R328-H330 PolarHBondContact O-N 3.24Å; R328-W331 PolarHBondContact O-N 2.8Å; R328-A332 PolarHBondContact O-N 3.18Å; R328-L353 HydrophobicContact CB-CD1 3.9Å; R328-L353 HydrophobicContact CB-CD2 4.39Å; R328-L353 PolarHBondContact NH2-O 3.31Å
329	L	98.4	Very high	96.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62	-32.9	176.5	-77.9	169.4	0	0	0	111.7	L239 F280 M321 L325 A326 A332 A333 C349 L350 L353	L239-L329 HydrophobicContact CD1-CB 3.97Å; L239-L329 HydrophobicContact CD2-CB 4.05Å; F280-L329 HydrophobicContact CD2-CD1 4.22Å; F280-L329 HydrophobicContact CE2-CD1 4.04Å; M321-L329 HydrophobicContact SD-CD1 3.96Å; L325-L329 HydrophobicContact CD1-CG 4.31Å; L325-L329 HydrophobicContact CG-CD1 4.1Å; L325-L329 HydrophobicContact CG-CG 4.24Å; L325-L329 WeakPolarHBondContact O-CB 3.42Å; L325-L329 WeakPolarHBondContact O-CG 3.38Å; L325-L329 PolarHBondContact O-N 2.89Å; A326-L329 WeakPolarHBondContact O-CB 3.36Å; A326-L329 PolarHBondContact O-N 3.19Å; L329-A332 PolarHBondContact O-N 3.15Å; L329-A333 VanDerWaalsContact O-CB 3.25Å; L329-A333 WeakPolarHBondContact O-CB 3.3Å; L329-A333 PolarHBondContact O-N 2.88Å; L329-C349 HydrophobicContact CD2-CB 3.58Å; L329-L350 HydrophobicContact CD2-CD2 4Å; L329-L350 HydrophobicContact CD2-CG 4.12Å; L329-L353 HydrophobicContact CD2-CD1 3.86Å; L329-L353 HydrophobicContact CG-CD1 4.12Å
330	H	97	Very high	96.5	Very high	7 Å²	7	33.5 Å²	33.5	3%	0.032	16%	0.159	C	C	.	.	H	α-helix	trans	-53.3	-56.5	170.9	171.7	45.2	0	0	0	111.4	L239 K240 H243 A326 R327 R328 A332 A333 E334	L239-H330 HydrophobicContact CB-CB 4.09Å; K240-H330 WeakPolarHBondContact CA-ND1 3.49Å; K240-H330 VanDerWaalsContact CB-CE1 3.45Å; K240-H330 WeakPolarHBondContact CB-CE1 3.24Å; H243-H330 HydrophobicContact CB-CB 4.25Å; H243-H330 AromaticContact CD2-CD2 3.51Å; H243-H330 AromaticContact CD2-NE2 3.76Å; H243-H330 AromaticContact CG-CD2 3.47Å; H243-H330 VanDerWaalsContact CG-CD2 3.47Å; A326-H330 PolarHBondContact O-N 3.15Å; R327-H330 WeakPolarHBondContact O-CB 3.45Å; R328-H330 PolarHBondContact O-N 3.24Å; H330-A332 VanDerWaalsContact C-N 3.3Å; H330-A332 PolarHBondContact O-N 2.9Å; H330-A333 WeakPolarHBondContact O-CB 3.43Å; H330-A333 PolarHBondContact O-N 3.35Å; H330-E334 IonicContact CE1-OE1 3.9Å; H330-E334 PolarHBondContact CE1-OE1 3.48Å; H330-E334 IonicContact ND1-OE1 2.71Å; H330-E334 IonicContact NE2-OE1 3.58Å; H330-E334 VanDerWaalsContact O-CG 3.32Å; H330-E334 WeakPolarHBondContact O-CG 3.49Å; H330-E334 PolarHBondContact O-N 3.49Å
331	W	96.1	Very high	96.5	Very high	120 Å²	120	34 Å²	34	46%	0.455	16%	0.162	S	C	.	.	H	α-helix	trans	-58.2	-39.4	179.5	-60.9	113.5	0	0	0	113.3	H243 R327 R328 E334 T335	H243-W331 AromaticContact CE1-CZ2 3.84Å; H243-W331 AromaticContact NE2-CZ2 3.74Å; R327-W331 VanDerWaalsContact O-CD1 3.27Å; R328-W331 PolarHBondContact O-N 2.8Å; W331-E334 PolarHBondContact O-N 2.83Å; W331-T335 PolarHBondContact O-OG1 3.31Å
332	A	97.3	Very high	96.5	Very high	5 Å²	5	34.1 Å²	34.1	4%	0.041	16%	0.162	C	C	.	.	H	α-helix	trans	-65.7	-43.3	174.8	0	0	0	0	0	111.7	R328 L329 H330 E334 T335 L336 C349 L353	R328-A332 PolarHBondContact O-N 3.18Å; L329-A332 PolarHBondContact O-N 3.15Å; H330-A332 VanDerWaalsContact C-N 3.3Å; H330-A332 PolarHBondContact O-N 2.9Å; A332-E334 VanDerWaalsContact C-N 3.28Å; A332-E334 PolarHBondContact O-N 3Å; A332-T335 PolarHBondContact O-N 2.76Å; A332-T335 PolarHBondContact O-OG1 3.31Å; A332-L336 WeakPolarHBondContact O-CG 3.32Å; A332-L336 PolarHBondContact O-N 2.8Å; A332-L336 VanDerWaalsContact O-N 3.14Å; A332-C349 HydrophobicContact CB-CB 3.92Å; A332-L353 HydrophobicContact CB-CD1 4.17Å; A332-L353 HydrophobicContact CB-CD2 4.12Å; A332-L353 HydrophobicContact CB-CG 3.91Å
333	A	96.6	Very high	96.4	Very high	3 Å²	3	33.8 Å²	33.8	3%	0.025	16%	0.161	C	C	.	.	H	α-helix	trans	-66.2	-27	179.6	0	0	0	0	0	113.5	T236 L239 L329 H330 F345	T236-A333 HydrophobicContact CG2-CB 4.02Å; L239-A333 HydrophobicContact CD1-CB 4.12Å; L329-A333 VanDerWaalsContact O-CB 3.25Å; L329-A333 WeakPolarHBondContact O-CB 3.3Å; L329-A333 PolarHBondContact O-N 2.88Å; H330-A333 WeakPolarHBondContact O-CB 3.43Å; H330-A333 PolarHBondContact O-N 3.35Å; A333-F345 HydrophobicContact CB-CE1 3.81Å; A333-F345 HydrophobicContact CB-CZ 4.11Å
334	E	92.7	Very high	96.5	Very high	66 Å²	66	33.8 Å²	33.8	31%	0.308	16%	0.162	S	C	.	.	H	α-helix	trans	-71.5	-30.7	174.6	-59.2	-151.3	129.3	0	0	112.9	F138 H330 W331 A332	F138-E334 HydrophobicContact CZ-CG 3.99Å; F138-E334 WeakPolarHBondContact CZ-OE1 3.41Å; H330-E334 IonicContact CE1-OE1 3.9Å; H330-E334 PolarHBondContact CE1-OE1 3.48Å; H330-E334 IonicContact ND1-OE1 2.71Å; H330-E334 IonicContact NE2-OE1 3.58Å; H330-E334 VanDerWaalsContact O-CG 3.32Å; H330-E334 WeakPolarHBondContact O-CG 3.49Å; H330-E334 PolarHBondContact O-N 3.49Å; W331-E334 PolarHBondContact O-N 2.83Å; A332-E334 VanDerWaalsContact C-N 3.28Å; A332-E334 PolarHBondContact O-N 3Å
335	T	93.1	Very high	96.5	Very high	114 Å²	114	31.8 Å²	31.8	70%	0.699	15%	0.149	S	C	*	.	H	α-helix	trans	-94.3	-23.5	-173.1	57.6	0	0	0	0	113.5	W331 A332	W331-T335 PolarHBondContact O-OG1 3.31Å; A332-T335 PolarHBondContact O-N 2.76Å; A332-T335 PolarHBondContact O-OG1 3.31Å
336	L	95.3	Very high	96.5	Very high	50 Å²	50	32 Å²	32	26%	0.262	15%	0.151	S	C	.	.	S	Bend	trans	-88.2	140.9	180	-68	176.3	0	0	0	111.6	H137 A332 I338 F345 M348 C349 A352	H137-L336 PolarHBondContact CE1-O 3.29Å; A332-L336 WeakPolarHBondContact O-CG 3.32Å; A332-L336 PolarHBondContact O-N 2.8Å; A332-L336 VanDerWaalsContact O-N 3.14Å; L336-I338 PolarHBondContact O-N 3.26Å; L336-F345 HydrophobicContact CB-CE2 4.01Å; L336-F345 HydrophobicContact CB-CZ 4.31Å; L336-M348 HydrophobicContact CD1-CB 4.26Å; L336-C349 HydrophobicContact CD1-CB 4.37Å; L336-A352 HydrophobicContact CD1-CB 4.13Å
337	E	93.4	Very high	96.5	Very high	125 Å²	125	32.1 Å²	32.1	58%	0.584	15%	0.151	S	C	*	.	P	Polyproline II helix	trans	-63.9	131.3	171.6	-60.8	-175.8	137	0	0	110.7	R134 F345	R134-E337 IonicContact CZ-OE2 3.98Å; R134-E337 VanDerWaalsContact NH1-CD 3.34Å; R134-E337 IonicContact NH1-OE1 3.59Å; R134-E337 IonicContact NH1-OE2 3.04Å; R134-E337 PolarHBondContact NH1-OE2 3.01Å; R134-E337 IonicContact NH2-OE2 3.42Å; R134-E337 PolarHBondContact NH2-OE2 3.43Å; E337-F345 WeakPolarHBondContact O-CE2 3.36Å
338	I	94.3	Very high	96.6	Very high	5 Å²	5	31.2 Å²	31.2	3%	0.026	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-54.2	145.3	179.2	-68.8	169.5	0	0	0	111	F130 R134 H137 T232 L233 L336	F130-I338 HydrophobicContact CE2-CG2 3.9Å; F130-I338 HydrophobicContact CZ-CG2 4Å; F130-I338 WeakPolarHBondContact CZ-O 3.22Å; R134-I338 PolarHBondContact NE-O 3.04Å; R134-I338 PolarHBondContact NH2-O 2.78Å; H137-I338 HydrophobicContact CB-CD1 4.4Å; T232-I338 HydrophobicContact CG2-CG2 3.74Å; L233-I338 HydrophobicContact CD2-CD1 3.48Å; L233-I338 VanDerWaalsContact CD2-CD1 3.48Å; L336-I338 PolarHBondContact O-N 3.26Å
339	Y	96.9	Very high	96.6	Very high	3 Å²	3	27.2 Å²	27.2	1%	0.012	13%	0.134	C	C	.	.			trans	-122.3	146.7	178.8	-166.5	-108.1	0	0	0	111.1	T232 I300 Y305 Y310 I341 V344 M348	T232-Y339 VanDerWaalsContact CB-O 3.29Å; T232-Y339 WeakPolarHBondContact CB-O 3.47Å; T232-Y339 PolarHBondContact OG1-O 3.16Å; I300-Y339 HydrophobicContact CD1-CE1 4.46Å; I300-Y339 WeakPolarHBondContact CG2-OH 3.34Å; Y305-Y339 HydrophobicContact CD2-CE2 4.05Å; Y310-Y339 HydrophobicContact CE1-CE1 4.18Å; Y310-Y339 AromaticContact CE1-CZ 3.91Å; Y310-Y339 WeakPolarHBondContact CE1-OH 3.41Å; Y310-Y339 PolarHBondContact OH-OH 3.17Å; Y339-I341 HydrophobicContact CD1-CB 4.08Å; Y339-I341 HydrophobicContact CE1-CB 4.05Å; Y339-I341 HydrophobicContact CE1-CD1 4.28Å; Y339-I341 HydrophobicContact CE1-CG1 4.19Å; Y339-I341 PolarHBondContact O-N 2.92Å; Y339-I341 VanDerWaalsContact O-N 3.14Å; Y339-V344 HydrophobicContact CD1-CB 4.01Å; Y339-V344 HydrophobicContact CD1-CG1 3.99Å; Y339-V344 HydrophobicContact CE1-CB 3.98Å; Y339-V344 HydrophobicContact CE1-CG1 3.75Å; Y339-M348 HydrophobicContact CD1-CE 3.82Å; Y339-M348 HydrophobicContact CD2-CE 3.67Å; Y339-M348 HydrophobicContact CE1-CE 4.03Å; Y339-M348 HydrophobicContact CE2-CE 3.89Å; Y339-M348 HydrophobicContact CG-CE 3.63Å
340	P	96.6	Very high	96.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-68.6	-12.1	-173.9	-19.7	30.7	0	0	0	115.9	F130 F229 I300 L304	F130-P340 HydrophobicContact CD1-CG 3.9Å; F130-P340 HydrophobicContact CD2-CB 4.48Å; F130-P340 HydrophobicContact CD2-CG 4.23Å; F130-P340 HydrophobicContact CE1-CG 3.6Å; F130-P340 HydrophobicContact CE2-CB 4.25Å; F130-P340 HydrophobicContact CE2-CG 3.94Å; F130-P340 HydrophobicContact CG-CG 4.21Å; F130-P340 HydrophobicContact CZ-CB 4.37Å; F130-P340 VanDerWaalsContact CZ-CD 3.49Å; F130-P340 HydrophobicContact CZ-CG 3.61Å; F229-P340 HydrophobicContact CB-CB 4.34Å; F229-P340 HydrophobicContact CD1-CB 3.65Å; F229-P340 HydrophobicContact CD2-CB 4.25Å; F229-P340 HydrophobicContact CE1-CB 3.92Å; F229-P340 HydrophobicContact CE2-CB 4.46Å; F229-P340 HydrophobicContact CG-CB 3.84Å; F229-P340 HydrophobicContact CZ-CB 4.33Å; I300-P340 HydrophobicContact CD1-CB 4.23Å; I300-P340 HydrophobicContact CD1-CG 4.11Å; L304-P340 HydrophobicContact CD1-CG 4.02Å
341	I	97.4	Very high	96.7	Very high	10 Å²	10	31.8 Å²	31.8	5%	0.051	16%	0.156	C	C	.	.	S	Bend	trans	-117.1	110.5	179.5	-52.6	174.8	0	0	0	107.4	Y298 I300 Y339 D343 V344 F345	Y298-I341 HydrophobicContact CD1-CD1 4.47Å; I300-I341 HydrophobicContact CD1-CD1 3.99Å; I300-I341 HydrophobicContact CD1-CG1 4.2Å; I300-I341 HydrophobicContact CG1-CD1 3.84Å; Y339-I341 HydrophobicContact CD1-CB 4.08Å; Y339-I341 HydrophobicContact CE1-CB 4.05Å; Y339-I341 HydrophobicContact CE1-CD1 4.28Å; Y339-I341 HydrophobicContact CE1-CG1 4.19Å; Y339-I341 PolarHBondContact O-N 2.92Å; Y339-I341 VanDerWaalsContact O-N 3.14Å; I341-D343 PolarHBondContact O-N 2.91Å; I341-V344 HydrophobicContact CB-CB 4.13Å; I341-V344 HydrophobicContact CB-CG2 4.01Å; I341-V344 HydrophobicContact CD1-CG2 4.5Å; I341-V344 HydrophobicContact CG2-CB 4.2Å; I341-V344 HydrophobicContact CG2-CG2 3.69Å; I341-V344 PolarHBondContact O-N 3Å; I341-F345 PolarHBondContact O-N 3.3Å
342	D	97.1	Very high	96.8	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.027	16%	0.158	C	C	.	.	H	α-helix	trans	-58.6	-45.8	-173.5	60.2	-32.6	0	0	0	113.2	K160 L231 T232 E235 V344 F345 L346	K160-D342 IonicContact NZ-OD2 2.79Å; K160-D342 PolarHBondContact NZ-OD2 3.36Å; L231-D342 HydrophobicContact CB-CB 3.86Å; T232-D342 VanDerWaalsContact OG1-CA 3.29Å; T232-D342 WeakPolarHBondContact OG1-CA 3.31Å; T232-D342 PolarHBondContact OG1-N 3.44Å; E235-D342 HydrophobicContact CG-CB 3.75Å; D342-V344 VanDerWaalsContact C-N 3.33Å; D342-V344 PolarHBondContact O-N 3.18Å; D342-F345 WeakPolarHBondContact O-CB 3.36Å; D342-F345 PolarHBondContact O-N 2.93Å; D342-L346 PolarHBondContact O-N 3.32Å
343	D	97.1	Very high	96.8	Very high	18 Å²	18	30.2 Å²	30.2	10%	0.096	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-41.2	179.2	-61	-32.8	0	0	0	112	Y313 A314 G316 I341 F345 L346 G347	Y313-D343 WeakPolarHBondContact CB-O 3.3Å; Y313-D343 HydrophobicContact CD2-CB 3.74Å; Y313-D343 HydrophobicContact CE2-CB 4.14Å; A314-D343 WeakPolarHBondContact O-CB 3.35Å; G316-D343 VanDerWaalsContact CA-CG 3.45Å; G316-D343 VanDerWaalsContact CA-OD1 3.32Å; G316-D343 WeakPolarHBondContact CA-OD1 3.18Å; G316-D343 WeakPolarHBondContact CA-OD2 3.24Å; G316-D343 PolarHBondContact N-OD2 2.9Å; I341-D343 PolarHBondContact O-N 2.91Å; D343-F345 VanDerWaalsContact C-N 3.35Å; D343-L346 PolarHBondContact O-N 3.28Å; D343-G347 PolarHBondContact O-N 2.99Å
344	V	98	Very high	96.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-67.6	-40.2	177.3	179.8	0	0	0	0	109.8	Y310 Y313 Y339 I341 D342 L346 G347 M348	Y310-V344 HydrophobicContact CD1-CG1 3.53Å; Y310-V344 HydrophobicContact CD2-CG1 4.16Å; Y310-V344 HydrophobicContact CD2-CG2 4Å; Y310-V344 HydrophobicContact CE1-CG1 3.86Å; Y310-V344 HydrophobicContact CE2-CG1 4.42Å; Y310-V344 HydrophobicContact CE2-CG2 4.07Å; Y310-V344 HydrophobicContact CG-CG1 3.7Å; Y310-V344 HydrophobicContact CG-CG2 4.36Å; Y313-V344 HydrophobicContact CD1-CG2 4.09Å; Y313-V344 HydrophobicContact CD2-CG2 4.41Å; Y313-V344 HydrophobicContact CE1-CG2 3.84Å; Y313-V344 HydrophobicContact CE2-CG2 4.16Å; Y313-V344 HydrophobicContact CG-CG2 4.38Å; Y339-V344 HydrophobicContact CD1-CB 4.01Å; Y339-V344 HydrophobicContact CD1-CG1 3.99Å; Y339-V344 HydrophobicContact CE1-CB 3.98Å; Y339-V344 HydrophobicContact CE1-CG1 3.75Å; I341-V344 HydrophobicContact CB-CB 4.13Å; I341-V344 HydrophobicContact CB-CG2 4.01Å; I341-V344 HydrophobicContact CD1-CG2 4.5Å; I341-V344 HydrophobicContact CG2-CB 4.2Å; I341-V344 HydrophobicContact CG2-CG2 3.69Å; I341-V344 PolarHBondContact O-N 3Å; D342-V344 VanDerWaalsContact C-N 3.33Å; D342-V344 PolarHBondContact O-N 3.18Å; V344-L346 VanDerWaalsContact C-N 3.35Å; V344-L346 PolarHBondContact O-N 2.89Å; V344-G347 CarbonylContact O-C 3.56Å; V344-G347 WeakPolarHBondContact O-CA 3.5Å; V344-G347 PolarHBondContact O-N 3.17Å; V344-G347 VanDerWaalsContact O-N 3.1Å; V344-M348 HydrophobicContact CG1-CE 3.72Å; V344-M348 WeakPolarHBondContact O-CG 3.35Å; V344-M348 PolarHBondContact O-N 3.38Å
345	F	98.1	Very high	97.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.8	-46.7	174.6	-178.5	-103.6	0	0	0	111.5	T232 T236 A333 L336 E337 I341 D342 D343 G347 M348 C349	T232-F345 HydrophobicContact CG2-CB 3.72Å; T232-F345 HydrophobicContact CG2-CD1 3.36Å; T232-F345 HydrophobicContact CG2-CD2 3.91Å; T232-F345 HydrophobicContact CG2-CE1 3.86Å; T232-F345 HydrophobicContact CG2-CE2 4.36Å; T232-F345 HydrophobicContact CG2-CG 3.36Å; T232-F345 HydrophobicContact CG2-CZ 4.33Å; T236-F345 HydrophobicContact CG2-CE1 3.7Å; T236-F345 HydrophobicContact CG2-CZ 4.11Å; A333-F345 HydrophobicContact CB-CE1 3.81Å; A333-F345 HydrophobicContact CB-CZ 4.11Å; L336-F345 HydrophobicContact CB-CE2 4.01Å; L336-F345 HydrophobicContact CB-CZ 4.31Å; E337-F345 WeakPolarHBondContact O-CE2 3.36Å; I341-F345 PolarHBondContact O-N 3.3Å; D342-F345 WeakPolarHBondContact O-CB 3.36Å; D342-F345 PolarHBondContact O-N 2.93Å; D343-F345 VanDerWaalsContact C-N 3.35Å; F345-G347 VanDerWaalsContact C-N 3.28Å; F345-G347 PolarHBondContact O-N 2.96Å; F345-M348 WeakPolarHBondContact O-CA 3.22Å; F345-M348 WeakPolarHBondContact O-CB 3.4Å; F345-M348 PolarHBondContact O-N 2.89Å; F345-C349 VanDerWaalsContact CE1-SG 3.59Å; F345-C349 PolarHBondContact O-N 3.27Å; F345-C349 PolarHBondContact O-SG 3.25Å; F345-C349 VanDerWaalsContact O-SG 3.39Å
346	L	98.1	Very high	97.3	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-37.4	174.2	-73.7	175.2	0	0	0	112.2	E235 L239 F319 D342 D343 V344 M348 C349 L350	E235-L346 HydrophobicContact CG-CD1 4.47Å; L239-L346 HydrophobicContact CD1-CD2 4.04Å; F319-L346 HydrophobicContact CE1-CD1 3.99Å; F319-L346 HydrophobicContact CE2-CD1 4.39Å; F319-L346 HydrophobicContact CZ-CD1 3.47Å; F319-L346 VanDerWaalsContact CZ-CD1 3.47Å; D342-L346 PolarHBondContact O-N 3.32Å; D343-L346 PolarHBondContact O-N 3.28Å; V344-L346 VanDerWaalsContact C-N 3.35Å; V344-L346 PolarHBondContact O-N 2.89Å; L346-M348 VanDerWaalsContact C-N 3.32Å; L346-M348 PolarHBondContact O-N 2.86Å; L346-C349 WeakPolarHBondContact O-CB 3.37Å; L346-C349 PolarHBondContact O-N 3.28Å; L346-L350 VanDerWaalsContact O-CG 3.3Å; L346-L350 WeakPolarHBondContact O-CG 3.49Å; L346-L350 PolarHBondContact O-N 2.87Å
347	G	98.3	Very high	97.4	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-58.7	-40	169.9	0	0	0	0	0	113.5	P312 D343 V344 F345 L350 E351	P312-G347 WeakPolarHBondContact O-CA 3.34Å; D343-G347 PolarHBondContact O-N 2.99Å; V344-G347 CarbonylContact O-C 3.56Å; V344-G347 WeakPolarHBondContact O-CA 3.5Å; V344-G347 PolarHBondContact O-N 3.17Å; V344-G347 VanDerWaalsContact O-N 3.1Å; F345-G347 VanDerWaalsContact C-N 3.28Å; F345-G347 PolarHBondContact O-N 2.96Å; G347-L350 PolarHBondContact O-N 2.7Å; G347-E351 WeakPolarHBondContact O-CB 3.45Å; G347-E351 PolarHBondContact O-N 3.47Å
348	M	98.5	Very high	97.5	Very high	33 Å²	33	31 Å²	31	16%	0.163	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-41.4	173.7	-59.6	-175.4	-164.9	0	0	111.5	Y305 P311 L336 Y339 V344 F345 L346 L350 E351 A352	Y305-M348 HydrophobicContact CD2-CE 3.93Å; Y305-M348 HydrophobicContact CE2-CE 3.65Å; P311-M348 HydrophobicContact CG-CB 4.46Å; P311-M348 HydrophobicContact CG-CG 3.86Å; L336-M348 HydrophobicContact CD1-CB 4.26Å; Y339-M348 HydrophobicContact CD1-CE 3.82Å; Y339-M348 HydrophobicContact CD2-CE 3.67Å; Y339-M348 HydrophobicContact CE1-CE 4.03Å; Y339-M348 HydrophobicContact CE2-CE 3.89Å; Y339-M348 HydrophobicContact CG-CE 3.63Å; V344-M348 HydrophobicContact CG1-CE 3.72Å; V344-M348 WeakPolarHBondContact O-CG 3.35Å; V344-M348 PolarHBondContact O-N 3.38Å; F345-M348 WeakPolarHBondContact O-CA 3.22Å; F345-M348 WeakPolarHBondContact O-CB 3.4Å; F345-M348 PolarHBondContact O-N 2.89Å; L346-M348 VanDerWaalsContact C-N 3.32Å; L346-M348 PolarHBondContact O-N 2.86Å; M348-L350 PolarHBondContact O-N 3.41Å; M348-E351 PolarHBondContact O-N 3.34Å; M348-A352 PolarHBondContact O-N 3.05Å
349	C	98.6	Very high	97.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-42.2	174.6	-62.9	0	0	0	0	111.9	L329 A332 L336 F345 L346 A352 L353	L329-C349 HydrophobicContact CD2-CB 3.58Å; A332-C349 HydrophobicContact CB-CB 3.92Å; L336-C349 HydrophobicContact CD1-CB 4.37Å; F345-C349 VanDerWaalsContact CE1-SG 3.59Å; F345-C349 PolarHBondContact O-N 3.27Å; F345-C349 PolarHBondContact O-SG 3.25Å; F345-C349 VanDerWaalsContact O-SG 3.39Å; L346-C349 WeakPolarHBondContact O-CB 3.37Å; L346-C349 PolarHBondContact O-N 3.28Å; C349-A352 PolarHBondContact O-N 3.25Å; C349-L353 WeakPolarHBondContact O-CG 3.39Å; C349-L353 PolarHBondContact O-N 3.19Å
350	L	98.6	Very high	97.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-43	175.7	-72.7	168.7	0	0	0	111.8	F280 L325 L329 L346 G347 M348 L353 Q354 V355 P357	F280-L350 HydrophobicContact CB-CD2 4.27Å; F280-L350 HydrophobicContact CD1-CD1 3.84Å; F280-L350 HydrophobicContact CD2-CD1 4.05Å; F280-L350 HydrophobicContact CD2-CD2 3.89Å; F280-L350 HydrophobicContact CD2-CG 4.47Å; F280-L350 HydrophobicContact CE1-CD1 3.89Å; F280-L350 HydrophobicContact CE2-CD1 4.1Å; F280-L350 HydrophobicContact CE2-CD2 4.45Å; F280-L350 HydrophobicContact CG-CD1 3.92Å; F280-L350 HydrophobicContact CG-CD2 4.08Å; F280-L350 HydrophobicContact CZ-CD1 4.02Å; L325-L350 HydrophobicContact CD1-CD2 4.43Å; L325-L350 HydrophobicContact CD2-CD2 4.04Å; L329-L350 HydrophobicContact CD2-CD2 4Å; L329-L350 HydrophobicContact CD2-CG 4.12Å; L346-L350 VanDerWaalsContact O-CG 3.3Å; L346-L350 WeakPolarHBondContact O-CG 3.49Å; L346-L350 PolarHBondContact O-N 2.87Å; G347-L350 PolarHBondContact O-N 2.7Å; M348-L350 PolarHBondContact O-N 3.41Å; L350-L353 CarbonylContact O-C 3.47Å; L350-L353 PolarHBondContact O-N 3.4Å; L350-Q354 PolarHBondContact O-N 3.04Å; L350-V355 HydrophobicContact CD2-CB 3.99Å; L350-V355 HydrophobicContact CD2-CG1 3.88Å; L350-V355 PolarHBondContact O-N 3.26Å; L350-P357 HydrophobicContact CD1-CB 4.03Å; L350-P357 HydrophobicContact CD1-CG 4.12Å
351	E	98.2	Very high	97.5	Very high	103 Å²	103	41.7 Å²	41.7	48%	0.481	22%	0.222	S	C	.	.	H	α-helix	trans	-59.1	-46	173.9	-178.9	175.4	-113.4	0	0	111.3	P311 G347 M348 L353 Q354	P311-E351 HydrophobicContact CB-CB 3.99Å; P311-E351 HydrophobicContact CB-CG 4.45Å; G347-E351 WeakPolarHBondContact O-CB 3.45Å; G347-E351 PolarHBondContact O-N 3.47Å; M348-E351 PolarHBondContact O-N 3.34Å; E351-L353 VanDerWaalsContact C-N 3.27Å; E351-L353 PolarHBondContact O-N 3.03Å; E351-Q354 PolarHBondContact O-N 3.43Å
352	A	98.3	Very high	97.3	Very high	59 Å²	59	41.4 Å²	41.4	49%	0.488	22%	0.221	S	C	.	.	H	α-helix	trans	-61.6	-34.5	176.7	0	0	0	0	0	112.8	L336 M348 C349 Q354	L336-A352 HydrophobicContact CD1-CB 4.13Å; M348-A352 PolarHBondContact O-N 3.05Å; C349-A352 PolarHBondContact O-N 3.25Å; A352-Q354 VanDerWaalsContact C-N 3.29Å
353	L	98.2	Very high	97.3	Very high	33 Å²	33	41.2 Å²	41.2	17%	0.173	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.5	175.4	-66.5	178	0	0	0	114.2	L325 R328 L329 A332 C349 L350 E351 V355	L325-L353 HydrophobicContact CD1-CD1 4.12Å; R328-L353 HydrophobicContact CB-CD1 3.9Å; R328-L353 HydrophobicContact CB-CD2 4.39Å; R328-L353 PolarHBondContact NH2-O 3.31Å; L329-L353 HydrophobicContact CD2-CD1 3.86Å; L329-L353 HydrophobicContact CG-CD1 4.12Å; A332-L353 HydrophobicContact CB-CD1 4.17Å; A332-L353 HydrophobicContact CB-CD2 4.12Å; A332-L353 HydrophobicContact CB-CG 3.91Å; C349-L353 WeakPolarHBondContact O-CG 3.39Å; C349-L353 PolarHBondContact O-N 3.19Å; L350-L353 CarbonylContact O-C 3.47Å; L350-L353 PolarHBondContact O-N 3.4Å; E351-L353 VanDerWaalsContact C-N 3.27Å; E351-L353 PolarHBondContact O-N 3.03Å; L353-V355 HydrophobicContact CB-CG2 4.14Å; L353-V355 PolarHBondContact O-N 2.92Å
354	Q	97.8	Very high	97.1	Very high	181 Å²	181	42.7 Å²	42.7	85%	0.846	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	33.6	-174.4	-55.1	178.2	-0.3	0	0	113.3	L350 E351 A352	L350-Q354 PolarHBondContact O-N 3.04Å; E351-Q354 PolarHBondContact O-N 3.43Å; A352-Q354 VanDerWaalsContact C-N 3.29Å
355	V	97.9	Very high	96.6	Very high	12 Å²	12	43.1 Å²	43.1	7%	0.073	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-102.9	126.4	176.2	176.2	0	0	0	0	108.9	N278 L325 L350 L353	N278-V355 HydrophobicContact CB-CG1 4.24Å; N278-V355 HydrophobicContact CB-CG2 4.35Å; L325-V355 HydrophobicContact CD1-CB 4.47Å; L325-V355 HydrophobicContact CD1-CG1 4.38Å; L325-V355 HydrophobicContact CD1-CG2 3.97Å; L325-V355 HydrophobicContact CD2-CG1 4.07Å; L350-V355 HydrophobicContact CD2-CB 3.99Å; L350-V355 HydrophobicContact CD2-CG1 3.88Å; L350-V355 PolarHBondContact O-N 3.26Å; L353-V355 HydrophobicContact CB-CG2 4.14Å; L353-V355 PolarHBondContact O-N 2.92Å
356	T	96.6	Very high	95.9	Very high	105 Å²	105	49.6 Å²	49.6	64%	0.644	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-94	120.3	175.9	-59.6	0	0	0	0	109.6
357	P	97.6	Very high	95	Very high	6 Å²	6	50 Å²	50	4%	0.039	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-67.7	144.1	176.6	28.4	-34	0	0	0	111.3	F280 V284 P312 L350	F280-P357 HydrophobicContact CB-CB 4.48Å; F280-P357 HydrophobicContact CD1-CB 3.7Å; F280-P357 HydrophobicContact CE1-CB 4.41Å; F280-P357 HydrophobicContact CG-CB 4.44Å; F280-P357 CarbonylContact O-C 3.47Å; F280-P357 WeakPolarHBondContact O-CA 3.25Å; V284-P357 HydrophobicContact CG1-CB 4.35Å; V284-P357 HydrophobicContact CG1-CG 3.89Å; V284-P357 HydrophobicContact CG2-CB 3.85Å; V284-P357 HydrophobicContact CG2-CG 4.3Å; P312-P357 HydrophobicContact CB-CG 3.91Å; L350-P357 HydrophobicContact CD1-CB 4.03Å; L350-P357 HydrophobicContact CD1-CG 4.12Å
358	V	96.6	Very high	94.2	Very high	70 Å²	70	51.2 Å²	51.2	42%	0.424	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.2	-176	-177.8	0	0	0	0	109.9	F280 V281 G282 V284	F280-V358 PolarHBondContact O-N 2.87Å; V281-V358 VanDerWaalsContact CA-O 3.29Å; V281-V358 WeakPolarHBondContact CA-O 3.2Å; V281-V358 HydrophobicContact CB-CB 4.27Å; V281-V358 HydrophobicContact CG2-CB 4.25Å; V281-V358 HydrophobicContact CG2-CG1 4.34Å; V281-V358 WeakPolarHBondContact CG2-O 3.32Å; G282-V358 PolarHBondContact N-O 3.36Å; G282-V358 VanDerWaalsContact N-O 3.12Å; V284-V358 VanDerWaalsContact CG2-O 3.3Å; V284-V358 WeakPolarHBondContact CG2-O 3.27Å
359	K	96.6	Very high	93.4	Very high	113 Å²	113	51.6 Å²	51.6	49%	0.491	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	136.5	173.2	-173.9	172.9	176.9	177	0	110.6	G282 V284 F286	G282-K359 CarbonylContact O-C 3.45Å; G282-K359 WeakPolarHBondContact O-CA 3.22Å; V284-K359 HydrophobicContact CB-CB 4Å; V284-K359 HydrophobicContact CB-CG 4.47Å; V284-K359 HydrophobicContact CG2-CB 4.4Å; F286-K359 HydrophobicContact CE2-CB 4.3Å
360	H	95.4	Very high	92.4	Very high	33 Å²	33	60.7 Å²	60.7	15%	0.153	31%	0.312	C	S	.	.			trans	-137.9	128.6	173.7	-169.3	-92	0	0	0	112.5	W72 F269 V281 G282 A362 F363	W72-H360 AromaticContact CE3-CE1 3.6Å; W72-H360 AromaticContact CE3-NE2 3.58Å; W72-H360 AromaticContact CZ3-CE1 3.27Å; W72-H360 WeakPolarHBondContact CZ3-CE1 3.48Å; W72-H360 AromaticContact CZ3-NE2 3.74Å; F269-H360 AromaticContact CD2-NE2 3.75Å; F269-H360 AromaticContact CE2-CD2 3.75Å; F269-H360 AromaticContact CE2-NE2 3.84Å; V281-H360 HydrophobicContact CG2-CB 3.46Å; V281-H360 VanDerWaalsContact CG2-CB 3.46Å; G282-H360 PolarHBondContact O-N 3.39Å; H360-A362 VanDerWaalsContact CE1-CB 3.43Å; H360-A362 WeakPolarHBondContact CE1-CB 3.47Å; H360-A362 WeakPolarHBondContact ND1-CB 3.37Å; H360-A362 PolarHBondContact ND1-N 2.85Å; H360-A362 PolarHBondContact O-N 3.23Å; H360-F363 HydrophobicContact CB-CD2 3.85Å; H360-F363 HydrophobicContact CB-CE2 4.12Å; H360-F363 AromaticContact ND1-CD2 3.82Å; H360-F363 AromaticContact ND1-CE2 3.96Å; H360-F363 PolarHBondContact O-N 3.46Å; H360-F363 VanDerWaalsContact O-N 3.17Å
361	N	93.8	Very high	91.7	Very high	86 Å²	86	65.2 Å²	65.2	46%	0.46	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.1	-169.4	-75.9	-13.7	0	0	0	114.5	F363 K364	N361-F363 PolarHBondContact O-N 3.28Å; N361-K364 WeakPolarHBondContact O-CE 3.45Å; N361-K364 PolarHBondContact O-NZ 2.88Å
362	A	95.1	Very high	90.7	Very high	5 Å²	5	68.5 Å²	68.5	4%	0.041	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-4.9	176.5	0	0	0	0	0	113.7	W72 H360 I387 V388	W72-A362 HydrophobicContact CH2-CB 3.75Å; W72-A362 HydrophobicContact CZ3-CB 3.83Å; H360-A362 VanDerWaalsContact CE1-CB 3.43Å; H360-A362 WeakPolarHBondContact CE1-CB 3.47Å; H360-A362 WeakPolarHBondContact ND1-CB 3.37Å; H360-A362 PolarHBondContact ND1-N 2.85Å; H360-A362 PolarHBondContact O-N 3.23Å; A362-I387 HydrophobicContact CB-CB 4.15Å; A362-I387 HydrophobicContact CB-CD1 4.08Å; A362-I387 HydrophobicContact CB-CG1 3.85Å; A362-I387 PolarHBondContact O-N 3.46Å; A362-V388 PolarHBondContact O-N 3Å; A362-V388 VanDerWaalsContact O-N 3.11Å
363	F	96.1	Very high	90	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.8	170.7	-68	-102	0	0	0	108.6	V281 D283 G318 L320 H360 N361 I387 V388	V281-F363 HydrophobicContact CG2-CE2 4.37Å; D283-F363 HydrophobicContact CB-CB 3.91Å; G318-F363 VanDerWaalsContact O-CD1 3.26Å; G318-F363 WeakPolarHBondContact O-CD1 3.41Å; L320-F363 HydrophobicContact CD1-CZ 3.95Å; L320-F363 HydrophobicContact CG-CZ 4.08Å; H360-F363 HydrophobicContact CB-CD2 3.85Å; H360-F363 HydrophobicContact CB-CE2 4.12Å; H360-F363 AromaticContact ND1-CD2 3.82Å; H360-F363 AromaticContact ND1-CE2 3.96Å; H360-F363 PolarHBondContact O-N 3.46Å; H360-F363 VanDerWaalsContact O-N 3.17Å; N361-F363 PolarHBondContact O-N 3.28Å; F363-I387 HydrophobicContact CD2-CB 4.46Å; F363-I387 HydrophobicContact CE1-CG2 3.9Å; F363-I387 HydrophobicContact CE2-CB 4.16Å; F363-I387 HydrophobicContact CE2-CD1 3.78Å; F363-I387 HydrophobicContact CE2-CG2 4.1Å; F363-I387 HydrophobicContact CZ-CB 4.21Å; F363-I387 HydrophobicContact CZ-CD1 4.23Å; F363-I387 HydrophobicContact CZ-CG2 3.65Å; F363-V388 HydrophobicContact CD1-CB 3.89Å; F363-V388 HydrophobicContact CD1-CG2 3.54Å; F363-V388 HydrophobicContact CE1-CG2 3.71Å
364	K	93.9	Very high	89.3	Confident	49 Å²	49	72.2 Å²	72.2	21%	0.213	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	79.8	-176.8	-62.7	-60.3	-165.5	-157.2	0	110.3	N361 F366 L368 M386 V388 H390	N361-K364 WeakPolarHBondContact O-CE 3.45Å; N361-K364 PolarHBondContact O-NZ 2.88Å; K364-F366 VanDerWaalsContact C-N 3.27Å; K364-F366 PolarHBondContact O-N 3.11Å; K364-L368 HydrophobicContact CB-CD2 4.45Å; K364-L368 HydrophobicContact CG-CD2 4.02Å; K364-M386 HydrophobicContact CD-SD 4.39Å; K364-M386 HydrophobicContact CG-CG 4.46Å; K364-M386 HydrophobicContact CG-SD 3.67Å; K364-V388 PolarHBondContact N-O 2.86Å; K364-H390 PolarHBondContact O-N 3.05Å
365	T	87.3	Confident	88.6	Confident	10 Å²	10	72.7 Å²	72.7	6%	0.061	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-6.7	-175.5	64.9	0	0	0	0	113.9	D283 H390	D283-T365 HydrophobicContact CB-CG2 3.64Å; D283-T365 PolarHBondContact OD2-N 3.33Å; D283-T365 PolarHBondContact OD2-OG1 2.72Å; T365-H390 WeakPolarHBondContact O-CB 3.32Å
366	F	82.9	Confident	87.9	Confident	137 Å²	137	76.6 Å²	76.6	60%	0.601	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	24.1	176.7	-62.3	-84.3	0	0	0	113	I285 K364	I285-F366 HydrophobicContact CD1-CE2 3.94Å; I285-F366 HydrophobicContact CD1-CZ 3.99Å; K364-F366 VanDerWaalsContact C-N 3.27Å; K364-F366 PolarHBondContact O-N 3.11Å
367	G	79.8	Confident	87.2	Confident	13 Å²	13	72.9 Å²	72.9	13%	0.134	36%	0.356	C	S	.	.			trans	82.9	166.8	-169.5	0	0	0	0	0	113.2	V369 H390	G367-V369 VanDerWaalsContact C-N 3.27Å; G367-V369 PolarHBondContact O-N 2.93Å; G367-H390 WeakPolarHBondContact CA-O 3.42Å; G367-H390 PolarHBondContact N-O 3.23Å; G367-H390 VanDerWaalsContact N-O 3.16Å
368	L	80.4	Confident	86.6	Confident	26 Å²	26	80.6 Å²	80.6	14%	0.136	38%	0.384	C	S	.	.	S	Bend	trans	-62.9	-38.1	177.1	-67	174.1	0	0	0	111.2	K364 M376 N377 F382 F383 M386 V389	K364-L368 HydrophobicContact CB-CD2 4.45Å; K364-L368 HydrophobicContact CG-CD2 4.02Å; L368-M376 WeakPolarHBondContact CD1-O 3.4Å; L368-N377 WeakPolarHBondContact CB-OD1 3.34Å; L368-N377 PolarHBondContact N-OD1 3.44Å; L368-F382 HydrophobicContact CD1-CB 3.55Å; L368-F382 HydrophobicContact CD1-CD2 4.48Å; L368-F382 HydrophobicContact CD1-CG 4.28Å; L368-F382 HydrophobicContact CD2-CB 4.16Å; L368-F382 HydrophobicContact CG-CB 4.48Å; L368-F383 HydrophobicContact CD1-CD2 3.94Å; L368-F383 HydrophobicContact CD1-CE2 3.63Å; L368-F383 HydrophobicContact CD1-CZ 4.45Å; L368-M386 HydrophobicContact CD2-CE 4.37Å; L368-M386 HydrophobicContact CD2-CG 3.82Å; L368-M386 HydrophobicContact CD2-SD 4.26Å; L368-V389 HydrophobicContact CD2-CG1 4.2Å; L368-V389 HydrophobicContact CD2-CG2 4Å; L368-V389 HydrophobicContact CG-CG1 4.02Å
369	V	82.6	Confident	86.3	Confident	41 Å²	41	81.2 Å²	81.2	25%	0.248	38%	0.383	C	S	.	.	S	Bend	trans	-131.7	148.1	175	-60.9	0	0	0	0	111.4	G367 N371 M376 N377	G367-V369 VanDerWaalsContact C-N 3.27Å; G367-V369 PolarHBondContact O-N 2.93Å; V369-N371 PolarHBondContact O-N 2.95Å; V369-N371 VanDerWaalsContact O-N 3.12Å; V369-M376 HydrophobicContact CG1-CB 4.32Å; V369-M376 HydrophobicContact CG1-CE 4.09Å; V369-M376 HydrophobicContact CG1-SD 4.22Å; V369-M376 HydrophobicContact CG2-CB 4.26Å; V369-N377 WeakPolarHBondContact CG2-OD1 3.34Å; V369-N377 PolarHBondContact N-OD1 3.24Å; V369-N377 PolarHBondContact O-ND2 2.86Å; V369-N377 PolarHBondContact O-OD1 2.79Å
370	K	77.6	Confident	86.1	Confident	191 Å²	191	76.6 Å²	76.6	83%	0.83	36%	0.364	S	S	*	.	S	Bend	trans	-56.7	-32	-176.9	-66.1	-178.7	-178.9	174.3	0	113.7	K372	K370-K372 PolarHBondContact O-N 3.07Å
371	N	82.9	Confident	85.9	Confident	97 Å²	97	76.2 Å²	76.2	52%	0.519	37%	0.365	S	S	.	.			trans	-76	103.3	175.2	179.6	5.7	0	0	0	109.7	V369 N373 S374 N377	V369-N371 PolarHBondContact O-N 2.95Å; V369-N371 VanDerWaalsContact O-N 3.12Å; N371-N373 PolarHBondContact O-N 2.87Å; N371-N373 VanDerWaalsContact O-N 3.11Å; N371-N373 PolarHBondContact OD1-N 2.92Å; N371-N373 VanDerWaalsContact OD1-N 3.08Å; N371-S374 VanDerWaalsContact O-CB 3.24Å; N371-S374 WeakPolarHBondContact O-CB 3.04Å; N371-S374 PolarHBondContact O-N 2.97Å; N371-N377 PolarHBondContact O-ND2 3.22Å
372	K	78.3	Confident	85.7	Confident	171 Å²	171	74.4 Å²	74.4	74%	0.743	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-32	179.8	-67.1	-179.1	179.1	172.9	0	113.2	K370 S374 N377	K370-K372 PolarHBondContact O-N 3.07Å; K372-S374 VanDerWaalsContact C-N 3.3Å; K372-S374 PolarHBondContact O-N 3.41Å; K372-N377 PolarHBondContact O-ND2 3Å
373	N	82.1	Confident	85.6	Confident	149 Å²	149	74.2 Å²	74.2	80%	0.797	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-0.9	-177.8	-62.9	-21.6	0	0	0	113.7	N371 K375	N371-N373 PolarHBondContact O-N 2.87Å; N371-N373 VanDerWaalsContact O-N 3.11Å; N371-N373 PolarHBondContact OD1-N 2.92Å; N371-N373 VanDerWaalsContact OD1-N 3.08Å; N373-K375 PolarHBondContact O-N 2.77Å
374	S	84.3	Confident	85.3	Confident	22 Å²	22	78.7 Å²	78.7	15%	0.154	37%	0.371	C	S	.	.			trans	-66.9	133.4	178.4	-177.8	0	0	0	0	111.3	N371 K372 M376 N377	N371-S374 VanDerWaalsContact O-CB 3.24Å; N371-S374 WeakPolarHBondContact O-CB 3.04Å; N371-S374 PolarHBondContact O-N 2.97Å; K372-S374 VanDerWaalsContact C-N 3.3Å; K372-S374 PolarHBondContact O-N 3.41Å; S374-M376 PolarHBondContact O-N 3.28Å; S374-M376 VanDerWaalsContact O-N 3.16Å; S374-M376 WeakPolarHBondContact OG-CB 3.32Å; S374-M376 PolarHBondContact OG-N 2.78Å; S374-N377 WeakPolarHBondContact O-CB 2.98Å; S374-N377 PolarHBondContact O-N 3.07Å; S374-N377 VanDerWaalsContact O-N 3.09Å
375	K	83.4	Confident	85.2	Confident	190 Å²	190	80 Å²	80	83%	0.826	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-58.3	-26.4	171.6	-65.7	-175.2	-179.7	-179	0	112.4	N373 N377 R378	N373-K375 PolarHBondContact O-N 2.77Å; K375-N377 PolarHBondContact O-N 3.41Å; K375-R378 PolarHBondContact O-N 3.29Å
376	M	81.8	Confident	85.5	Confident	95 Å²	95	80.5 Å²	80.5	47%	0.468	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-58.5	-29.1	176.6	-68.4	-173.6	-90.2	0	0	112.8	L368 V369 S374 R378 E379	L368-M376 WeakPolarHBondContact CD1-O 3.4Å; V369-M376 HydrophobicContact CG1-CB 4.32Å; V369-M376 HydrophobicContact CG1-CE 4.09Å; V369-M376 HydrophobicContact CG1-SD 4.22Å; V369-M376 HydrophobicContact CG2-CB 4.26Å; S374-M376 PolarHBondContact O-N 3.28Å; S374-M376 VanDerWaalsContact O-N 3.16Å; S374-M376 WeakPolarHBondContact OG-CB 3.32Å; S374-M376 PolarHBondContact OG-N 2.78Å; M376-R378 PolarHBondContact O-N 3.32Å; M376-R378 VanDerWaalsContact O-N 3.08Å; M376-E379 PolarHBondContact O-N 2.93Å
377	N	83.4	Confident	86.2	Confident	26 Å²	26	74 Å²	74	14%	0.139	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-67.3	-5.8	176	-72.3	-31.4	0	0	0	113.6	L368 V369 N371 K372 S374 K375 F383	L368-N377 WeakPolarHBondContact CB-OD1 3.34Å; L368-N377 PolarHBondContact N-OD1 3.44Å; V369-N377 WeakPolarHBondContact CG2-OD1 3.34Å; V369-N377 PolarHBondContact N-OD1 3.24Å; V369-N377 PolarHBondContact O-ND2 2.86Å; V369-N377 PolarHBondContact O-OD1 2.79Å; N371-N377 PolarHBondContact O-ND2 3.22Å; K372-N377 PolarHBondContact O-ND2 3Å; S374-N377 WeakPolarHBondContact O-CB 2.98Å; S374-N377 PolarHBondContact O-N 3.07Å; S374-N377 VanDerWaalsContact O-N 3.09Å; K375-N377 PolarHBondContact O-N 3.41Å; N377-F383 WeakPolarHBondContact O-CE2 3.22Å; N377-F383 WeakPolarHBondContact O-CZ 3.38Å
378	R	85.1	Confident	87	Confident	168 Å²	168	73.3 Å²	73.3	63%	0.634	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-126.8	17.3	179.1	-62.6	-176.9	173.4	-178	-6.7	112.5	K375 M376 P380 D396 M400	K375-R378 PolarHBondContact O-N 3.29Å; M376-R378 PolarHBondContact O-N 3.32Å; M376-R378 VanDerWaalsContact O-N 3.08Å; R378-P380 WeakPolarHBondContact O-CD 3.31Å; R378-D396 IonicContact NH2-OD2 2.61Å; R378-M400 WeakPolarHBondContact O-CE 3.48Å
379	E	89.5	Confident	87.7	Confident	83 Å²	83	72.2 Å²	72.2	39%	0.388	34%	0.341	S	S	.	.			trans	-91.2	109.9	-176.8	175.4	56.2	-118.6	0	0	110.5	M376 C381 F382 F383	M376-E379 PolarHBondContact O-N 2.93Å; E379-C381 PolarHBondContact O-N 3.22Å; E379-C381 VanDerWaalsContact O-N 3.13Å; E379-F382 HydrophobicContact CB-CD2 3.78Å; E379-F382 HydrophobicContact CB-CE2 4.26Å; E379-F382 HydrophobicContact CG-CD2 3.63Å; E379-F382 HydrophobicContact CG-CE2 3.87Å; E379-F382 PolarHBondContact O-N 3.44Å; E379-F382 VanDerWaalsContact O-N 3.13Å; E379-F383 WeakPolarHBondContact O-CD2 3.45Å
380	P	92.3	Very high	88.2	Confident	16 Å²	16	72.6 Å²	72.6	10%	0.104	34%	0.34	C	S	.	.	H	α-helix	trans	-58.2	-31.3	-169.2	-26.4	35.6	0	0	0	114.8	R378 F382 F383 K384 M400 L403 V404 L408	R378-P380 WeakPolarHBondContact O-CD 3.31Å; P380-F382 VanDerWaalsContact C-N 3.26Å; P380-F382 PolarHBondContact O-N 3Å; P380-F383 WeakPolarHBondContact O-CB 3.34Å; P380-F383 PolarHBondContact O-N 3.47Å; P380-F383 VanDerWaalsContact O-N 3.11Å; P380-K384 PolarHBondContact O-N 2.86Å; P380-M400 HydrophobicContact CB-SD 3.84Å; P380-M400 HydrophobicContact CG-CE 4.26Å; P380-M400 HydrophobicContact CG-SD 3.88Å; P380-L403 HydrophobicContact CB-CB 4.07Å; P380-L403 HydrophobicContact CG-CB 3.94Å; P380-L403 HydrophobicContact CG-CD1 3.84Å; P380-L403 HydrophobicContact CG-CG 4.47Å; P380-V404 HydrophobicContact CB-CG2 4.19Å; P380-L408 HydrophobicContact CB-CD1 4.3Å; P380-L408 HydrophobicContact CB-CD2 3.69Å
381	C	90.5	Very high	88.8	Confident	25 Å²	25	69.6 Å²	69.6	17%	0.169	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-28.5	-179.6	-76.9	0	0	0	0	114.1	E379 N385 C410	E379-C381 PolarHBondContact O-N 3.22Å; E379-C381 VanDerWaalsContact O-N 3.13Å; C381-N385 PolarHBondContact O-ND2 3.4Å; C381-C410 WeakPolarHBondContact CA-SG 3.32Å; C381-C410 HydrophobicContact CB-CB 3.76Å; C381-C410 WeakPolarHBondContact CB-SG 3.25Å; C381-C410 WeakPolarHBondContact SG-CA 3.35Å; C381-C410 WeakPolarHBondContact SG-CB 3.38Å; C381-C410 CovalentContact SG-SG 2.04Å; C381-C410 PolarHBondContact SG-SG 2.72Å
382	F	90.4	Very high	89.3	Confident	49 Å²	49	65.4 Å²	65.4	22%	0.215	31%	0.305	C	S	.	.	H	α-helix	trans	-73.5	-41.3	172.7	-70.7	-68.7	0	0	0	111.2	L368 E379 P380 K384 N385 M386 L416	L368-F382 HydrophobicContact CD1-CB 3.55Å; L368-F382 HydrophobicContact CD1-CD2 4.48Å; L368-F382 HydrophobicContact CD1-CG 4.28Å; L368-F382 HydrophobicContact CD2-CB 4.16Å; L368-F382 HydrophobicContact CG-CB 4.48Å; E379-F382 HydrophobicContact CB-CD2 3.78Å; E379-F382 HydrophobicContact CB-CE2 4.26Å; E379-F382 HydrophobicContact CG-CD2 3.63Å; E379-F382 HydrophobicContact CG-CE2 3.87Å; E379-F382 PolarHBondContact O-N 3.44Å; E379-F382 VanDerWaalsContact O-N 3.13Å; P380-F382 VanDerWaalsContact C-N 3.26Å; P380-F382 PolarHBondContact O-N 3Å; F382-K384 PolarHBondContact O-N 2.96Å; F382-N385 PolarHBondContact O-N 3.46Å; F382-M386 VanDerWaalsContact O-CG 3.26Å; F382-M386 WeakPolarHBondContact O-CG 3.43Å; F382-M386 PolarHBondContact O-N 2.88Å; F382-L416 HydrophobicContact CD1-CD1 3.84Å; F382-L416 HydrophobicContact CE1-CD1 3.52Å; F382-L416 HydrophobicContact CE1-CG 4.43Å
383	F	92.5	Very high	90	Very high	1 Å²	1	61 Å²	61	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-58	-35.7	179	-76.7	-107.2	0	0	0	112.2	F260 L368 N377 E379 P380 N385 M386 V389 L392 M400 V404	F260-F383 HydrophobicContact CB-CD1 3.91Å; F260-F383 HydrophobicContact CB-CE1 3.88Å; F260-F383 AromaticContact CD1-CD1 3.69Å; F260-F383 HydrophobicContact CD1-CD1 3.69Å; F260-F383 HydrophobicContact CD1-CE1 4.48Å; F260-F383 HydrophobicContact CD2-CD1 4.08Å; F260-F383 HydrophobicContact CE1-CB 4.25Å; F260-F383 HydrophobicContact CE1-CD1 4.19Å; F260-F383 AromaticContact CG-CD1 3.62Å; F260-F383 HydrophobicContact CG-CD1 3.62Å; F260-F383 HydrophobicContact CG-CE1 4.1Å; F260-F383 HydrophobicContact CZ-CB 4.48Å; L368-F383 HydrophobicContact CD1-CD2 3.94Å; L368-F383 HydrophobicContact CD1-CE2 3.63Å; L368-F383 HydrophobicContact CD1-CZ 4.45Å; N377-F383 WeakPolarHBondContact O-CE2 3.22Å; N377-F383 WeakPolarHBondContact O-CZ 3.38Å; E379-F383 WeakPolarHBondContact O-CD2 3.45Å; P380-F383 WeakPolarHBondContact O-CB 3.34Å; P380-F383 PolarHBondContact O-N 3.47Å; P380-F383 VanDerWaalsContact O-N 3.11Å; F383-N385 PolarHBondContact O-N 3.21Å; F383-N385 VanDerWaalsContact O-N 3.16Å; F383-M386 PolarHBondContact O-N 3.35Å; F383-V389 HydrophobicContact CD1-CB 3.99Å; F383-V389 HydrophobicContact CD1-CG1 4.39Å; F383-V389 HydrophobicContact CD1-CG2 3.87Å; F383-V389 HydrophobicContact CE1-CB 3.56Å; F383-V389 HydrophobicContact CE1-CG1 3.62Å; F383-V389 HydrophobicContact CE1-CG2 3.93Å; F383-V389 HydrophobicContact CE2-CG1 4.41Å; F383-V389 HydrophobicContact CG-CG2 4.38Å; F383-V389 HydrophobicContact CZ-CB 4.13Å; F383-V389 HydrophobicContact CZ-CG1 3.64Å; F383-V389 HydrophobicContact CZ-CG2 4.49Å; F383-L392 HydrophobicContact CE1-CD1 3.75Å; F383-L392 HydrophobicContact CE1-CD2 4.49Å; F383-L392 HydrophobicContact CE1-CG 4.23Å; F383-L392 HydrophobicContact CZ-CD1 4.3Å; F383-L392 HydrophobicContact CZ-CD2 4.29Å; F383-M400 HydrophobicContact CB-SD 4.31Å; F383-M400 HydrophobicContact CD1-CG 3.76Å; F383-M400 HydrophobicContact CD1-SD 4.28Å; F383-M400 HydrophobicContact CD2-CE 3.98Å; F383-M400 HydrophobicContact CD2-CG 4.43Å; F383-M400 HydrophobicContact CD2-SD 3.91Å; F383-M400 HydrophobicContact CE1-CG 4.01Å; F383-M400 HydrophobicContact CE2-CE 3.78Å; F383-M400 HydrophobicContact CE2-SD 4.28Å; F383-M400 HydrophobicContact CG-CE 4.47Å; F383-M400 HydrophobicContact CG-CG 4Å; F383-M400 HydrophobicContact CG-SD 3.91Å; F383-M400 HydrophobicContact CZ-CE 4.09Å; F383-M400 HydrophobicContact CZ-CG 4.44Å; F383-V404 HydrophobicContact CB-CG2 3.67Å
384	K	91.2	Very high	90.7	Very high	94 Å²	94	55 Å²	55	41%	0.409	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.1	176.6	-166.1	166	-175	164.2	0	113.6	N265 P380 F382 V404	N265-K384 PolarHBondContact ND2-O 3.41Å; P380-K384 PolarHBondContact O-N 2.86Å; F382-K384 PolarHBondContact O-N 2.96Å; K384-V404 HydrophobicContact CB-CG1 4.22Å; K384-V404 HydrophobicContact CG-CG1 4.5Å
385	N	90.6	Very high	91.2	Very high	77 Å²	77	58 Å²	58	41%	0.412	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	8	-179.4	-59.2	-64.3	0	0	0	113.4	C381 F382 F383	C381-N385 PolarHBondContact O-ND2 3.4Å; F382-N385 PolarHBondContact O-N 3.46Å; F383-N385 PolarHBondContact O-N 3.21Å; F383-N385 VanDerWaalsContact O-N 3.16Å
386	M	94.4	Very high	91.8	Very high	19 Å²	19	51.2 Å²	51.2	9%	0.094	25%	0.252	C	S	.	.			trans	-109	152.6	-179.2	-61.7	-65.2	147.4	0	0	110.6	S262 N265 K364 L368 F382 F383 V389	S262-M386 WeakPolarHBondContact CB-O 3.38Å; N265-M386 PolarHBondContact ND2-O 3.2Å; K364-M386 HydrophobicContact CD-SD 4.39Å; K364-M386 HydrophobicContact CG-CG 4.46Å; K364-M386 HydrophobicContact CG-SD 3.67Å; L368-M386 HydrophobicContact CD2-CE 4.37Å; L368-M386 HydrophobicContact CD2-CG 3.82Å; L368-M386 HydrophobicContact CD2-SD 4.26Å; F382-M386 VanDerWaalsContact O-CG 3.26Å; F382-M386 WeakPolarHBondContact O-CG 3.43Å; F382-M386 PolarHBondContact O-N 2.88Å; F383-M386 PolarHBondContact O-N 3.35Å; M386-V389 HydrophobicContact CB-CG2 3.58Å; M386-V389 HydrophobicContact CG-CG2 3.88Å
387	I	96.8	Very high	92.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-90.1	-49.8	171.6	-67.7	172.8	0	0	0	109.3	V261 S262 N265 I266 F269 A362 F363	V261-I387 CarbonylContact C-O 3.6Å; V261-I387 VanDerWaalsContact CA-O 3.27Å; V261-I387 WeakPolarHBondContact CA-O 3.42Å; S262-I387 PolarHBondContact N-O 3.28Å; N265-I387 HydrophobicContact CB-CG1 3.8Å; I266-I387 HydrophobicContact CD1-CG2 4.17Å; I266-I387 HydrophobicContact CG1-CG2 3.51Å; F269-I387 HydrophobicContact CB-CD1 4.09Å; F269-I387 HydrophobicContact CG-CD1 4.28Å; A362-I387 HydrophobicContact CB-CB 4.15Å; A362-I387 HydrophobicContact CB-CD1 4.08Å; A362-I387 HydrophobicContact CB-CG1 3.85Å; A362-I387 PolarHBondContact O-N 3.46Å; F363-I387 HydrophobicContact CD2-CB 4.46Å; F363-I387 HydrophobicContact CE1-CG2 3.9Å; F363-I387 HydrophobicContact CE2-CB 4.16Å; F363-I387 HydrophobicContact CE2-CD1 3.78Å; F363-I387 HydrophobicContact CE2-CG2 4.1Å; F363-I387 HydrophobicContact CZ-CB 4.21Å; F363-I387 HydrophobicContact CZ-CD1 4.23Å; F363-I387 HydrophobicContact CZ-CG2 3.65Å
388	V	96.9	Very high	93.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.5	177.6	177.9	0	0	0	0	110.2	F253 V259 F260 A362 F363 K364	F253-V388 HydrophobicContact CE2-CG2 3.56Å; F253-V388 HydrophobicContact CZ-CG2 3.81Å; V259-V388 HydrophobicContact CB-CG1 4.03Å; V259-V388 HydrophobicContact CG1-CG1 4.06Å; V259-V388 HydrophobicContact CG2-CG1 4.34Å; F260-V388 WeakPolarHBondContact O-CA 3.38Å; A362-V388 PolarHBondContact O-N 3Å; A362-V388 VanDerWaalsContact O-N 3.11Å; F363-V388 HydrophobicContact CD1-CB 3.89Å; F363-V388 HydrophobicContact CD1-CG2 3.54Å; F363-V388 HydrophobicContact CE1-CG2 3.71Å; K364-V388 PolarHBondContact N-O 2.86Å
389	V	95.4	Very high	93.6	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121	168	-173.1	0	0	0	0	110.6	V259 F260 L368 F383 M386	V259-V389 WeakPolarHBondContact CA-O 3.22Å; F260-V389 HydrophobicContact CB-CB 4.43Å; F260-V389 PolarHBondContact N-O 3.3Å; F260-V389 PolarHBondContact O-N 3.39Å; L368-V389 HydrophobicContact CD2-CG1 4.2Å; L368-V389 HydrophobicContact CD2-CG2 4Å; L368-V389 HydrophobicContact CG-CG1 4.02Å; F383-V389 HydrophobicContact CD1-CB 3.99Å; F383-V389 HydrophobicContact CD1-CG1 4.39Å; F383-V389 HydrophobicContact CD1-CG2 3.87Å; F383-V389 HydrophobicContact CE1-CB 3.56Å; F383-V389 HydrophobicContact CE1-CG1 3.62Å; F383-V389 HydrophobicContact CE1-CG2 3.93Å; F383-V389 HydrophobicContact CE2-CG1 4.41Å; F383-V389 HydrophobicContact CG-CG2 4.38Å; F383-V389 HydrophobicContact CZ-CB 4.13Å; F383-V389 HydrophobicContact CZ-CG1 3.64Å; F383-V389 HydrophobicContact CZ-CG2 4.49Å; M386-V389 HydrophobicContact CB-CG2 3.58Å; M386-V389 HydrophobicContact CG-CG2 3.88Å
390	H	92.7	Very high	93.9	Very high	48 Å²	48	44.7 Å²	44.7	22%	0.222	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.7	171.7	-171.6	-95.2	0	0	0	110.4	D258 V259 K364 T365 G367	D258-H390 IonicContact OD1-CD2 3.08Å; D258-H390 PolarHBondContact OD1-CD2 3.42Å; D258-H390 VanDerWaalsContact OD1-CD2 3.24Å; D258-H390 IonicContact OD1-NE2 3.18Å; D258-H390 PolarHBondContact OD1-NE2 2.98Å; D258-H390 VanDerWaalsContact OD1-NE2 3.08Å; D258-H390 IonicContact OD2-CE1 3.97Å; D258-H390 IonicContact OD2-NE2 3.99Å; D258-H390 PolarHBondContact OD2-NE2 3.25Å; V259-H390 HydrophobicContact CG1-CB 4.12Å; K364-H390 PolarHBondContact O-N 3.05Å; T365-H390 WeakPolarHBondContact O-CB 3.32Å; G367-H390 WeakPolarHBondContact CA-O 3.42Å; G367-H390 PolarHBondContact N-O 3.23Å; G367-H390 VanDerWaalsContact N-O 3.16Å
391	K	91.1	Very high	94.1	Very high	129 Å²	129	46.2 Å²	46.2	56%	0.561	22%	0.224	S	C	*	.			cis	-127.4	151.9	-5	57.9	-179.3	-173	174.9	0	111.2	D258	D258-K391 HydrophobicContact CB-CB 4.34Å; D258-K391 CarbonylContact O-C 3.58Å; D258-K391 WeakPolarHBondContact O-CA 3.41Å; D258-K391 VanDerWaalsContact O-CB 3.32Å; D258-K391 WeakPolarHBondContact O-CB 3.34Å
392	L	92.2	Very high	94.4	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	24%	0.24	C	C	.	.			trans	-127.4	129	167.9	-64	-177.1	0	0	0	109.8	D258 F260 F383 D396 L397 M400	D258-L392 PolarHBondContact O-N 2.84Å; F260-L392 HydrophobicContact CB-CD1 3.91Å; F260-L392 HydrophobicContact CD2-CD1 4.34Å; F383-L392 HydrophobicContact CE1-CD1 3.75Å; F383-L392 HydrophobicContact CE1-CD2 4.49Å; F383-L392 HydrophobicContact CE1-CG 4.23Å; F383-L392 HydrophobicContact CZ-CD1 4.3Å; F383-L392 HydrophobicContact CZ-CD2 4.29Å; L392-D396 HydrophobicContact CB-CB 4.38Å; L392-D396 HydrophobicContact CD2-CB 4.15Å; L392-L397 HydrophobicContact CB-CB 3.89Å; L392-L397 HydrophobicContact CB-CD1 4.32Å; L392-L397 HydrophobicContact CD1-CB 4.49Å; L392-L397 HydrophobicContact CD1-CD1 4.05Å; L392-M400 HydrophobicContact CD1-CB 3.59Å; L392-M400 HydrophobicContact CD1-CG 3.8Å
393	L	92.9	Very high	94.6	Very high	79 Å²	79	51.2 Å²	51.2	41%	0.414	25%	0.247	S	C	.	.			trans	-74.3	163.6	170.1	-64.6	-178.5	0	0	0	110.1	S395 D396 L397	L393-S395 PolarHBondContact O-N 3.13Å; L393-S395 VanDerWaalsContact O-N 3.15Å; L393-D396 CarbonylContact O-C 3.57Å; L393-D396 PolarHBondContact O-N 3.34Å; L393-L397 WeakPolarHBondContact O-CB 3.08Å; L393-L397 PolarHBondContact O-N 3.37Å
394	P	96.5	Very high	94.6	Very high	21 Å²	21	51.8 Å²	51.8	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-49.3	-47.6	-171.1	-33.6	38.7	0	0	0	115.4	D167 R168 V171 L397 M398	D167-P394 HydrophobicContact CB-CG 4.46Å; R168-P394 HydrophobicContact CG-CG 3.74Å; V171-P394 HydrophobicContact CB-CB 4.43Å; V171-P394 HydrophobicContact CG2-CB 3.82Å; P394-L397 PolarHBondContact O-N 3.05Å; P394-M398 WeakPolarHBondContact O-CB 3.32Å; P394-M398 PolarHBondContact O-N 3.29Å
395	S	96.4	Very high	94.6	Very high	87 Å²	87	51.5 Å²	51.5	61%	0.608	25%	0.254	S	S	*	.	H	α-helix	trans	-67.5	-40.7	179.6	54.9	0	0	0	0	113	L393 R399	L393-S395 PolarHBondContact O-N 3.13Å; L393-S395 VanDerWaalsContact O-N 3.15Å; S395-R399 WeakPolarHBondContact O-CB 3.31Å; S395-R399 PolarHBondContact O-N 2.98Å; S395-R399 VanDerWaalsContact O-N 3.11Å
396	D	94.8	Very high	94.6	Very high	47 Å²	47	50.7 Å²	50.7	25%	0.251	25%	0.254	S	S	.	.	H	α-helix	trans	-68.9	-38.1	176.8	-71.6	-29	0	0	0	111	R378 L392 L393 R399 M400	R378-D396 IonicContact NH2-OD2 2.61Å; L392-D396 HydrophobicContact CB-CB 4.38Å; L392-D396 HydrophobicContact CD2-CB 4.15Å; L393-D396 CarbonylContact O-C 3.57Å; L393-D396 PolarHBondContact O-N 3.34Å; D396-R399 PolarHBondContact O-N 2.91Å; D396-M400 VanDerWaalsContact O-CB 3.25Å; D396-M400 WeakPolarHBondContact O-CB 3.35Å; D396-M400 PolarHBondContact O-N 3.36Å
397	L	96.8	Very high	94.2	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-49.9	177.1	178.1	61.4	0	0	0	110.7	V171 I172 F260 L392 L393 P394 R399 M400 W401	V171-L397 HydrophobicContact CG1-CB 4.1Å; V171-L397 HydrophobicContact CG1-CD2 3.67Å; V171-L397 HydrophobicContact CG1-CG 3.85Å; I172-L397 HydrophobicContact CG1-CD2 4.23Å; F260-L397 HydrophobicContact CB-CD1 4.12Å; F260-L397 HydrophobicContact CD2-CD1 4.02Å; L392-L397 HydrophobicContact CB-CB 3.89Å; L392-L397 HydrophobicContact CB-CD1 4.32Å; L392-L397 HydrophobicContact CD1-CB 4.49Å; L392-L397 HydrophobicContact CD1-CD1 4.05Å; L393-L397 WeakPolarHBondContact O-CB 3.08Å; L393-L397 PolarHBondContact O-N 3.37Å; P394-L397 PolarHBondContact O-N 3.05Å; L397-R399 VanDerWaalsContact C-N 3.33Å; L397-R399 PolarHBondContact O-N 2.94Å; L397-M400 PolarHBondContact O-N 2.71Å; L397-W401 VanDerWaalsContact O-CB 3.31Å; L397-W401 WeakPolarHBondContact O-CB 3.33Å; L397-W401 PolarHBondContact O-N 1.99Å
398	M	96.8	Very high	93.7	Very high	54 Å²	54	61.1 Å²	61.1	27%	0.266	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-44.8	177.6	-163.7	72	178.8	0	0	111.3	V171 K174 T175 P394 W401 H402	V171-M398 HydrophobicContact CG1-CB 4.16Å; V171-M398 HydrophobicContact CG1-SD 4.17Å; K174-M398 HydrophobicContact CB-CE 4.26Å; K174-M398 HydrophobicContact CB-SD 4.42Å; T175-M398 HydrophobicContact CG2-SD 3.47Å; T175-M398 WeakPolarHBondContact CG2-SD 3.41Å; P394-M398 WeakPolarHBondContact O-CB 3.32Å; P394-M398 PolarHBondContact O-N 3.29Å; M398-W401 PolarHBondContact O-N 3.32Å; M398-H402 WeakPolarHBondContact CE-NE2 3.44Å; M398-H402 PolarHBondContact O-CD2 3.07Å; M398-H402 PolarHBondContact O-N 3.05Å; M398-H402 VanDerWaalsContact O-N 3.16Å
399	R	95.7	Very high	93.1	Very high	169 Å²	169	68.8 Å²	68.8	64%	0.638	35%	0.345	S	S	*	.	H	α-helix	trans	-62.2	-49.3	177.1	-175.8	-173.7	-60.3	-155.4	-0.4	111.7	S395 D396 L397 W401 H402 L403	S395-R399 WeakPolarHBondContact O-CB 3.31Å; S395-R399 PolarHBondContact O-N 2.98Å; S395-R399 VanDerWaalsContact O-N 3.11Å; D396-R399 PolarHBondContact O-N 2.91Å; L397-R399 VanDerWaalsContact C-N 3.33Å; L397-R399 PolarHBondContact O-N 2.94Å; R399-W401 VanDerWaalsContact C-N 3.31Å; R399-W401 PolarHBondContact O-N 3.48Å; R399-H402 PolarHBondContact O-N 3.21Å; R399-L403 HydrophobicContact CG-CD1 4.09Å; R399-L403 WeakPolarHBondContact O-CG 3.17Å; R399-L403 PolarHBondContact O-N 3.19Å
400	M	95.7	Very high	92.5	Very high	10 Å²	10	71 Å²	71	5%	0.049	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-41.6	-179.4	-174.6	57.7	69.6	0	0	111.1	F260 R378 P380 F383 L392 D396 L397 H402 L403 V404	F260-M400 HydrophobicContact CD2-CG 4.11Å; F260-M400 HydrophobicContact CE2-CG 4.22Å; R378-M400 WeakPolarHBondContact O-CE 3.48Å; P380-M400 HydrophobicContact CB-SD 3.84Å; P380-M400 HydrophobicContact CG-CE 4.26Å; P380-M400 HydrophobicContact CG-SD 3.88Å; F383-M400 HydrophobicContact CB-SD 4.31Å; F383-M400 HydrophobicContact CD1-CG 3.76Å; F383-M400 HydrophobicContact CD1-SD 4.28Å; F383-M400 HydrophobicContact CD2-CE 3.98Å; F383-M400 HydrophobicContact CD2-CG 4.43Å; F383-M400 HydrophobicContact CD2-SD 3.91Å; F383-M400 HydrophobicContact CE1-CG 4.01Å; F383-M400 HydrophobicContact CE2-CE 3.78Å; F383-M400 HydrophobicContact CE2-SD 4.28Å; F383-M400 HydrophobicContact CG-CE 4.47Å; F383-M400 HydrophobicContact CG-CG 4Å; F383-M400 HydrophobicContact CG-SD 3.91Å; F383-M400 HydrophobicContact CZ-CE 4.09Å; F383-M400 HydrophobicContact CZ-CG 4.44Å; L392-M400 HydrophobicContact CD1-CB 3.59Å; L392-M400 HydrophobicContact CD1-CG 3.8Å; D396-M400 VanDerWaalsContact O-CB 3.25Å; D396-M400 WeakPolarHBondContact O-CB 3.35Å; D396-M400 PolarHBondContact O-N 3.36Å; L397-M400 PolarHBondContact O-N 2.71Å; M400-H402 VanDerWaalsContact C-N 3.34Å; M400-H402 PolarHBondContact O-N 2.95Å; M400-L403 PolarHBondContact O-N 3.32Å; M400-L403 VanDerWaalsContact O-N 3.16Å; M400-V404 HydrophobicContact CG-CG2 4.14Å; M400-V404 WeakPolarHBondContact O-CG2 3.48Å; M400-V404 PolarHBondContact O-N 3.35Å; M400-V404 HydrophobicContact SD-CG2 3.83Å
401	W	96.6	Very high	91.6	Very high	48 Å²	48	74.4 Å²	74.4	18%	0.182	39%	0.389	C	S	.	.	H	α-helix	trans	-56.1	-47.2	175.6	-176.2	-103	0	0	0	111.9	T175 W176 F260 L397 M398 R399 L403 N405	T175-W401 HydrophobicContact CG2-CB 3.77Å; T175-W401 HydrophobicContact CG2-CD2 4.2Å; T175-W401 HydrophobicContact CG2-CG 3.55Å; W176-W401 HydrophobicContact CB-CE3 4.09Å; W176-W401 HydrophobicContact CB-CH2 3.88Å; W176-W401 HydrophobicContact CB-CZ3 3.53Å; F260-W401 HydrophobicContact CD2-CE3 4.48Å; F260-W401 AromaticContact CE2-CE3 3.71Å; F260-W401 HydrophobicContact CE2-CE3 3.71Å; F260-W401 HydrophobicContact CE2-CZ3 4.32Å; F260-W401 HydrophobicContact CZ-CE3 4.14Å; F260-W401 HydrophobicContact CZ-CZ3 4.33Å; L397-W401 VanDerWaalsContact O-CB 3.31Å; L397-W401 WeakPolarHBondContact O-CB 3.33Å; L397-W401 PolarHBondContact O-N 1.99Å; M398-W401 PolarHBondContact O-N 3.32Å; R399-W401 VanDerWaalsContact C-N 3.31Å; R399-W401 PolarHBondContact O-N 3.48Å; W401-L403 PolarHBondContact O-N 3.3Å; W401-N405 VanDerWaalsContact CD2-ND2 3.26Å; W401-N405 WeakPolarHBondContact O-CB 3.03Å; W401-N405 PolarHBondContact O-N 3.14Å; W401-N405 VanDerWaalsContact O-N 3.12Å; W401-N405 PolarHBondContact O-ND2 3.49Å
402	H	95.6	Very high	90	Very high	109 Å²	109	78.4 Å²	78.4	51%	0.505	41%	0.406	S	S	.	.	H	α-helix	trans	-65.2	-37.1	176.4	-69.9	-52.2	0	0	0	113.5	M398 R399 M400 S406	M398-H402 WeakPolarHBondContact CE-NE2 3.44Å; M398-H402 PolarHBondContact O-CD2 3.07Å; M398-H402 PolarHBondContact O-N 3.05Å; M398-H402 VanDerWaalsContact O-N 3.16Å; R399-H402 PolarHBondContact O-N 3.21Å; M400-H402 VanDerWaalsContact C-N 3.34Å; M400-H402 PolarHBondContact O-N 2.95Å; H402-S406 VanDerWaalsContact O-CB 3.28Å; H402-S406 WeakPolarHBondContact O-CB 2.93Å; H402-S406 PolarHBondContact O-N 3.36Å; H402-S406 VanDerWaalsContact O-N 3.13Å; H402-S406 PolarHBondContact O-OG 3.15Å
403	L	94.7	Very high	88	Confident	70 Å²	70	85.2 Å²	85.2	37%	0.366	44%	0.435	S	S	.	.	H	α-helix	trans	-70	-39.5	178.9	-70.6	171.3	0	0	0	112.7	P380 R399 M400 W401 S406	P380-L403 HydrophobicContact CB-CB 4.07Å; P380-L403 HydrophobicContact CG-CB 3.94Å; P380-L403 HydrophobicContact CG-CD1 3.84Å; P380-L403 HydrophobicContact CG-CG 4.47Å; R399-L403 HydrophobicContact CG-CD1 4.09Å; R399-L403 WeakPolarHBondContact O-CG 3.17Å; R399-L403 PolarHBondContact O-N 3.19Å; M400-L403 PolarHBondContact O-N 3.32Å; M400-L403 VanDerWaalsContact O-N 3.16Å; W401-L403 PolarHBondContact O-N 3.3Å; L403-S406 PolarHBondContact O-OG 3.3Å; L403-S406 VanDerWaalsContact O-OG 3.05Å
404	V	93.8	Very high	85.6	Confident	12 Å²	12	86.7 Å²	86.7	7%	0.073	45%	0.447	C	S	.	.	H	α-helix	trans	-73.4	-33.7	-179.4	174.1	0	0	0	0	111.5	F260 P380 F383 K384 M400	F260-V404 HydrophobicContact CE2-CG2 4.39Å; F260-V404 HydrophobicContact CZ-CB 4.25Å; F260-V404 HydrophobicContact CZ-CG1 4.08Å; F260-V404 HydrophobicContact CZ-CG2 4.2Å; P380-V404 HydrophobicContact CB-CG2 4.19Å; F383-V404 HydrophobicContact CB-CG2 3.67Å; K384-V404 HydrophobicContact CB-CG1 4.22Å; K384-V404 HydrophobicContact CG-CG1 4.5Å; M400-V404 HydrophobicContact CG-CG2 4.14Å; M400-V404 WeakPolarHBondContact O-CG2 3.48Å; M400-V404 PolarHBondContact O-N 3.35Å; M400-V404 HydrophobicContact SD-CG2 3.83Å
405	N	91.5	Very high	82.9	Confident	89 Å²	89	92.8 Å²	92.8	48%	0.476	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	6.6	-178.9	-66.6	-81.9	0	0	0	113.9	W401	W401-N405 VanDerWaalsContact CD2-ND2 3.26Å; W401-N405 WeakPolarHBondContact O-CB 3.03Å; W401-N405 PolarHBondContact O-N 3.14Å; W401-N405 VanDerWaalsContact O-N 3.12Å; W401-N405 PolarHBondContact O-ND2 3.49Å
406	S	90.5	Very high	80	Confident	59 Å²	59	93.9 Å²	93.9	41%	0.413	47%	0.472	S	S	.	.	S	Bend	trans	-92	-179.7	169.5	68.5	0	0	0	0	111.2	H402 L403 L408	H402-S406 VanDerWaalsContact O-CB 3.28Å; H402-S406 WeakPolarHBondContact O-CB 2.93Å; H402-S406 PolarHBondContact O-N 3.36Å; H402-S406 VanDerWaalsContact O-N 3.13Å; H402-S406 PolarHBondContact O-OG 3.15Å; L403-S406 PolarHBondContact O-OG 3.3Å; L403-S406 VanDerWaalsContact O-OG 3.05Å; S406-L408 PolarHBondContact O-N 3.03Å
407	E	85	Confident	77.3	Confident	200 Å²	200	101.5 Å²	101.5	94%	0.935	51%	0.512	S	S	*	.			trans	-68.2	76.1	170.5	-66.6	-172.2	176.3	0	0	110.9
408	L	85.9	Confident	76.3	Confident	38 Å²	38	106.5 Å²	106.5	20%	0.199	54%	0.537	C	S	.	.			trans	-89.2	110.7	179.8	-171.4	72.2	0	0	0	110.2	P380 S406 C410	P380-L408 HydrophobicContact CB-CD1 4.3Å; P380-L408 HydrophobicContact CB-CD2 3.69Å; S406-L408 PolarHBondContact O-N 3.03Å; L408-C410 VanDerWaalsContact CD2-SG 3.56Å; L408-C410 PolarHBondContact O-N 3.21Å
409	N	84.1	Confident	75.2	Confident	162 Å²	162	109.3 Å²	109.3	87%	0.866	55%	0.551	S	S	*	*			trans	-83.1	97.9	171.9	-80.8	-35	0	0	0	110.6
410	C	83.3	Confident	74.1	Confident	48 Å²	48	105.9 Å²	105.9	32%	0.324	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-88.5	125.8	171.5	-60.1	0	0	0	0	110.2	C381 L408 K412	C381-C410 WeakPolarHBondContact CA-SG 3.32Å; C381-C410 HydrophobicContact CB-CB 3.76Å; C381-C410 WeakPolarHBondContact CB-SG 3.25Å; C381-C410 WeakPolarHBondContact SG-CA 3.35Å; C381-C410 WeakPolarHBondContact SG-CB 3.38Å; C381-C410 CovalentContact SG-SG 2.04Å; C381-C410 PolarHBondContact SG-SG 2.72Å; L408-C410 VanDerWaalsContact CD2-SG 3.56Å; L408-C410 PolarHBondContact O-N 3.21Å; C410-K412 PolarHBondContact O-N 2.97Å
411	S	73.7	Confident	72.8	Confident	120 Å²	120	111.6 Å²	111.6	84%	0.839	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-58.3	137.6	168.8	44.7	0	0	0	0	109.7	K413	S411-K413 PolarHBondContact O-N 3.45Å
412	K	58.5	Low	71.3	Confident	213 Å²	213	115.6 Å²	115.6	93%	0.926	60%	0.601	S	S	*	*	S	Bend	trans	-57.3	127.5	-171.6	-87.8	-179.2	174.7	176.8	0	112.4	C410	C410-K412 PolarHBondContact O-N 2.97Å
413	K	48.8	Very low	69.7	Low	153 Å²	153	116 Å²	116	67%	0.665	61%	0.607	S	S	*	*			trans	31.5	108.6	159.6	-84.1	-174	171.9	-172.9	0	118	S411	S411-K413 PolarHBondContact O-N 3.45Å
414	V	42.3	Very low	67.9	Low	110 Å²	110	119.3 Å²	119.3	67%	0.667	62%	0.624	S	S	*	*			trans	-91.1	117.1	143.3	-179.8	0	0	0	0	106.8	L416	V414-L416 HydrophobicContact CG1-CD2 4.3Å; V414-L416 HydrophobicContact CG1-CG 4.31Å; V414-L416 PolarHBondContact O-N 2.88Å
415	E	39.8	Very low	65.9	Low	149 Å²	149	127.5 Å²	127.5	70%	0.696	67%	0.667	S	S	*	*			trans	-65.5	98.1	164.4	-78.7	-178.4	163.3	0	0	108.1	L417	E415-L417 PolarHBondContact O-N 3.35Å; E415-L417 VanDerWaalsContact O-N 3.07Å
416	L	36.5	Very low	63.8	Low	110 Å²	110	130.8 Å²	130.8	58%	0.576	68%	0.682	S	S	*	*			trans	-79.8	83.6	165.7	-72.6	171.1	0	0	0	107.5	F382 V414	F382-L416 HydrophobicContact CD1-CD1 3.84Å; F382-L416 HydrophobicContact CE1-CD1 3.52Å; F382-L416 HydrophobicContact CE1-CG 4.43Å; V414-L416 HydrophobicContact CG1-CD2 4.3Å; V414-L416 HydrophobicContact CG1-CG 4.31Å; V414-L416 PolarHBondContact O-N 2.88Å
417	L	37.3	Very low	61.4	Low	207 Å²	207	137.3 Å²	137.3	100%	1.084	71%	0.707	S	S	*	*			trans	-51.6	0	169	-71.8	164.1	0	0	0	112.1	E415	E415-L417 PolarHBondContact O-N 3.35Å; E415-L417 VanDerWaalsContact O-N 3.07Å

Retrieved 417 of 417 residues in 2870.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).