A0A087XZ21_POEFO Loading...

BOS complex subunit NCLN

AlphaFold DB , UniProt , Accession A0A087XZ21, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 577 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	40.2	Very low	43.2	Very low	195 Å²	195	124.2 Å²	124.2	96%	0.961	63%	0.629	S	S	*	*				0	-54.3	0	-100.9	-160	-90.6	0	0	115.3	E4 A5	M1-E4 WeakPolarHBondContact CA-OE2 3.41Å; M1-E4 PolarHBondContact N-OE2 3.05Å; M1-A5 PolarHBondContact O-N 3.14Å
2	F	34.9	Very low	43.3	Very low	200 Å²	200	121.1 Å²	121.1	88%	0.877	61%	0.612	S	S	*	*	H	α-helix	trans	-79.5	-29.8	176.1	-103.1	-84.6	0	0	0	114.1	S6	F2-S6 PolarHBondContact O-N 3.28Å
3	E	37.3	Very low	43.7	Very low	164 Å²	164	119.9 Å²	119.9	77%	0.766	60%	0.601	S	S	*	*	H	α-helix	trans	-77.9	-37	175.7	-79.8	174.5	145.8	0	0	113.1	A5 S6 E7	E3-A5 VanDerWaalsContact C-N 3.29Å; E3-A5 PolarHBondContact O-N 3.4Å; E3-S6 PolarHBondContact O-N 3.23Å; E3-S6 VanDerWaalsContact O-N 3.17Å; E3-S6 PolarHBondContact O-OG 2.78Å; E3-E7 PolarHBondContact O-N 3.35Å
4	E	40.8	Very low	44.2	Very low	128 Å²	128	122.6 Å²	122.6	60%	0.598	61%	0.607	S	S	*	*	H	α-helix	trans	-67.4	-31.8	174.8	-69.1	158.4	141.4	0	0	111.9	M1 V8	M1-E4 WeakPolarHBondContact CA-OE2 3.41Å; M1-E4 PolarHBondContact N-OE2 3.05Å; E4-V8 VanDerWaalsContact O-CG2 3.24Å; E4-V8 WeakPolarHBondContact O-CG2 3.46Å; E4-V8 PolarHBondContact O-N 3.44Å; E4-V8 VanDerWaalsContact O-N 3.16Å
5	A	42.2	Very low	44.4	Very low	45 Å²	45	121 Å²	121	37%	0.372	61%	0.612	S	S	.	*	H	α-helix	trans	-68.2	-36.2	172.9	0	0	0	0	0	111.5	M1 E3 F9	M1-A5 PolarHBondContact O-N 3.14Å; E3-A5 VanDerWaalsContact C-N 3.29Å; E3-A5 PolarHBondContact O-N 3.4Å; A5-F9 WeakPolarHBondContact O-CB 3.45Å; A5-F9 VanDerWaalsContact O-CD2 3.3Å; A5-F9 WeakPolarHBondContact O-CD2 3.49Å; A5-F9 PolarHBondContact O-N 3.23Å; A5-F9 VanDerWaalsContact O-N 3.08Å
6	S	42.1	Very low	45	Very low	69 Å²	69	116.2 Å²	116.2	48%	0.483	59%	0.593	S	S	.	*	H	α-helix	trans	-71.1	-39.4	178.1	83.1	0	0	0	0	111.9	F2 E3 V8 F9 D10	F2-S6 PolarHBondContact O-N 3.28Å; E3-S6 PolarHBondContact O-N 3.23Å; E3-S6 VanDerWaalsContact O-N 3.17Å; E3-S6 PolarHBondContact O-OG 2.78Å; S6-V8 PolarHBondContact O-N 3.1Å; S6-F9 PolarHBondContact O-N 2.9Å; S6-D10 WeakPolarHBondContact O-CB 3.18Å; S6-D10 PolarHBondContact O-N 2.88Å
7	E	42.6	Very low	45.6	Very low	131 Å²	131	115.3 Å²	115.3	61%	0.612	58%	0.584	S	S	*	*	H	α-helix	trans	-66.7	-35.1	176.2	-80.5	-170.3	147.7	0	0	113.3	E3 N11	E3-E7 PolarHBondContact O-N 3.35Å; E7-N11 WeakPolarHBondContact O-CB 3.1Å; E7-N11 PolarHBondContact O-N 2.77Å; E7-N11 PolarHBondContact O-ND2 2.86Å
8	V	51.8	Low	46.3	Very low	88 Å²	88	112.7 Å²	112.7	53%	0.533	58%	0.577	S	S	.	*	H	α-helix	trans	-69	-40.1	173.7	172.9	0	0	0	0	110.9	E4 S6 M12	E4-V8 VanDerWaalsContact O-CG2 3.24Å; E4-V8 WeakPolarHBondContact O-CG2 3.46Å; E4-V8 PolarHBondContact O-N 3.44Å; E4-V8 VanDerWaalsContact O-N 3.16Å; S6-V8 PolarHBondContact O-N 3.1Å; V8-M12 HydrophobicContact CG1-SD 4.14Å; V8-M12 WeakPolarHBondContact O-CB 3.4Å; V8-M12 WeakPolarHBondContact O-CG 3.35Å; V8-M12 PolarHBondContact O-N 3.49Å
9	F	46.7	Very low	46.7	Very low	141 Å²	141	112.3 Å²	112.3	62%	0.618	58%	0.575	S	S	*	*	H	α-helix	trans	-63.6	-41.7	174.3	-99.9	-91.1	0	0	0	112.3	A5 S6 F13	A5-F9 WeakPolarHBondContact O-CB 3.45Å; A5-F9 VanDerWaalsContact O-CD2 3.3Å; A5-F9 WeakPolarHBondContact O-CD2 3.49Å; A5-F9 PolarHBondContact O-N 3.23Å; A5-F9 VanDerWaalsContact O-N 3.08Å; S6-F9 PolarHBondContact O-N 2.9Å; F9-F13 PolarHBondContact O-N 2.88Å; F9-F13 VanDerWaalsContact O-N 3.15Å
10	D	48.5	Very low	47.3	Very low	99 Å²	99	108.5 Å²	108.5	53%	0.529	56%	0.557	S	S	.	*	H	α-helix	trans	-72.5	-34.9	-178.7	-125.6	26.6	0	0	0	112.5	S6 K14	S6-D10 WeakPolarHBondContact O-CB 3.18Å; S6-D10 PolarHBondContact O-N 2.88Å; D10-K14 PolarHBondContact O-N 3.46Å
11	N	48.5	Very low	47.8	Very low	106 Å²	106	108.4 Å²	108.4	57%	0.567	55%	0.553	S	S	*	*	H	α-helix	trans	-76.3	-30.4	175.2	-79.2	-29.9	0	0	0	113	E7 K14	E7-N11 WeakPolarHBondContact O-CB 3.1Å; E7-N11 PolarHBondContact O-N 2.77Å; E7-N11 PolarHBondContact O-ND2 2.86Å; N11-K14 PolarHBondContact O-N 2.82Å
12	M	43.9	Very low	48.7	Very low	87 Å²	87	102.4 Å²	102.4	43%	0.429	53%	0.525	S	S	.	.	H	α-helix	trans	-71.2	-34.6	173.4	-80.5	-179.2	77	0	0	112.9	V8 K14 T20	V8-M12 HydrophobicContact CG1-SD 4.14Å; V8-M12 WeakPolarHBondContact O-CB 3.4Å; V8-M12 WeakPolarHBondContact O-CG 3.35Å; V8-M12 PolarHBondContact O-N 3.49Å; M12-K14 VanDerWaalsContact C-N 3.27Å; M12-K14 PolarHBondContact O-N 3.45Å; M12-T20 HydrophobicContact CE-CG2 3.17Å
13	F	49.1	Very low	49.8	Very low	106 Å²	106	97.3 Å²	97.3	47%	0.465	51%	0.51	S	S	.	.	H	α-helix	trans	-66.2	-28.5	174.9	-105.5	-113.2	0	0	0	112.7	F9 F17	F9-F13 PolarHBondContact O-N 2.88Å; F9-F13 VanDerWaalsContact O-N 3.15Å; F13-F17 AromaticContact CD1-CD2 3.69Å; F13-F17 HydrophobicContact CD1-CD2 3.69Å; F13-F17 AromaticContact CD1-CE2 3.04Å; F13-F17 HydrophobicContact CD1-CE2 3.04Å; F13-F17 AromaticContact CD1-CZ 3.83Å; F13-F17 HydrophobicContact CD1-CZ 3.83Å; F13-F17 AromaticContact CE1-CD2 3.99Å; F13-F17 HydrophobicContact CE1-CD2 3.99Å; F13-F17 HydrophobicContact CE1-CE1 4.42Å; F13-F17 AromaticContact CE1-CE2 3Å; F13-F17 HydrophobicContact CE1-CE2 3Å; F13-F17 AromaticContact CE1-CZ 3.25Å; F13-F17 HydrophobicContact CE1-CZ 3.25Å; F13-F17 HydrophobicContact CG-CD2 4.14Å; F13-F17 AromaticContact CG-CE2 3.91Å; F13-F17 HydrophobicContact CG-CE2 3.91Å; F13-F17 AromaticContact CZ-CE2 3.84Å; F13-F17 HydrophobicContact CZ-CE2 3.84Å; F13-F17 AromaticContact CZ-CZ 3.77Å; F13-F17 HydrophobicContact CZ-CZ 3.77Å; F13-F17 WeakPolarHBondContact O-CD2 3.43Å
14	K	50.2	Low	51	Low	157 Å²	157	95.8 Å²	95.8	68%	0.683	50%	0.501	S	S	*	.	H	α-helix	trans	-83.8	-23.9	-174.3	-79.9	173.1	-177.7	159	0	115.6	D10 N11 M12	D10-K14 PolarHBondContact O-N 3.46Å; N11-K14 PolarHBondContact O-N 2.82Å; M12-K14 VanDerWaalsContact C-N 3.27Å; M12-K14 PolarHBondContact O-N 3.45Å
15	S	47.7	Very low	52	Low	99 Å²	99	92 Å²	92	69%	0.692	48%	0.484	S	S	*	.	H	α-helix	trans	-118.9	-16.6	-172.6	88.4	0	0	0	0	116.7
16	S	54	Low	52.8	Low	44 Å²	44	92.2 Å²	92.2	31%	0.308	48%	0.481	S	S	.	.			trans	-156.7	44.3	-173.7	-77.1	0	0	0	0	114.5	P18 L19 T20	S16-P18 VanDerWaalsContact C-CD 3.42Å; S16-L19 PolarHBondContact O-N 3.45Å; S16-L19 VanDerWaalsContact O-N 3.08Å; S16-T20 PolarHBondContact O-N 3.01Å; S16-T20 PolarHBondContact O-OG1 3.35Å
17	F	54.6	Low	53.6	Low	101 Å²	101	91 Å²	91	44%	0.443	48%	0.475	S	S	.	.	H	α-helix	trans	-47.5	-40.2	-178.5	-149.4	-72.6	0	0	0	116.3	F13 T20 F21	F13-F17 AromaticContact CD1-CD2 3.69Å; F13-F17 HydrophobicContact CD1-CD2 3.69Å; F13-F17 AromaticContact CD1-CE2 3.04Å; F13-F17 HydrophobicContact CD1-CE2 3.04Å; F13-F17 AromaticContact CD1-CZ 3.83Å; F13-F17 HydrophobicContact CD1-CZ 3.83Å; F13-F17 AromaticContact CE1-CD2 3.99Å; F13-F17 HydrophobicContact CE1-CD2 3.99Å; F13-F17 HydrophobicContact CE1-CE1 4.42Å; F13-F17 AromaticContact CE1-CE2 3Å; F13-F17 HydrophobicContact CE1-CE2 3Å; F13-F17 AromaticContact CE1-CZ 3.25Å; F13-F17 HydrophobicContact CE1-CZ 3.25Å; F13-F17 HydrophobicContact CG-CD2 4.14Å; F13-F17 AromaticContact CG-CE2 3.91Å; F13-F17 HydrophobicContact CG-CE2 3.91Å; F13-F17 AromaticContact CZ-CE2 3.84Å; F13-F17 HydrophobicContact CZ-CE2 3.84Å; F13-F17 AromaticContact CZ-CZ 3.77Å; F13-F17 HydrophobicContact CZ-CZ 3.77Å; F13-F17 WeakPolarHBondContact O-CD2 3.43Å; F17-T20 PolarHBondContact O-OG1 3.1Å; F17-F21 HydrophobicContact CE1-CE2 4.37Å
18	P	58	Low	54.5	Low	69 Å²	69	87.9 Å²	87.9	45%	0.448	47%	0.465	S	S	.	.	H	α-helix	trans	-79.3	-33	178.2	28.5	-31.8	0	0	0	113.1	S16 I22	S16-P18 VanDerWaalsContact C-CD 3.42Å; P18-I22 WeakPolarHBondContact O-CD1 3.48Å; P18-I22 WeakPolarHBondContact O-CG1 3.39Å; P18-I22 PolarHBondContact O-N 2.98Å
19	L	54.6	Low	54.8	Low	104 Å²	104	86.5 Å²	86.5	55%	0.545	46%	0.455	S	S	.	.	H	α-helix	trans	-74.7	-34	-175	-88.6	156.3	0	0	0	112.4	S16 I22 V23	S16-L19 PolarHBondContact O-N 3.45Å; S16-L19 VanDerWaalsContact O-N 3.08Å; L19-I22 PolarHBondContact O-N 2.75Å; L19-V23 WeakPolarHBondContact O-CG2 3.49Å; L19-V23 PolarHBondContact O-N 2.63Å; L19-V23 VanDerWaalsContact O-N 3.07Å
20	T	58.3	Low	55.3	Low	36 Å²	36	85.6 Å²	85.6	22%	0.221	46%	0.455	C	S	.	.	H	α-helix	trans	-70.3	-37.7	178.6	37.5	0	0	0	0	112.6	M12 S16 F17 I22 V23 F24	M12-T20 HydrophobicContact CE-CG2 3.17Å; S16-T20 PolarHBondContact O-N 3.01Å; S16-T20 PolarHBondContact O-OG1 3.35Å; F17-T20 PolarHBondContact O-OG1 3.1Å; T20-I22 VanDerWaalsContact C-N 3.33Å; T20-I22 PolarHBondContact O-N 3.07Å; T20-V23 PolarHBondContact O-N 2.7Å; T20-F24 WeakPolarHBondContact O-CB 3.4Å; T20-F24 PolarHBondContact O-N 2.82Å
21	F	58.4	Low	55.6	Low	108 Å²	108	87.8 Å²	87.8	47%	0.474	47%	0.466	S	S	.	.	H	α-helix	trans	-68.3	-30.7	172	-97.9	-85.1	0	0	0	113.5	F17 I25 Y548	F17-F21 HydrophobicContact CE1-CE2 4.37Å; F21-I25 HydrophobicContact CD1-CD1 3.71Å; F21-I25 HydrophobicContact CE1-CD1 4.09Å; F21-Y548 PolarHBondContact O-OH 3.47Å
22	I	59.1	Low	55.9	Low	69 Å²	69	87 Å²	87	35%	0.354	47%	0.465	S	S	.	.	H	α-helix	trans	-73	-34.8	178.1	-70	165.9	0	0	0	111.7	P18 L19 T20 P26 Y548 M552	P18-I22 WeakPolarHBondContact O-CD1 3.48Å; P18-I22 WeakPolarHBondContact O-CG1 3.39Å; P18-I22 PolarHBondContact O-N 2.98Å; L19-I22 PolarHBondContact O-N 2.75Å; T20-I22 VanDerWaalsContact C-N 3.33Å; T20-I22 PolarHBondContact O-N 3.07Å; I22-P26 WeakPolarHBondContact O-CD 3.09Å; I22-P26 WeakPolarHBondContact O-CG 3.48Å; I22-Y548 WeakPolarHBondContact CA-OH 3.32Å; I22-M552 HydrophobicContact CD1-CE 3.75Å; I22-M552 HydrophobicContact CD1-SD 4.44Å; I22-M552 HydrophobicContact CG1-CE 3.66Å; I22-M552 HydrophobicContact CG1-SD 3.69Å
23	V	58.7	Low	56	Low	93 Å²	93	85.7 Å²	85.7	56%	0.564	46%	0.464	S	S	*	.	H	α-helix	trans	-96.3	-35.3	-175.6	178.5	0	0	0	0	112.5	L19 T20 A27	L19-V23 WeakPolarHBondContact O-CG2 3.49Å; L19-V23 PolarHBondContact O-N 2.63Å; L19-V23 VanDerWaalsContact O-N 3.07Å; T20-V23 PolarHBondContact O-N 2.7Å; V23-A27 VanDerWaalsContact O-CB 3.25Å; V23-A27 WeakPolarHBondContact O-CB 3.47Å; V23-A27 PolarHBondContact O-N 3.18Å; V23-A27 VanDerWaalsContact O-N 3.14Å
24	F	61.4	Low	56.1	Low	132 Å²	132	86.4 Å²	86.4	58%	0.579	48%	0.48	S	S	*	.	H	α-helix	trans	-72.3	-41.4	-172.9	-166.3	-99.7	0	0	0	112.9	T20 A27 V28	T20-F24 WeakPolarHBondContact O-CB 3.4Å; T20-F24 PolarHBondContact O-N 2.82Å; F24-A27 PolarHBondContact O-N 3.11Å; F24-V28 HydrophobicContact CD1-CG2 4.08Å; F24-V28 HydrophobicContact CE1-CG2 3.87Å; F24-V28 HydrophobicContact CZ-CG2 4.23Å; F24-V28 WeakPolarHBondContact O-CB 3.28Å; F24-V28 VanDerWaalsContact O-CG2 3.28Å; F24-V28 WeakPolarHBondContact O-CG2 3.43Å; F24-V28 PolarHBondContact O-N 3.38Å
25	I	62.1	Low	55.9	Low	48 Å²	48	85.9 Å²	85.9	25%	0.246	48%	0.483	C	S	.	.	H	α-helix	trans	-69.7	-44.4	-178.2	-68.3	174.2	0	0	0	111.8	F21 A27 V28 L29 Y548	F21-I25 HydrophobicContact CD1-CD1 3.71Å; F21-I25 HydrophobicContact CE1-CD1 4.09Å; I25-A27 VanDerWaalsContact C-N 3.35Å; I25-A27 PolarHBondContact O-N 2.91Å; I25-V28 PolarHBondContact O-N 2.87Å; I25-L29 HydrophobicContact CG2-CD1 3.77Å; I25-L29 HydrophobicContact CG2-CG 4.39Å; I25-L29 WeakPolarHBondContact O-CB 3.48Å; I25-L29 VanDerWaalsContact O-CG 3.24Å; I25-L29 WeakPolarHBondContact O-CG 3.14Å; I25-L29 PolarHBondContact O-N 3.16Å; I25-Y548 HydrophobicContact CB-CE2 4.19Å; I25-Y548 HydrophobicContact CD1-CD2 3.99Å; I25-Y548 HydrophobicContact CD1-CE2 3.6Å; I25-Y548 HydrophobicContact CG1-CE2 4.47Å; I25-Y548 HydrophobicContact CG2-CD2 4.23Å; I25-Y548 HydrophobicContact CG2-CE2 4.15Å
26	P	59.6	Low	55.6	Low	49 Å²	49	86.7 Å²	86.7	32%	0.318	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-38.3	171.8	-25.6	37	0	0	0	113.1	I22 L29 I30	I22-P26 WeakPolarHBondContact O-CD 3.09Å; I22-P26 WeakPolarHBondContact O-CG 3.48Å; P26-L29 PolarHBondContact O-N 3.17Å; P26-I30 WeakPolarHBondContact O-CB 3.46Å; P26-I30 WeakPolarHBondContact O-CD1 2.96Å; P26-I30 WeakPolarHBondContact O-CG1 3.35Å; P26-I30 PolarHBondContact O-N 3.46Å
27	A	58.3	Low	55.5	Low	43 Å²	43	87.8 Å²	87.8	36%	0.355	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-41	176.9	0	0	0	0	0	112.2	V23 F24 I25 I30 L31	V23-A27 VanDerWaalsContact O-CB 3.25Å; V23-A27 WeakPolarHBondContact O-CB 3.47Å; V23-A27 PolarHBondContact O-N 3.18Å; V23-A27 VanDerWaalsContact O-N 3.14Å; F24-A27 PolarHBondContact O-N 3.11Å; I25-A27 VanDerWaalsContact C-N 3.35Å; I25-A27 PolarHBondContact O-N 2.91Å; A27-I30 PolarHBondContact O-N 3.04Å; A27-L31 WeakPolarHBondContact O-CB 3.39Å; A27-L31 PolarHBondContact O-N 3.38Å
28	V	62.1	Low	55.3	Low	66 Å²	66	91.4 Å²	91.4	40%	0.4	52%	0.516	S	S	.	.	H	α-helix	trans	-66.9	-40	173.6	172	0	0	0	0	111.2	F24 I25 I30 L31 V32	F24-V28 HydrophobicContact CD1-CG2 4.08Å; F24-V28 HydrophobicContact CE1-CG2 3.87Å; F24-V28 HydrophobicContact CZ-CG2 4.23Å; F24-V28 WeakPolarHBondContact O-CB 3.28Å; F24-V28 VanDerWaalsContact O-CG2 3.28Å; F24-V28 WeakPolarHBondContact O-CG2 3.43Å; F24-V28 PolarHBondContact O-N 3.38Å; I25-V28 PolarHBondContact O-N 2.87Å; V28-I30 VanDerWaalsContact C-N 3.34Å; V28-I30 PolarHBondContact O-N 3.49Å; V28-L31 PolarHBondContact O-N 2.72Å; V28-V32 HydrophobicContact CG1-CG2 4.45Å; V28-V32 WeakPolarHBondContact O-CB 3.46Å; V28-V32 WeakPolarHBondContact O-CG2 3.19Å; V28-V32 PolarHBondContact O-N 3.27Å
29	L	57.8	Low	55.3	Low	60 Å²	60	90.3 Å²	90.3	31%	0.314	51%	0.513	S	S	.	.	H	α-helix	trans	-67.2	-32.8	176.6	-72.9	166.9	0	0	0	112.8	I25 P26 V32 S33 L541	I25-L29 HydrophobicContact CG2-CD1 3.77Å; I25-L29 HydrophobicContact CG2-CG 4.39Å; I25-L29 WeakPolarHBondContact O-CB 3.48Å; I25-L29 VanDerWaalsContact O-CG 3.24Å; I25-L29 WeakPolarHBondContact O-CG 3.14Å; I25-L29 PolarHBondContact O-N 3.16Å; P26-L29 PolarHBondContact O-N 3.17Å; L29-V32 PolarHBondContact O-N 3.13Å; L29-S33 PolarHBondContact O-N 3.26Å; L29-L541 HydrophobicContact CD2-CD1 3.73Å
30	I	57.2	Low	55.8	Low	121 Å²	121	87.8 Å²	87.8	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-73.3	-37.2	174	-68.2	163.7	0	0	0	110.9	P26 A27 V28 V32 S33	P26-I30 WeakPolarHBondContact O-CB 3.46Å; P26-I30 WeakPolarHBondContact O-CD1 2.96Å; P26-I30 WeakPolarHBondContact O-CG1 3.35Å; P26-I30 PolarHBondContact O-N 3.46Å; A27-I30 PolarHBondContact O-N 3.04Å; V28-I30 VanDerWaalsContact C-N 3.34Å; V28-I30 PolarHBondContact O-N 3.49Å; I30-V32 VanDerWaalsContact C-N 3.27Å; I30-V32 PolarHBondContact O-N 3.46Å; I30-S33 VanDerWaalsContact O-CB 3.27Å; I30-S33 WeakPolarHBondContact O-CB 3.14Å; I30-S33 PolarHBondContact O-N 2.98Å; I30-S33 PolarHBondContact O-OG 3.36Å
31	L	54.5	Low	57	Low	146 Å²	146	87 Å²	87	76%	0.764	50%	0.501	S	S	*	.	H	α-helix	trans	-67.9	-25.6	172.5	-97.9	146.2	0	0	0	113.4	A27 V28	A27-L31 WeakPolarHBondContact O-CB 3.39Å; A27-L31 PolarHBondContact O-N 3.38Å; V28-L31 PolarHBondContact O-N 2.72Å
32	V	54	Low	58.5	Low	88 Å²	88	87.6 Å²	87.6	53%	0.533	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-7.5	174.1	176.1	0	0	0	0	112	V28 L29 I30	V28-V32 HydrophobicContact CG1-CG2 4.45Å; V28-V32 WeakPolarHBondContact O-CB 3.46Å; V28-V32 WeakPolarHBondContact O-CG2 3.19Å; V28-V32 PolarHBondContact O-N 3.27Å; L29-V32 PolarHBondContact O-N 3.13Å; I30-V32 VanDerWaalsContact C-N 3.27Å; I30-V32 PolarHBondContact O-N 3.46Å
33	S	47	Very low	60	Low	60 Å²	60	85.1 Å²	85.1	42%	0.42	49%	0.492	S	S	.	.	S	Bend	trans	-64.7	148.4	171.5	80.5	0	0	0	0	110.1	L29 I30 L35	L29-S33 PolarHBondContact O-N 3.26Å; I30-S33 VanDerWaalsContact O-CB 3.27Å; I30-S33 WeakPolarHBondContact O-CB 3.14Å; I30-S33 PolarHBondContact O-N 2.98Å; I30-S33 PolarHBondContact O-OG 3.36Å; S33-L35 PolarHBondContact O-N 2.98Å
34	P	50.4	Low	61.6	Low	122 Å²	122	83.4 Å²	83.4	79%	0.792	48%	0.482	S	S	*	.			trans	-66.7	108.3	-171.7	26.9	-31.8	0	0	0	109.3
35	L	46.3	Very low	63.1	Low	145 Å²	145	77.1 Å²	77.1	76%	0.759	45%	0.454	S	S	*	.			trans	-49.8	147.8	159.7	-78.3	160.4	0	0	0	108.7	S33 A37	S33-L35 PolarHBondContact O-N 2.98Å; L35-A37 PolarHBondContact O-N 3.16Å
36	P	41.3	Very low	64.6	Low	117 Å²	117	75.9 Å²	75.9	76%	0.76	45%	0.447	S	S	*	.			trans	-49.1	120.6	-178.1	19.7	-31.5	0	0	0	109.3	E38	P36-E38 VanDerWaalsContact C-N 3.32Å; P36-E38 PolarHBondContact O-N 3.32Å
37	A	51.4	Low	66.2	Low	66 Å²	66	73.6 Å²	73.6	55%	0.545	43%	0.432	S	S	.	.			trans	-66.9	90.7	-174.9	0	0	0	0	0	109.3	L35 A39	L35-A37 PolarHBondContact O-N 3.16Å; A37-A39 PolarHBondContact O-N 3.2Å
38	E	52	Low	67.9	Low	177 Å²	177	71.6 Å²	71.6	83%	0.827	42%	0.415	S	S	*	.			trans	-53.6	136.2	159.6	-75.5	-178.3	158.8	0	0	107.7	P36 A40	P36-E38 VanDerWaalsContact C-N 3.32Å; P36-E38 PolarHBondContact O-N 3.32Å; E38-A40 PolarHBondContact O-N 3.42Å
39	A	56.6	Low	69.3	Low	47 Å²	47	68.4 Å²	68.4	39%	0.388	40%	0.396	S	S	.	.			trans	-55.2	125.8	175.3	0	0	0	0	0	107.8	A37 H41 N528 Y530	A37-A39 PolarHBondContact O-N 3.2Å; A39-H41 PolarHBondContact O-N 2.83Å; A39-N528 HydrophobicContact CB-CB 4.47Å; A39-Y530 HydrophobicContact CB-CD1 4.24Å; A39-Y530 HydrophobicContact CB-CE1 3.72Å
40	A	65.6	Low	70.9	Confident	51 Å²	51	65.8 Å²	65.8	42%	0.421	38%	0.382	S	S	.	.	S	Bend	trans	-68.1	-30.3	-179	0	0	0	0	0	110.5	E38 A529 R531	E38-A40 PolarHBondContact O-N 3.42Å; A40-A529 WeakPolarHBondContact CB-O 3.16Å; A40-A529 PolarHBondContact N-O 2.82Å; A40-R531 HydrophobicContact CB-CB 4.46Å
41	H	84.1	Confident	72.5	Confident	19 Å²	19	60.7 Å²	60.7	9%	0.088	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	142	177	-173.2	58.6	0	0	0	110.9	A39 F43 D146 E148 I152 A529	A39-H41 PolarHBondContact O-N 2.83Å; H41-F43 AromaticContact CD2-CD1 3.6Å; H41-D146 IonicContact CE1-OD2 2.97Å; H41-D146 PolarHBondContact CE1-OD2 2.89Å; H41-D146 IonicContact NE2-OD2 2.87Å; H41-D146 PolarHBondContact NE2-OD2 3.18Å; H41-E148 IonicContact CE1-OE2 3.07Å; H41-E148 PolarHBondContact CE1-OE2 3.07Å; H41-E148 IonicContact CG-OE2 2.8Å; H41-E148 IonicContact ND1-OE2 3.36Å; H41-E148 PolarHBondContact ND1-OE2 3.42Å; H41-I152 HydrophobicContact CB-CD1 4.28Å; H41-A529 HydrophobicContact CB-CB 4.38Å; H41-A529 PolarHBondContact N-O 3.41Å; H41-A529 PolarHBondContact O-N 3.02Å
42	E	88.4	Confident	74.2	Confident	120 Å²	120	54.8 Å²	54.8	56%	0.561	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.4	171.9	174.6	172.7	-165.3	0	0	108.9	T526 N528	E42-T526 WeakPolarHBondContact OE1-CB 3.1Å; E42-T526 PolarHBondContact OE1-OG1 3.07Å; E42-N528 WeakPolarHBondContact CG-OD1 3.22Å
43	F	91.3	Very high	75.8	Confident	17 Å²	17	51 Å²	51	8%	0.075	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	154.8	178.5	63.3	-80.1	0	0	0	111.8	H41 V45 A143 L149 M183 M527	H41-F43 AromaticContact CD2-CD1 3.6Å; F43-V45 HydrophobicContact CD2-CG1 3.64Å; F43-V45 HydrophobicContact CE2-CG1 3.28Å; F43-V45 HydrophobicContact CZ-CG1 4.21Å; F43-A143 HydrophobicContact CD2-CB 3.87Å; F43-A143 HydrophobicContact CE2-CB 3.76Å; F43-L149 HydrophobicContact CD1-CD1 4.44Å; F43-L149 HydrophobicContact CD2-CD2 4.3Å; F43-L149 HydrophobicContact CE1-CD1 3.93Å; F43-L149 HydrophobicContact CE2-CD1 4.16Å; F43-L149 HydrophobicContact CE2-CD2 4.2Å; F43-L149 HydrophobicContact CZ-CD1 3.77Å; F43-M183 HydrophobicContact CE1-CE 4.48Å; F43-M183 HydrophobicContact CE1-SD 4.24Å; F43-M183 HydrophobicContact CZ-SD 4.4Å; F43-M527 WeakPolarHBondContact CD1-O 3.4Å; F43-M527 HydrophobicContact CE1-CB 4.15Å; F43-M527 HydrophobicContact CE1-CG 4.12Å; F43-M527 HydrophobicContact CE1-SD 4.33Å; F43-M527 HydrophobicContact CE2-CB 4.14Å; F43-M527 HydrophobicContact CE2-CG 4.49Å; F43-M527 HydrophobicContact CE2-SD 4.13Å; F43-M527 HydrophobicContact CZ-CB 3.91Å; F43-M527 HydrophobicContact CZ-CG 3.85Å; F43-M527 HydrophobicContact CZ-SD 3.54Å; F43-M527 VanDerWaalsContact CZ-SD 3.54Å; F43-M527 PolarHBondContact N-O 3.35Å; F43-M527 PolarHBondContact O-N 3.4Å
44	T	92	Very high	77.6	Confident	58 Å²	58	52.8 Å²	52.8	36%	0.356	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132.4	178	53.3	0	0	0	0	110.9	T526	T44-T526 HydrophobicContact CG2-CG2 4.49Å
45	V	93.3	Very high	79.1	Confident	0 Å²	0	50 Å²	50	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.9	175.2	-66.7	0	0	0	0	111	F43 Y141 A143 Q525 M527	F43-V45 HydrophobicContact CD2-CG1 3.64Å; F43-V45 HydrophobicContact CE2-CG1 3.28Å; F43-V45 HydrophobicContact CZ-CG1 4.21Å; V45-Y141 HydrophobicContact CB-CD1 4.02Å; V45-Y141 HydrophobicContact CB-CG 4.31Å; V45-Y141 HydrophobicContact CG2-CD1 3.81Å; V45-Y141 HydrophobicContact CG2-CE1 4.18Å; V45-Y141 HydrophobicContact CG2-CG 4.36Å; V45-A143 HydrophobicContact CG1-CB 4.22Å; V45-Q525 HydrophobicContact CG2-CB 4.04Å; V45-Q525 WeakPolarHBondContact CG2-O 3.29Å; V45-Q525 PolarHBondContact N-O 3.19Å; V45-Q525 PolarHBondContact O-N 2.78Å; V45-M527 HydrophobicContact CG1-CB 3.72Å; V45-M527 HydrophobicContact CG1-CE 4.06Å; V45-M527 HydrophobicContact CG1-SD 4.22Å; V45-M527 HydrophobicContact CG2-CB 3.95Å; V45-M527 HydrophobicContact CG2-CE 4.23Å
46	Y	94.2	Very high	81.1	Confident	22 Å²	22	47 Å²	47	9%	0.086	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.3	176.9	-54.4	-71.1	0	0	0	108.8	Y141 F142 E144 W230 L231 K524	Y46-Y141 CarbonylContact O-C 3.53Å; Y46-Y141 WeakPolarHBondContact O-CA 3.38Å; Y46-F142 PolarHBondContact N-O 3.1Å; Y46-F142 PolarHBondContact O-N 3.31Å; Y46-E144 HydrophobicContact CE2-CG 4.43Å; Y46-W230 HydrophobicContact CD1-CB 3.36Å; Y46-W230 AromaticContact CD1-CG 3.92Å; Y46-W230 HydrophobicContact CD1-CG 3.92Å; Y46-W230 HydrophobicContact CE1-CB 3.76Å; Y46-W230 HydrophobicContact CE1-CG 4.27Å; Y46-W230 HydrophobicContact CG-CB 4.18Å; Y46-L231 HydrophobicContact CD2-CD1 3.74Å; Y46-L231 HydrophobicContact CD2-CD2 3.74Å; Y46-L231 HydrophobicContact CD2-CG 3.76Å; Y46-L231 HydrophobicContact CE2-CD1 4.42Å; Y46-L231 HydrophobicContact CE2-CD2 3.62Å; Y46-L231 HydrophobicContact CE2-CG 4.18Å; Y46-L231 HydrophobicContact CG-CD1 4.23Å; Y46-L231 HydrophobicContact CG-CD2 4.35Å; Y46-L231 HydrophobicContact CG-CG 4.03Å; Y46-K524 HydrophobicContact CD1-CB 4.43Å; Y46-K524 HydrophobicContact CD1-CG 4.2Å; Y46-K524 HydrophobicContact CE1-CD 4.03Å; Y46-K524 HydrophobicContact CE1-CG 4.12Å
47	R	93.1	Very high	83.4	Confident	1 Å²	1	43.2 Å²	43.2	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	142.8	-178.1	-168.9	176.8	157.4	-143.8	-2.7	110.4	T60 R61 N62 Y141 S190 L523	R47-T60 PolarHBondContact NE-OG1 3.06Å; R47-T60 PolarHBondContact NH2-O 3.17Å; R47-R61 VanDerWaalsContact NH2-C 3.31Å; R47-R61 PolarHBondContact NH2-O 2.82Å; R47-R61 VanDerWaalsContact NH2-O 3.16Å; R47-N62 VanDerWaalsContact CZ-O 3.24Å; R47-N62 PolarHBondContact NE-O 3.39Å; R47-N62 PolarHBondContact NH2-O 2.93Å; R47-N62 VanDerWaalsContact NH2-O 3.14Å; R47-Y141 HydrophobicContact CB-CD1 3.97Å; R47-Y141 HydrophobicContact CB-CE1 3.87Å; R47-Y141 HydrophobicContact CG-CD1 4.22Å; R47-Y141 HydrophobicContact CG-CE1 3.91Å; R47-S190 PolarHBondContact NH1-OG 3.5Å; R47-L523 PolarHBondContact N-O 2.83Å
48	M	93	Very high	85.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-56	142.1	168.3	-178.5	158.9	99	0	0	110.1	T60 M131 L132 V140 F142 V227	M48-T60 HydrophobicContact CB-CG2 3.78Å; M48-T60 HydrophobicContact CE-CG2 3.3Å; M48-T60 HydrophobicContact CG-CG2 4.06Å; M48-T60 PolarHBondContact O-OG1 3.16Å; M48-T60 HydrophobicContact SD-CG2 4.22Å; M48-M131 HydrophobicContact SD-CB 4.48Å; M48-M131 HydrophobicContact SD-CE 4.41Å; M48-L132 HydrophobicContact CG-CD2 3.93Å; M48-L132 HydrophobicContact SD-CD2 4.39Å; M48-V140 HydrophobicContact CB-CB 3.95Å; M48-V140 HydrophobicContact CB-CG1 4.49Å; M48-V140 WeakPolarHBondContact CB-O 3.34Å; M48-V140 HydrophobicContact CE-CG2 4.26Å; M48-V140 PolarHBondContact N-O 2.52Å; M48-V140 HydrophobicContact SD-CB 4.19Å; M48-V140 HydrophobicContact SD-CG1 4.43Å; M48-V140 HydrophobicContact SD-CG2 4.45Å; M48-F142 HydrophobicContact CB-CE2 4.1Å; M48-V227 CarbonylContact C-O 3.53Å; M48-V227 WeakPolarHBondContact CA-O 3.45Å; M48-V227 HydrophobicContact CB-CG2 4.5Å; M48-V227 HydrophobicContact CG-CG2 3.68Å; M48-V227 HydrophobicContact SD-CG2 3.52Å; M48-V227 VanDerWaalsContact SD-CG2 3.52Å
49	Q	91.3	Very high	87.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-52.1	149.8	-174.3	-47.4	-137.4	-10.2	0	0	111.9	Y51 G59 T60 L132 G226 V227 P229	Q49-Y51 HydrophobicContact CB-CD1 4.12Å; Q49-Y51 HydrophobicContact CB-CE1 4.33Å; Q49-G59 VanDerWaalsContact O-CA 3.3Å; Q49-G59 WeakPolarHBondContact O-CA 3.31Å; Q49-T60 PolarHBondContact O-N 2.92Å; Q49-T60 VanDerWaalsContact O-N 3.16Å; Q49-L132 HydrophobicContact CB-CD2 4.06Å; Q49-L132 HydrophobicContact CG-CD2 4.11Å; Q49-G226 VanDerWaalsContact CD-O 3.3Å; Q49-G226 WeakPolarHBondContact CG-O 3.47Å; Q49-G226 PolarHBondContact NE2-O 2.8Å; Q49-V227 WeakPolarHBondContact CG-O 3.48Å; Q49-V227 PolarHBondContact N-O 3.13Å; Q49-P229 HydrophobicContact CB-CG 4.26Å; Q49-P229 HydrophobicContact CG-CG 3.64Å
50	Q	91.3	Very high	88.6	Confident	5 Å²	5	31.1 Å²	31.1	2%	0.023	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	121.4	166.5	-174.3	-174.1	-2.4	0	0	107.6	T60 R61 S190 Y520	Q50-T60 VanDerWaalsContact CB-O 3.24Å; Q50-T60 WeakPolarHBondContact CB-O 3.38Å; Q50-T60 VanDerWaalsContact CD-O 3.24Å; Q50-T60 WeakPolarHBondContact CG-O 3.46Å; Q50-T60 PolarHBondContact OE1-O 2.8Å; Q50-R61 VanDerWaalsContact NE2-NH1 3.14Å; Q50-S190 VanDerWaalsContact OE1-CB 3.3Å; Q50-S190 PolarHBondContact OE1-OG 2.8Å; Q50-Y520 HydrophobicContact CB-CD2 4.17Å; Q50-Y520 HydrophobicContact CB-CG 4.24Å; Q50-Y520 VanDerWaalsContact CD-CG 3.43Å; Q50-Y520 HydrophobicContact CG-CD1 4.3Å; Q50-Y520 HydrophobicContact CG-CD2 3.58Å; Q50-Y520 HydrophobicContact CG-CE2 3.98Å; Q50-Y520 HydrophobicContact CG-CG 3.76Å; Q50-Y520 VanDerWaalsContact NE2-CD1 3.31Å; Q50-Y520 WeakPolarHBondContact O-CD2 3.35Å
51	Y	91.3	Very high	89.6	Confident	13 Å²	13	31.3 Å²	31.3	5%	0.051	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	156.1	173.9	63.2	-93.3	0	0	0	110.1	Q49 L53 Y58 F225 F277 V518	Q49-Y51 HydrophobicContact CB-CD1 4.12Å; Q49-Y51 HydrophobicContact CB-CE1 4.33Å; Y51-L53 HydrophobicContact CD2-CD1 4.11Å; Y51-L53 HydrophobicContact CD2-CG 3.75Å; Y51-L53 HydrophobicContact CE2-CD1 3.53Å; Y51-L53 HydrophobicContact CE2-CG 3.7Å; Y51-Y58 AromaticContact CD2-CD2 3.84Å; Y51-Y58 HydrophobicContact CD2-CD2 3.84Å; Y51-Y58 HydrophobicContact CD2-CG 4.29Å; Y51-Y58 AromaticContact CE2-CD2 3.29Å; Y51-Y58 HydrophobicContact CE2-CD2 3.29Å; Y51-Y58 HydrophobicContact CE2-CE2 4.14Å; Y51-Y58 AromaticContact CE2-CG 3.56Å; Y51-Y58 HydrophobicContact CE2-CG 3.56Å; Y51-Y58 VanDerWaalsContact CZ-CB 3.48Å; Y51-Y58 AromaticContact CZ-CD2 3.99Å; Y51-Y58 AromaticContact CZ-CG 3.75Å; Y51-Y58 PolarHBondContact N-O 2.79Å; Y51-Y58 PolarHBondContact O-N 2.82Å; Y51-F225 HydrophobicContact CE1-CE2 4.02Å; Y51-F225 HydrophobicContact CE1-CZ 4.13Å; Y51-F277 AromaticContact CD1-CE1 3.79Å; Y51-F277 HydrophobicContact CD1-CE1 3.79Å; Y51-F277 HydrophobicContact CD1-CZ 4.43Å; Y51-F277 HydrophobicContact CD2-CD1 4.25Å; Y51-F277 AromaticContact CD2-CE1 3.89Å; Y51-F277 HydrophobicContact CD2-CE1 3.89Å; Y51-F277 AromaticContact CE1-CE1 3.98Å; Y51-F277 HydrophobicContact CE1-CE1 3.98Å; Y51-F277 HydrophobicContact CE2-CD1 4.36Å; Y51-F277 HydrophobicContact CE2-CE1 4.08Å; Y51-F277 HydrophobicContact CG-CD1 4.49Å; Y51-F277 AromaticContact CG-CE1 3.74Å; Y51-F277 HydrophobicContact CG-CE1 3.74Å; Y51-V518 VanDerWaalsContact CA-O 3.28Å; Y51-V518 WeakPolarHBondContact CA-O 3.47Å; Y51-V518 WeakPolarHBondContact CB-O 3.41Å
52	D	90.3	Very high	89.7	Confident	22 Å²	22	33.5 Å²	33.5	12%	0.118	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	131	171	-51.9	-30.7	0	0	0	108.5	Q56 P57 R61 F517 V518 Y520	D52-Q56 CarbonylContact C-O 3.56Å; D52-Q56 VanDerWaalsContact CA-O 3.22Å; D52-Q56 WeakPolarHBondContact CA-O 3.43Å; D52-P57 WeakPolarHBondContact OD1-CA 3.48Å; D52-R61 IonicContact OD1-CZ 3.43Å; D52-R61 IonicContact OD1-NH1 2.8Å; D52-R61 PolarHBondContact OD1-NH1 3.41Å; D52-R61 IonicContact OD1-NH2 3.92Å; D52-R61 PolarHBondContact OD1-NH2 3.26Å; D52-R61 IonicContact OD2-NH1 3.13Å; D52-R61 PolarHBondContact OD2-NH1 3.04Å; D52-R61 IonicContact OD2-NH2 3.18Å; D52-F517 CarbonylContact O-C 3.59Å; D52-F517 VanDerWaalsContact O-CA 3.29Å; D52-F517 WeakPolarHBondContact O-CA 3.3Å; D52-V518 HydrophobicContact CB-CB 4.19Å; D52-V518 PolarHBondContact N-O 3.47Å; D52-V518 PolarHBondContact O-N 3.1Å; D52-Y520 PolarHBondContact OD2-OH 3.42Å
53	L	87.4	Confident	89.4	Confident	9 Å²	9	27.8 Å²	27.8	5%	0.047	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.8	172	-72.9	173.1	0	0	0	109	Y51 G55 Q56 Y58 F277 M364 F517	Y51-L53 HydrophobicContact CD2-CD1 4.11Å; Y51-L53 HydrophobicContact CD2-CG 3.75Å; Y51-L53 HydrophobicContact CE2-CD1 3.53Å; Y51-L53 HydrophobicContact CE2-CG 3.7Å; L53-G55 PolarHBondContact O-N 2.92Å; L53-Q56 PolarHBondContact N-O 2.81Å; L53-Q56 WeakPolarHBondContact O-CB 3.32Å; L53-Q56 PolarHBondContact O-N 2.83Å; L53-Y58 HydrophobicContact CB-CD2 4.45Å; L53-Y58 HydrophobicContact CB-CE2 3.97Å; L53-Y58 HydrophobicContact CD1-CE2 4.39Å; L53-Y58 HydrophobicContact CG-CE2 4.48Å; L53-F277 HydrophobicContact CD1-CD1 4.39Å; L53-F277 HydrophobicContact CD2-CB 4.31Å; L53-F277 HydrophobicContact CD2-CD1 4.16Å; L53-M364 HydrophobicContact CD1-CE 4.05Å; L53-M364 HydrophobicContact CD1-SD 3.54Å; L53-M364 VanDerWaalsContact CD1-SD 3.54Å; L53-F517 HydrophobicContact CD2-CB 3.88Å
54	Q	84.6	Confident	89.1	Confident	98 Å²	98	30.6 Å²	30.6	46%	0.458	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	34.6	179.6	-59.1	178.3	-12.5	0	0	113.3	Q56 E516	Q54-Q56 VanDerWaalsContact C-N 3.32Å; Q54-Q56 PolarHBondContact O-N 2.9Å; Q54-E516 PolarHBondContact N-O 2.86Å
55	G	82.3	Confident	88.8	Confident	64 Å²	64	28 Å²	28	66%	0.66	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.2	-2.5	-177.5	0	0	0	0	0	115.7	L53	L53-G55 PolarHBondContact O-N 2.92Å
56	Q	87.8	Confident	88.5	Confident	81 Å²	81	32.7 Å²	32.7	38%	0.379	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124	172.9	-66.5	-172.8	18.9	0	0	111.5	D52 L53 Q54 Y58 D363	D52-Q56 CarbonylContact C-O 3.56Å; D52-Q56 VanDerWaalsContact CA-O 3.22Å; D52-Q56 WeakPolarHBondContact CA-O 3.43Å; L53-Q56 PolarHBondContact N-O 2.81Å; L53-Q56 WeakPolarHBondContact O-CB 3.32Å; L53-Q56 PolarHBondContact O-N 2.83Å; Q54-Q56 VanDerWaalsContact C-N 3.32Å; Q54-Q56 PolarHBondContact O-N 2.9Å; Q56-Y58 HydrophobicContact CB-CE2 3.9Å; Q56-Y58 WeakPolarHBondContact O-CD2 3.42Å; Q56-Y58 WeakPolarHBondContact O-CE2 3.37Å; Q56-Y58 PolarHBondContact OE1-OH 3.24Å; Q56-D363 PolarHBondContact NE2-OD2 3.12Å
57	P	90.2	Very high	88.1	Confident	38 Å²	38	32.8 Å²	32.8	25%	0.247	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	142	170.4	-13.2	18.4	0	0	0	114.4	D52 E135	D52-P57 WeakPolarHBondContact OD1-CA 3.48Å; P57-E135 HydrophobicContact CB-CB 4.26Å; P57-E135 HydrophobicContact CB-CG 3.86Å; P57-E135 WeakPolarHBondContact CB-OE1 3.45Å; P57-E135 VanDerWaalsContact CG-CD 3.41Å; P57-E135 HydrophobicContact CG-CG 4.44Å; P57-E135 VanDerWaalsContact CG-OE1 3.26Å; P57-E135 WeakPolarHBondContact CG-OE1 3.31Å; P57-E135 WeakPolarHBondContact CG-OE2 3.47Å
58	Y	90.8	Very high	87.7	Confident	34 Å²	34	35.7 Å²	35.7	13%	0.133	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.4	165.2	-63.1	-84.6	0	0	0	111.8	Y51 L53 Q56	Y51-Y58 AromaticContact CD2-CD2 3.84Å; Y51-Y58 HydrophobicContact CD2-CD2 3.84Å; Y51-Y58 HydrophobicContact CD2-CG 4.29Å; Y51-Y58 AromaticContact CE2-CD2 3.29Å; Y51-Y58 HydrophobicContact CE2-CD2 3.29Å; Y51-Y58 HydrophobicContact CE2-CE2 4.14Å; Y51-Y58 AromaticContact CE2-CG 3.56Å; Y51-Y58 HydrophobicContact CE2-CG 3.56Å; Y51-Y58 VanDerWaalsContact CZ-CB 3.48Å; Y51-Y58 AromaticContact CZ-CD2 3.99Å; Y51-Y58 AromaticContact CZ-CG 3.75Å; Y51-Y58 PolarHBondContact N-O 2.79Å; Y51-Y58 PolarHBondContact O-N 2.82Å; L53-Y58 HydrophobicContact CB-CD2 4.45Å; L53-Y58 HydrophobicContact CB-CE2 3.97Å; L53-Y58 HydrophobicContact CD1-CE2 4.39Å; L53-Y58 HydrophobicContact CG-CE2 4.48Å; Q56-Y58 HydrophobicContact CB-CE2 3.9Å; Q56-Y58 WeakPolarHBondContact O-CD2 3.42Å; Q56-Y58 WeakPolarHBondContact O-CE2 3.37Å; Q56-Y58 PolarHBondContact OE1-OH 3.24Å
59	G	89.4	Confident	87.4	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.9	-142.1	175.2	0	0	0	0	0	115.7	Q49 L132 T136	Q49-G59 VanDerWaalsContact O-CA 3.3Å; Q49-G59 WeakPolarHBondContact O-CA 3.31Å; G59-L132 PolarHBondContact N-O 2.5Å; G59-L132 VanDerWaalsContact N-O 3.13Å; G59-T136 PolarHBondContact O-N 2.83Å; G59-T136 PolarHBondContact O-OG1 2.94Å
60	T	89.6	Confident	87	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-101.6	140.7	-169.5	67.4	0	0	0	0	113.7	R47 M48 Q49 Q50 T136 V138 V140	R47-T60 PolarHBondContact NE-OG1 3.06Å; R47-T60 PolarHBondContact NH2-O 3.17Å; M48-T60 HydrophobicContact CB-CG2 3.78Å; M48-T60 HydrophobicContact CE-CG2 3.3Å; M48-T60 HydrophobicContact CG-CG2 4.06Å; M48-T60 PolarHBondContact O-OG1 3.16Å; M48-T60 HydrophobicContact SD-CG2 4.22Å; Q49-T60 PolarHBondContact O-N 2.92Å; Q49-T60 VanDerWaalsContact O-N 3.16Å; Q50-T60 VanDerWaalsContact CB-O 3.24Å; Q50-T60 WeakPolarHBondContact CB-O 3.38Å; Q50-T60 VanDerWaalsContact CD-O 3.24Å; Q50-T60 WeakPolarHBondContact CG-O 3.46Å; Q50-T60 PolarHBondContact OE1-O 2.8Å; T60-T136 CarbonylContact C-O 3.55Å; T60-T136 VanDerWaalsContact CA-O 3.31Å; T60-T136 WeakPolarHBondContact CA-O 3.31Å; T60-V138 WeakPolarHBondContact CG2-O 3.49Å; T60-V140 HydrophobicContact CG2-CB 3.96Å; T60-V140 HydrophobicContact CG2-CG2 3.86Å
61	R	86.8	Confident	86.7	Confident	56 Å²	56	36.5 Å²	36.5	21%	0.211	20%	0.197	C	C	.	.			trans	-97.3	-39.1	-178.2	-66	-61.5	-158.8	177.7	6.1	115.8	R47 Q50 D52 E135 T136 Y520	R47-R61 VanDerWaalsContact NH2-C 3.31Å; R47-R61 PolarHBondContact NH2-O 2.82Å; R47-R61 VanDerWaalsContact NH2-O 3.16Å; Q50-R61 VanDerWaalsContact NE2-NH1 3.14Å; D52-R61 IonicContact OD1-CZ 3.43Å; D52-R61 IonicContact OD1-NH1 2.8Å; D52-R61 PolarHBondContact OD1-NH1 3.41Å; D52-R61 IonicContact OD1-NH2 3.92Å; D52-R61 PolarHBondContact OD1-NH2 3.26Å; D52-R61 IonicContact OD2-NH1 3.13Å; D52-R61 PolarHBondContact OD2-NH1 3.04Å; D52-R61 IonicContact OD2-NH2 3.18Å; R61-E135 IonicContact CZ-OE1 3.84Å; R61-E135 IonicContact NE-OE1 2.74Å; R61-E135 PolarHBondContact NE-OE1 3.07Å; R61-E135 VanDerWaalsContact NE-OE1 3.1Å; R61-E135 IonicContact NH2-OE1 2.7Å; R61-T136 PolarHBondContact N-O 3.12Å; R61-Y520 VanDerWaalsContact NH1-CZ 3.26Å; R61-Y520 PolarHBondContact NH1-OH 2.8Å
62	N	86.1	Confident	86.2	Confident	64 Å²	64	36.7 Å²	36.7	34%	0.342	20%	0.199	S	C	.	.			trans	-83.9	153.8	179.6	-72.9	-18.4	0	0	0	111.7	R47 I137 P139	R47-N62 VanDerWaalsContact CZ-O 3.24Å; R47-N62 PolarHBondContact NE-O 3.39Å; R47-N62 PolarHBondContact NH2-O 2.93Å; R47-N62 VanDerWaalsContact NH2-O 3.14Å; N62-I137 VanDerWaalsContact CB-O 3.24Å; N62-I137 WeakPolarHBondContact CB-O 3.35Å; N62-I137 VanDerWaalsContact CG-O 3.31Å; N62-I137 PolarHBondContact N-O 3.27Å; N62-I137 WeakPolarHBondContact ND2-CG2 3.44Å; N62-I137 PolarHBondContact ND2-O 2.96Å; N62-P139 HydrophobicContact CB-CG 4.37Å; N62-P139 WeakPolarHBondContact O-CB 3.25Å
63	A	81.9	Confident	85.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.			trans	-134.9	1.6	177.8	0	0	0	0	0	114.4	Y141 Q189 Q522 Q525	A63-Y141 PolarHBondContact O-OH 3.46Å; A63-Q189 VanDerWaalsContact N-OE1 3.1Å; A63-Q522 HydrophobicContact CB-CB 4.46Å; A63-Q525 PolarHBondContact O-NE2 3.1Å; A63-Q525 VanDerWaalsContact O-NE2 3.17Å; A63-Q525 PolarHBondContact O-OE1 2.71Å
64	I	85.3	Confident	84.9	Confident	77 Å²	77	41.3 Å²	41.3	40%	0.395	22%	0.22	S	C	.	.			trans	-109.7	131.2	178.4	-60.3	-178.1	0	0	0	109.1	Q189	I64-Q189 HydrophobicContact CD1-CB 4.35Å; I64-Q189 HydrophobicContact CD1-CG 3.51Å; I64-Q189 HydrophobicContact CG1-CG 3.91Å; I64-Q189 VanDerWaalsContact CG1-NE2 3.3Å
65	L	85.8	Confident	84.3	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	24%	0.235	C	C	.	.			trans	-121.6	134	173.8	-174.2	58.9	0	0	0	110.5	T67 C81 A104 M183 V184 T185 M527	L65-T67 HydrophobicContact CD1-CG2 4.11Å; L65-T67 WeakPolarHBondContact CD1-OG1 3.24Å; L65-C81 HydrophobicContact CD1-CB 4.41Å; L65-C81 HydrophobicContact CD2-CB 4.15Å; L65-A104 HydrophobicContact CD1-CB 3.38Å; L65-A104 HydrophobicContact CD2-CB 3.7Å; L65-A104 HydrophobicContact CG-CB 4.08Å; L65-M183 HydrophobicContact CD2-CB 3.75Å; L65-M183 HydrophobicContact CG-CB 4.49Å; L65-V184 WeakPolarHBondContact O-CA 3.23Å; L65-T185 HydrophobicContact CB-CG2 3.71Å; L65-T185 PolarHBondContact N-OG1 3.48Å; L65-T185 PolarHBondContact O-N 3.5Å; L65-T185 VanDerWaalsContact O-N 3.13Å; L65-T185 PolarHBondContact O-OG1 3.02Å; L65-M527 HydrophobicContact CD2-CE 3.54Å; L65-M527 HydrophobicContact CD2-SD 4.18Å
66	N	86.7	Confident	84.2	Confident	99 Å²	99	45 Å²	45	53%	0.529	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	74.6	167.4	-173	9.2	0	0	0	109.3	Q182 M183 V184	N66-Q182 PolarHBondContact OD1-NE2 2.94Å; N66-M183 WeakPolarHBondContact CA-O 3.27Å; N66-V184 WeakPolarHBondContact OD1-CG2 3.38Å
67	T	85.8	Confident	83.9	Confident	24 Å²	24	41.1 Å²	41.1	15%	0.147	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155	-173.1	61.1	0	0	0	0	112.6	L65 R79 C81 M183	L65-T67 HydrophobicContact CD1-CG2 4.11Å; L65-T67 WeakPolarHBondContact CD1-OG1 3.24Å; T67-R79 VanDerWaalsContact CB-O 3.25Å; T67-R79 WeakPolarHBondContact CB-O 3.46Å; T67-R79 WeakPolarHBondContact CG2-O 3.42Å; T67-C81 WeakPolarHBondContact OG1-CB 3.24Å; T67-C81 PolarHBondContact OG1-N 3.07Å; T67-M183 PolarHBondContact N-O 3.49Å; T67-M183 PolarHBondContact O-N 3.4Å
68	E	84.6	Confident	83.6	Confident	63 Å²	63	42.1 Å²	42.1	29%	0.294	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	137	172.8	-168.4	-167.4	155.1	0	0	111.1	R70 R80 C81 F181	E68-R70 IonicContact OE1-CZ 3.18Å; E68-R70 IonicContact OE1-NE 2.89Å; E68-R70 PolarHBondContact OE1-NE 2.86Å; E68-R70 IonicContact OE1-NH2 3.3Å; E68-R70 PolarHBondContact OE1-NH2 2.94Å; E68-R80 CarbonylContact O-C 3.55Å; E68-R80 WeakPolarHBondContact O-CA 3.25Å; E68-R80 WeakPolarHBondContact O-CB 3.24Å; E68-C81 PolarHBondContact O-N 3.29Å; E68-F181 CarbonylContact C-O 3.51Å; E68-F181 WeakPolarHBondContact CA-O 3.36Å
69	A	85.5	Confident	83.3	Confident	2 Å²	2	50.5 Å²	50.5	2%	0.017	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	136.3	175.8	0	0	0	0	0	112	C81 I83 T156 F181 M183	A69-C81 CarbonylContact C-O 3.55Å; A69-C81 VanDerWaalsContact CA-O 3.28Å; A69-C81 WeakPolarHBondContact CA-O 3.5Å; A69-I83 HydrophobicContact CB-CD1 3.81Å; A69-I83 HydrophobicContact CB-CG1 4.39Å; A69-T156 HydrophobicContact CB-CG2 4.47Å; A69-F181 HydrophobicContact CB-CB 4.13Å; A69-F181 PolarHBondContact N-O 3.28Å; A69-M183 HydrophobicContact CB-CE 4.31Å; A69-M183 HydrophobicContact CB-CG 4.04Å
70	R	84.8	Confident	83.2	Confident	19 Å²	19	53.3 Å²	53.3	7%	0.072	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	161.6	172.2	-71	-61.2	179.5	140.8	-5.3	110.5	E68 A74 R80 C81 V82 I83	E68-R70 IonicContact OE1-CZ 3.18Å; E68-R70 IonicContact OE1-NE 2.89Å; E68-R70 PolarHBondContact OE1-NE 2.86Å; E68-R70 IonicContact OE1-NH2 3.3Å; E68-R70 PolarHBondContact OE1-NH2 2.94Å; R70-A74 HydrophobicContact CB-CB 4.48Å; R70-R80 HydrophobicContact CB-CB 4.44Å; R70-R80 HydrophobicContact CG-CB 4.31Å; R70-R80 HydrophobicContact CG-CG 4.24Å; R70-C81 PolarHBondContact N-O 2.82Å; R70-C81 VanDerWaalsContact O-O 3.09Å; R70-V82 CarbonylContact O-C 3.58Å; R70-V82 VanDerWaalsContact O-CA 3.27Å; R70-V82 WeakPolarHBondContact O-CA 3.43Å; R70-I83 PolarHBondContact O-N 3.07Å
71	T	84.1	Confident	83.2	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	164.8	173.1	55	0	0	0	0	110.8	E73 A74 Y153 L157 S160	T71-E73 PolarHBondContact O-N 2.83Å; T71-A74 PolarHBondContact O-N 3.49Å; T71-Y153 HydrophobicContact CG2-CD2 4.05Å; T71-Y153 HydrophobicContact CG2-CE2 3.86Å; T71-L157 HydrophobicContact CG2-CB 4.04Å; T71-L157 HydrophobicContact CG2-CD1 4.09Å; T71-S160 VanDerWaalsContact OG1-CB 3.28Å; T71-S160 WeakPolarHBondContact OG1-CB 3.16Å; T71-S160 PolarHBondContact OG1-OG 3.41Å
72	V	80.6	Confident	83.4	Confident	16 Å²	16	50.7 Å²	50.7	10%	0.097	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.6	-177.6	-178.3	0	0	0	0	113.3	A74 V82 M84 Q93	V72-A74 PolarHBondContact O-N 3.43Å; V72-V82 HydrophobicContact CB-CG1 4.43Å; V72-V82 HydrophobicContact CG2-CG1 3.6Å; V72-M84 HydrophobicContact CG2-CB 4Å; V72-M84 HydrophobicContact CG2-CE 3.85Å; V72-Q93 HydrophobicContact CG1-CB 3.75Å; V72-Q93 HydrophobicContact CG1-CG 3.81Å
73	E	76.4	Confident	83.7	Confident	124 Å²	124	47.7 Å²	47.7	58%	0.579	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.3	-178.5	-63	-177.9	171.9	0	0	113.8	T71 L157	T71-E73 PolarHBondContact O-N 2.83Å; E73-L157 VanDerWaalsContact CD-CD1 3.5Å; E73-L157 HydrophobicContact CG-CD1 4.26Å; E73-L157 VanDerWaalsContact OE2-CD1 3.31Å; E73-L157 WeakPolarHBondContact OE2-CD1 3.28Å
74	A	73.9	Confident	84.1	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.041	23%	0.232	C	C	.	.			trans	-68.1	142	179.9	0	0	0	0	0	112.1	R70 T71 V72 V76 L77	R70-A74 HydrophobicContact CB-CB 4.48Å; T71-A74 PolarHBondContact O-N 3.49Å; V72-A74 PolarHBondContact O-N 3.43Å; A74-V76 VanDerWaalsContact C-N 3.35Å; A74-V76 PolarHBondContact O-N 3.45Å; A74-L77 HydrophobicContact CB-CD2 3.98Å
75	E	72.5	Confident	84.4	Confident	162 Å²	162	48.1 Å²	48.1	76%	0.757	23%	0.228	S	C	*	.	S	Bend	trans	-67.4	-34.2	179.7	-66.6	-172.5	164.2	0	0	113	Q100	E75-Q100 PolarHBondContact O-NE2 2.7Å
76	V	79.9	Confident	84.5	Confident	77 Å²	77	48.1 Å²	48.1	47%	0.467	23%	0.228	S	C	.	.			trans	-118.4	109.5	-177.3	-176.8	0	0	0	0	110.5	A74 S78 R80	A74-V76 VanDerWaalsContact C-N 3.35Å; A74-V76 PolarHBondContact O-N 3.45Å; V76-S78 WeakPolarHBondContact CG1-OG 3.43Å; V76-R80 VanDerWaalsContact O-CD 3.31Å; V76-R80 WeakPolarHBondContact O-CD 3.26Å; V76-R80 PolarHBondContact O-NH1 3.26Å
77	L	81.4	Confident	84.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.223	C	C	.	.			trans	-103.7	-3.3	179.1	-53.8	171.4	0	0	0	113.5	A74 R79 R80 V82 A97 Q100 A102	A74-L77 HydrophobicContact CB-CD2 3.98Å; L77-R79 PolarHBondContact O-N 2.74Å; L77-R80 PolarHBondContact O-N 2.88Å; L77-R80 VanDerWaalsContact O-N 3.17Å; L77-V82 HydrophobicContact CB-CG2 4.11Å; L77-V82 HydrophobicContact CD1-CG2 4.36Å; L77-V82 HydrophobicContact CD2-CG2 3.93Å; L77-V82 HydrophobicContact CG-CG2 4.35Å; L77-A97 HydrophobicContact CD1-CB 4.25Å; L77-Q100 HydrophobicContact CB-CB 4.22Å; L77-A102 WeakPolarHBondContact O-CA 3.48Å
78	S	84.6	Confident	84.3	Confident	59 Å²	59	47.8 Å²	47.8	41%	0.413	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-58.1	127.7	-176.6	63.6	0	0	0	0	112.1	V76 R80 Q100	V76-S78 WeakPolarHBondContact CG1-OG 3.43Å; S78-R80 PolarHBondContact O-N 2.58Å; S78-Q100 WeakPolarHBondContact CA-O 3.34Å
79	R	83.4	Confident	84.3	Confident	210 Å²	210	45.7 Å²	45.7	79%	0.792	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	25	-179.5	-55.2	-178.4	177.3	-175.4	-1.3	114.8	T67 L77 S101	T67-R79 VanDerWaalsContact CB-O 3.25Å; T67-R79 WeakPolarHBondContact CB-O 3.46Å; T67-R79 WeakPolarHBondContact CG2-O 3.42Å; L77-R79 PolarHBondContact O-N 2.74Å; R79-S101 PolarHBondContact N-O 3.13Å; R79-S101 VanDerWaalsContact N-O 3.11Å
80	R	87.9	Confident	84.4	Confident	60 Å²	60	47.5 Å²	47.5	23%	0.226	24%	0.235	C	C	.	.	S	Bend	trans	-114.5	149.8	174.9	-71.3	159.6	164	-169.7	0.3	110.2	E68 R70 V76 L77 S78 V82 G103	E68-R80 CarbonylContact O-C 3.55Å; E68-R80 WeakPolarHBondContact O-CA 3.25Å; E68-R80 WeakPolarHBondContact O-CB 3.24Å; R70-R80 HydrophobicContact CB-CB 4.44Å; R70-R80 HydrophobicContact CG-CB 4.31Å; R70-R80 HydrophobicContact CG-CG 4.24Å; V76-R80 VanDerWaalsContact O-CD 3.31Å; V76-R80 WeakPolarHBondContact O-CD 3.26Å; V76-R80 PolarHBondContact O-NH1 3.26Å; L77-R80 PolarHBondContact O-N 2.88Å; L77-R80 VanDerWaalsContact O-N 3.17Å; S78-R80 PolarHBondContact O-N 2.58Å; R80-V82 PolarHBondContact O-N 3.49Å; R80-G103 PolarHBondContact O-N 3.42Å
81	C	89.4	Confident	84.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.9	173.9	176.3	0	0	0	0	108.8	L65 T67 E68 A69 R70 A104 V106 M183	L65-C81 HydrophobicContact CD1-CB 4.41Å; L65-C81 HydrophobicContact CD2-CB 4.15Å; T67-C81 WeakPolarHBondContact OG1-CB 3.24Å; T67-C81 PolarHBondContact OG1-N 3.07Å; E68-C81 PolarHBondContact O-N 3.29Å; A69-C81 CarbonylContact C-O 3.55Å; A69-C81 VanDerWaalsContact CA-O 3.28Å; A69-C81 WeakPolarHBondContact CA-O 3.5Å; R70-C81 PolarHBondContact N-O 2.82Å; R70-C81 VanDerWaalsContact O-O 3.09Å; C81-A104 WeakPolarHBondContact CA-O 2.98Å; C81-A104 HydrophobicContact CB-CB 4.48Å; C81-V106 VanDerWaalsContact SG-CG2 3.55Å; C81-M183 HydrophobicContact CB-CB 4.39Å; C81-M183 HydrophobicContact CB-CG 4.47Å
82	V	91.2	Very high	84.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	117.1	-179.5	-175.5	0	0	0	0	109.4	R70 V72 L77 R80 M84 A97 A102 A104 V105 V106	R70-V82 CarbonylContact O-C 3.58Å; R70-V82 VanDerWaalsContact O-CA 3.27Å; R70-V82 WeakPolarHBondContact O-CA 3.43Å; V72-V82 HydrophobicContact CB-CG1 4.43Å; V72-V82 HydrophobicContact CG2-CG1 3.6Å; L77-V82 HydrophobicContact CB-CG2 4.11Å; L77-V82 HydrophobicContact CD1-CG2 4.36Å; L77-V82 HydrophobicContact CD2-CG2 3.93Å; L77-V82 HydrophobicContact CG-CG2 4.35Å; R80-V82 PolarHBondContact O-N 3.49Å; V82-M84 HydrophobicContact CG1-CE 4.07Å; V82-A97 HydrophobicContact CG2-CB 4.31Å; V82-A102 HydrophobicContact CG2-CB 3.83Å; V82-A104 PolarHBondContact N-O 3.38Å; V82-V105 CarbonylContact O-C 3.52Å; V82-V105 WeakPolarHBondContact O-CA 3.14Å; V82-V106 PolarHBondContact O-N 3.38Å
83	I	91.7	Very high	85	Confident	2 Å²	2	57 Å²	57	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.7	174.4	-54.1	175.7	0	0	0	108.6	A69 R70 V106 I108 I152 Y153 M183	A69-I83 HydrophobicContact CB-CD1 3.81Å; A69-I83 HydrophobicContact CB-CG1 4.39Å; R70-I83 PolarHBondContact O-N 3.07Å; I83-V106 WeakPolarHBondContact CA-O 3.44Å; I83-I108 HydrophobicContact CG2-CD1 3.48Å; I83-I108 VanDerWaalsContact CG2-CD1 3.48Å; I83-I108 HydrophobicContact CG2-CG1 4.01Å; I83-I152 HydrophobicContact CD1-CG2 4.46Å; I83-Y153 HydrophobicContact CB-CD2 4.23Å; I83-Y153 HydrophobicContact CG2-CD2 3.69Å; I83-Y153 HydrophobicContact CG2-CE2 4.4Å; I83-M183 HydrophobicContact CD1-CE 3.78Å
84	M	90.8	Very high	85.6	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.4	176.6	55.4	-175.8	60.1	0	0	110	V72 V82 F89 V105 V106 I107 I108	V72-M84 HydrophobicContact CG2-CB 4Å; V72-M84 HydrophobicContact CG2-CE 3.85Å; V82-M84 HydrophobicContact CG1-CE 4.07Å; M84-F89 HydrophobicContact SD-CD2 3.58Å; M84-F89 VanDerWaalsContact SD-CD2 3.58Å; M84-F89 HydrophobicContact SD-CE2 3.76Å; M84-V105 HydrophobicContact CE-CG1 3.48Å; M84-V105 VanDerWaalsContact CE-CG1 3.48Å; M84-V105 HydrophobicContact CG-CG1 4.19Å; M84-V105 HydrophobicContact SD-CG1 3.63Å; M84-V106 PolarHBondContact N-O 2.88Å; M84-I107 HydrophobicContact CG-CB 4.34Å; M84-I107 HydrophobicContact CG-CG1 3.66Å; M84-I107 CarbonylContact O-C 3.55Å; M84-I107 WeakPolarHBondContact O-CA 3.47Å; M84-I107 HydrophobicContact SD-CD1 4.26Å; M84-I107 HydrophobicContact SD-CG1 3.67Å; M84-I108 PolarHBondContact O-N 2.86Å
85	R	90.8	Very high	86.3	Confident	82 Å²	82	53.3 Å²	53.3	31%	0.309	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	147.3	169.2	-65.5	-173.6	-58.8	167.3	1.4	109.5	A87 D88 F89 I108 Y153	R85-A87 PolarHBondContact O-N 3.36Å; R85-D88 IonicContact CZ-OD2 2.76Å; R85-D88 VanDerWaalsContact CZ-OD2 3.25Å; R85-D88 IonicContact NE-OD2 3.25Å; R85-D88 PolarHBondContact NE-OD2 3.04Å; R85-D88 IonicContact NH2-OD1 2.79Å; R85-D88 PolarHBondContact NH2-OD1 3.2Å; R85-D88 IonicContact NH2-OD2 3.28Å; R85-D88 PolarHBondContact NH2-OD2 3.37Å; R85-D88 CarbonylContact O-C 3.54Å; R85-D88 PolarHBondContact O-N 2.68Å; R85-F89 PolarHBondContact O-N 3.42Å; R85-F89 VanDerWaalsContact O-N 3.15Å; R85-I108 HydrophobicContact CG-CB 4.5Å; R85-I108 HydrophobicContact CG-CD1 4.5Å; R85-Y153 HydrophobicContact CG-CD1 4.07Å; R85-Y153 HydrophobicContact CG-CE1 3.78Å; R85-Y153 HydrophobicContact CG-CE2 4.32Å; R85-Y153 HydrophobicContact CG-CG 4.45Å; R85-Y153 VanDerWaalsContact NE-CE1 3.3Å
86	L	88.1	Confident	87.1	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.016	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-57.2	-37	174.5	-175	71.6	0	0	0	112.4	D88 F89 I107 I108 L109 P110 M113 M116 F124 M397	L86-D88 PolarHBondContact O-N 3.39Å; L86-F89 WeakPolarHBondContact O-CB 3.35Å; L86-F89 PolarHBondContact O-N 3.26Å; L86-F89 VanDerWaalsContact O-N 3.14Å; L86-I107 HydrophobicContact CD1-CG2 4.43Å; L86-I108 WeakPolarHBondContact CB-O 3.45Å; L86-I108 PolarHBondContact N-O 2.88Å; L86-L109 HydrophobicContact CB-CD2 4.36Å; L86-L109 HydrophobicContact CD1-CD2 4.1Å; L86-L109 HydrophobicContact CD2-CD2 3.97Å; L86-L109 HydrophobicContact CG-CD2 4.37Å; L86-P110 HydrophobicContact CD2-CG 4.3Å; L86-M113 HydrophobicContact CD2-SD 3.91Å; L86-M116 HydrophobicContact CD2-CE 4.18Å; L86-M116 HydrophobicContact CG-CE 4.41Å; L86-F124 HydrophobicContact CD1-CB 4.48Å; L86-F124 HydrophobicContact CD1-CD1 4.25Å; L86-F124 HydrophobicContact CD1-CD2 3.42Å; L86-F124 VanDerWaalsContact CD1-CD2 3.42Å; L86-F124 HydrophobicContact CD1-CE1 4.32Å; L86-F124 HydrophobicContact CD1-CE2 3.54Å; L86-F124 HydrophobicContact CD1-CG 3.79Å; L86-F124 HydrophobicContact CD1-CZ 3.99Å; L86-M397 HydrophobicContact CD1-CE 4.27Å; L86-M397 HydrophobicContact CD2-CE 3.4Å; L86-M397 HydrophobicContact CG-CE 4.39Å
87	A	84.9	Confident	87.5	Confident	51 Å²	51	46 Å²	46	42%	0.421	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-64.3	-28.6	177.7	0	0	0	0	0	113.7	R85 M116	R85-A87 PolarHBondContact O-N 3.36Å; A87-M116 HydrophobicContact CB-CE 4.23Å
88	D	83.1	Confident	87.8	Confident	64 Å²	64	46.9 Å²	46.9	34%	0.342	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-98.4	6.4	178.8	-54.7	-34.5	0	0	0	111.2	R85 L86 S90 Q93 Y153	R85-D88 IonicContact CZ-OD2 2.76Å; R85-D88 VanDerWaalsContact CZ-OD2 3.25Å; R85-D88 IonicContact NE-OD2 3.25Å; R85-D88 PolarHBondContact NE-OD2 3.04Å; R85-D88 IonicContact NH2-OD1 2.79Å; R85-D88 PolarHBondContact NH2-OD1 3.2Å; R85-D88 IonicContact NH2-OD2 3.28Å; R85-D88 PolarHBondContact NH2-OD2 3.37Å; R85-D88 CarbonylContact O-C 3.54Å; R85-D88 PolarHBondContact O-N 2.68Å; L86-D88 PolarHBondContact O-N 3.39Å; D88-S90 PolarHBondContact O-N 2.91Å; D88-Q93 PolarHBondContact O-OE1 3.45Å; D88-Y153 PolarHBondContact OD2-OH 3.07Å
89	F	85.3	Confident	88	Confident	20 Å²	20	52.5 Å²	52.5	9%	0.088	24%	0.238	C	C	.	.			trans	-71.7	129.3	-172.4	-177	-101	0	0	0	111.4	M84 R85 L86 Y94 I107 F124 L127 M131	M84-F89 HydrophobicContact SD-CD2 3.58Å; M84-F89 VanDerWaalsContact SD-CD2 3.58Å; M84-F89 HydrophobicContact SD-CE2 3.76Å; R85-F89 PolarHBondContact O-N 3.42Å; R85-F89 VanDerWaalsContact O-N 3.15Å; L86-F89 WeakPolarHBondContact O-CB 3.35Å; L86-F89 PolarHBondContact O-N 3.26Å; L86-F89 VanDerWaalsContact O-N 3.14Å; F89-Y94 HydrophobicContact CE2-CD2 4.35Å; F89-Y94 HydrophobicContact CE2-CG 4.27Å; F89-Y94 HydrophobicContact CZ-CG 4.33Å; F89-I107 HydrophobicContact CD2-CD1 4.35Å; F89-I107 HydrophobicContact CE2-CD1 3.89Å; F89-F124 AromaticContact CD1-CD2 3.89Å; F89-F124 HydrophobicContact CD1-CD2 3.89Å; F89-F124 HydrophobicContact CD1-CE2 4.34Å; F89-F124 AromaticContact CE1-CD2 3.96Å; F89-F124 HydrophobicContact CE1-CD2 3.96Å; F89-F124 HydrophobicContact CE1-CE2 4.18Å; F89-L127 HydrophobicContact CD1-CD1 4.23Å; F89-L127 HydrophobicContact CE1-CB 4.48Å; F89-L127 HydrophobicContact CE1-CD1 3.75Å; F89-M131 HydrophobicContact CE1-SD 4.24Å; F89-M131 HydrophobicContact CZ-CE 4.14Å; F89-M131 HydrophobicContact CZ-SD 3.63Å
90	S	86.8	Confident	88.3	Confident	40 Å²	40	45.4 Å²	45.4	28%	0.28	21%	0.214	S	C	.	.			trans	-137.2	139.9	171.4	171.8	0	0	0	0	109.8	D88 D92 Q93 Y94	D88-S90 PolarHBondContact O-N 2.91Å; S90-D92 VanDerWaalsContact C-N 3.26Å; S90-D92 PolarHBondContact O-N 3.24Å; S90-D92 PolarHBondContact OG-N 3.2Å; S90-Q93 WeakPolarHBondContact O-CB 3.09Å; S90-Q93 PolarHBondContact O-N 3.38Å; S90-Y94 PolarHBondContact O-N 2.99Å
91	Y	87.1	Confident	88.2	Confident	61 Å²	61	46.4 Å²	46.4	24%	0.239	23%	0.23	C	C	.	.	H	α-helix	trans	-60.5	-35.6	179.3	-172.4	-111.9	0	0	0	112.8	Y94 Q95 L127	Y91-Y94 HydrophobicContact CD2-CD1 4.26Å; Y91-Y94 HydrophobicContact CE2-CD1 4.25Å; Y91-Y94 PolarHBondContact O-N 2.66Å; Y91-Q95 WeakPolarHBondContact O-CB 3.21Å; Y91-Q95 PolarHBondContact O-N 3.11Å; Y91-L127 HydrophobicContact CD2-CD2 3.83Å; Y91-L127 HydrophobicContact CG-CD2 3.76Å
92	D	88.2	Confident	88.2	Confident	104 Å²	104	46.7 Å²	46.7	56%	0.556	23%	0.233	S	C	*	.	H	α-helix	trans	-65.8	-41.4	177.5	-177.9	59.7	0	0	0	111.7	S90 Q95 K96	S90-D92 VanDerWaalsContact C-N 3.26Å; S90-D92 PolarHBondContact O-N 3.24Å; S90-D92 PolarHBondContact OG-N 3.2Å; D92-Q95 PolarHBondContact O-N 3.45Å; D92-K96 VanDerWaalsContact O-CB 3.31Å; D92-K96 WeakPolarHBondContact O-CB 3.15Å; D92-K96 PolarHBondContact O-N 3.14Å
93	Q	86.9	Confident	88	Confident	71 Å²	71	47.6 Å²	47.6	33%	0.332	24%	0.242	S	C	.	.	H	α-helix	trans	-64.5	-43	175.7	-74	-175.2	12.8	0	0	112	V72 D88 S90 K96 A97	V72-Q93 HydrophobicContact CG1-CB 3.75Å; V72-Q93 HydrophobicContact CG1-CG 3.81Å; D88-Q93 PolarHBondContact O-OE1 3.45Å; S90-Q93 WeakPolarHBondContact O-CB 3.09Å; S90-Q93 PolarHBondContact O-N 3.38Å; Q93-K96 PolarHBondContact O-N 3.46Å; Q93-A97 PolarHBondContact O-N 3.31Å
94	Y	89	Confident	88	Confident	1 Å²	1	47.5 Å²	47.5	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-48.2	174.1	174.3	-109.1	0	0	0	111.3	F89 S90 Y91 K96 A97 L98 V105 M131 V140	F89-Y94 HydrophobicContact CE2-CD2 4.35Å; F89-Y94 HydrophobicContact CE2-CG 4.27Å; F89-Y94 HydrophobicContact CZ-CG 4.33Å; S90-Y94 PolarHBondContact O-N 2.99Å; Y91-Y94 HydrophobicContact CD2-CD1 4.26Å; Y91-Y94 HydrophobicContact CE2-CD1 4.25Å; Y91-Y94 PolarHBondContact O-N 2.66Å; Y94-K96 VanDerWaalsContact C-N 3.31Å; Y94-K96 PolarHBondContact O-N 2.77Å; Y94-A97 WeakPolarHBondContact O-CB 3.46Å; Y94-A97 PolarHBondContact O-N 3.5Å; Y94-A97 VanDerWaalsContact O-N 3.16Å; Y94-L98 HydrophobicContact CD1-CD1 4.04Å; Y94-L98 HydrophobicContact CE1-CD1 3.45Å; Y94-L98 VanDerWaalsContact CE1-CD1 3.45Å; Y94-L98 HydrophobicContact CE1-CG 4.32Å; Y94-L98 HydrophobicContact CE2-CD1 4.22Å; Y94-L98 HydrophobicContact CE2-CD2 4.43Å; Y94-L98 HydrophobicContact CE2-CG 4.3Å; Y94-L98 WeakPolarHBondContact O-CG 3.39Å; Y94-L98 PolarHBondContact O-N 2.61Å; Y94-V105 HydrophobicContact CD2-CG1 4.38Å; Y94-M131 HydrophobicContact CD1-CG 4.37Å; Y94-M131 HydrophobicContact CD2-CE 4.38Å; Y94-M131 HydrophobicContact CE1-CE 4.15Å; Y94-M131 HydrophobicContact CE1-CG 3.94Å; Y94-M131 HydrophobicContact CE2-CE 3.93Å; Y94-V140 HydrophobicContact CE2-CG1 4.46Å; Y94-V140 HydrophobicContact CE2-CG2 3.92Å
95	Q	89.5	Confident	88.1	Confident	50 Å²	50	47.4 Å²	47.4	23%	0.234	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-36.3	178.3	-164.2	179.2	27	0	0	112	Y91 D92 L98 R99	Y91-Q95 WeakPolarHBondContact O-CB 3.21Å; Y91-Q95 PolarHBondContact O-N 3.11Å; D92-Q95 PolarHBondContact O-N 3.45Å; Q95-L98 PolarHBondContact O-N 2.99Å; Q95-R99 WeakPolarHBondContact O-CB 3.46Å; Q95-R99 VanDerWaalsContact O-CG 3.3Å; Q95-R99 WeakPolarHBondContact O-CG 3.39Å; Q95-R99 PolarHBondContact O-N 2.79Å; Q95-R99 VanDerWaalsContact OE1-NH2 3.14Å
96	K	88.9	Confident	88.3	Confident	85 Å²	85	43.6 Å²	43.6	37%	0.37	23%	0.227	S	C	.	.	H	α-helix	trans	-61.4	-45.6	173	-176	-174.2	176.6	-167.6	0	111.3	D92 Q93 Y94 L98 R99 Q100	D92-K96 VanDerWaalsContact O-CB 3.31Å; D92-K96 WeakPolarHBondContact O-CB 3.15Å; D92-K96 PolarHBondContact O-N 3.14Å; Q93-K96 PolarHBondContact O-N 3.46Å; Y94-K96 VanDerWaalsContact C-N 3.31Å; Y94-K96 PolarHBondContact O-N 2.77Å; K96-L98 VanDerWaalsContact C-N 3.31Å; K96-L98 PolarHBondContact O-N 2.91Å; K96-R99 PolarHBondContact O-N 3.04Å; K96-Q100 WeakPolarHBondContact O-CG 3.21Å; K96-Q100 PolarHBondContact O-N 2.66Å
97	A	87.8	Confident	88.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-41.1	177	0	0	0	0	0	111.8	L77 V82 Q93 Y94 A102 V105	L77-A97 HydrophobicContact CD1-CB 4.25Å; V82-A97 HydrophobicContact CG2-CB 4.31Å; Q93-A97 PolarHBondContact O-N 3.31Å; Y94-A97 WeakPolarHBondContact O-CB 3.46Å; Y94-A97 PolarHBondContact O-N 3.5Å; Y94-A97 VanDerWaalsContact O-N 3.16Å; A97-A102 HydrophobicContact CB-CB 4.45Å; A97-A102 VanDerWaalsContact O-CB 3.3Å; A97-A102 WeakPolarHBondContact O-CB 3.44Å; A97-A102 PolarHBondContact O-N 3.03Å; A97-A102 VanDerWaalsContact O-N 3.14Å; A97-V105 HydrophobicContact CB-CG2 4.24Å
98	L	88.6	Confident	88.9	Confident	19 Å²	19	41 Å²	41	10%	0.099	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-46.2	175.2	-66.6	178.5	0	0	0	112.5	Y94 Q95 K96 Q100 S101 M134 T136 V138	Y94-L98 HydrophobicContact CD1-CD1 4.04Å; Y94-L98 HydrophobicContact CE1-CD1 3.45Å; Y94-L98 VanDerWaalsContact CE1-CD1 3.45Å; Y94-L98 HydrophobicContact CE1-CG 4.32Å; Y94-L98 HydrophobicContact CE2-CD1 4.22Å; Y94-L98 HydrophobicContact CE2-CD2 4.43Å; Y94-L98 HydrophobicContact CE2-CG 4.3Å; Y94-L98 WeakPolarHBondContact O-CG 3.39Å; Y94-L98 PolarHBondContact O-N 2.61Å; Q95-L98 PolarHBondContact O-N 2.99Å; K96-L98 VanDerWaalsContact C-N 3.31Å; K96-L98 PolarHBondContact O-N 2.91Å; L98-Q100 VanDerWaalsContact C-N 3.28Å; L98-Q100 PolarHBondContact O-N 2.77Å; L98-S101 PolarHBondContact O-N 3.45Å; L98-M134 HydrophobicContact CD1-CE 4.13Å; L98-M134 HydrophobicContact CD1-SD 3.97Å; L98-T136 HydrophobicContact CD1-CG2 3.71Å; L98-T136 HydrophobicContact CD2-CG2 4.04Å; L98-V138 HydrophobicContact CD2-CB 3.82Å; L98-V138 HydrophobicContact CD2-CG1 4.3Å; L98-V138 HydrophobicContact CD2-CG2 4.1Å
99	R	89.1	Confident	89.3	Confident	176 Å²	176	38.2 Å²	38.2	66%	0.664	19%	0.191	S	C	*	.	H	α-helix	trans	-61.1	-36	179.1	-75.8	177.6	-173.6	168.6	7.4	112.6	Q95 K96 S101	Q95-R99 WeakPolarHBondContact O-CB 3.46Å; Q95-R99 VanDerWaalsContact O-CG 3.3Å; Q95-R99 WeakPolarHBondContact O-CG 3.39Å; Q95-R99 PolarHBondContact O-N 2.79Å; Q95-R99 VanDerWaalsContact OE1-NH2 3.14Å; K96-R99 PolarHBondContact O-N 3.04Å; R99-S101 PolarHBondContact O-N 3.18Å
100	Q	89.5	Confident	89.4	Confident	61 Å²	61	38 Å²	38	29%	0.285	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	4.6	176.8	-68.3	-167.2	-3.9	0	0	113.8	E75 L77 S78 K96 L98	E75-Q100 PolarHBondContact O-NE2 2.7Å; L77-Q100 HydrophobicContact CB-CB 4.22Å; S78-Q100 WeakPolarHBondContact CA-O 3.34Å; K96-Q100 WeakPolarHBondContact O-CG 3.21Å; K96-Q100 PolarHBondContact O-N 2.66Å; L98-Q100 VanDerWaalsContact C-N 3.28Å; L98-Q100 PolarHBondContact O-N 2.77Å
101	S	86.6	Confident	89	Confident	82 Å²	82	42.5 Å²	42.5	57%	0.573	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	55	-177.4	-58.6	0	0	0	0	111.9	R79 L98 R99	R79-S101 PolarHBondContact N-O 3.13Å; R79-S101 VanDerWaalsContact N-O 3.11Å; L98-S101 PolarHBondContact O-N 3.45Å; R99-S101 PolarHBondContact O-N 3.18Å
102	A	89	Confident	88.5	Confident	6 Å²	6	45.3 Å²	45.3	5%	0.05	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-53.2	148.9	169.2	0	0	0	0	0	111.4	L77 V82 A97 V138	L77-A102 WeakPolarHBondContact O-CA 3.48Å; V82-A102 HydrophobicContact CG2-CB 3.83Å; A97-A102 HydrophobicContact CB-CB 4.45Å; A97-A102 VanDerWaalsContact O-CB 3.3Å; A97-A102 WeakPolarHBondContact O-CB 3.44Å; A97-A102 PolarHBondContact O-N 3.03Å; A97-A102 VanDerWaalsContact O-N 3.14Å; A102-V138 HydrophobicContact CB-CG1 4.38Å; A102-V138 WeakPolarHBondContact O-CG1 3.46Å; A102-V138 WeakPolarHBondContact O-CG2 3.49Å
103	G	87.3	Confident	87.6	Confident	19 Å²	19	41.8 Å²	41.8	20%	0.196	21%	0.206	C	C	.	.	S	Bend	trans	-70.1	-37.2	177.5	0	0	0	0	0	112.6	R80 P139	R80-G103 PolarHBondContact O-N 3.42Å; G103-P139 VanDerWaalsContact O-CD 3.3Å; G103-P139 WeakPolarHBondContact O-CD 3.39Å
104	A	91.8	Very high	86.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	166	170	0	0	0	0	0	109.8	L65 C81 V82 P139 Y141	L65-A104 HydrophobicContact CD1-CB 3.38Å; L65-A104 HydrophobicContact CD2-CB 3.7Å; L65-A104 HydrophobicContact CG-CB 4.08Å; C81-A104 WeakPolarHBondContact CA-O 2.98Å; C81-A104 HydrophobicContact CB-CB 4.48Å; V82-A104 PolarHBondContact N-O 3.38Å; A104-P139 CarbonylContact C-O 3.48Å; A104-P139 WeakPolarHBondContact CA-O 3.43Å; A104-P139 HydrophobicContact CB-CG 3.84Å; A104-Y141 HydrophobicContact CB-CD2 4.44Å; A104-Y141 HydrophobicContact CB-CE2 4.46Å
105	V	93	Very high	85.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127	166.5	-179.1	0	0	0	0	108.4	V82 M84 Y94 A97 I107 V138 P139 V140 Y141	V82-V105 CarbonylContact O-C 3.52Å; V82-V105 WeakPolarHBondContact O-CA 3.14Å; M84-V105 HydrophobicContact CE-CG1 3.48Å; M84-V105 VanDerWaalsContact CE-CG1 3.48Å; M84-V105 HydrophobicContact CG-CG1 4.19Å; M84-V105 HydrophobicContact SD-CG1 3.63Å; Y94-V105 HydrophobicContact CD2-CG1 4.38Å; A97-V105 HydrophobicContact CB-CG2 4.24Å; V105-I107 HydrophobicContact CG1-CG1 4.19Å; V105-V138 HydrophobicContact CG2-CG1 4.29Å; V105-P139 PolarHBondContact N-O 3.06Å; V105-V140 HydrophobicContact CB-CG1 4.41Å; V105-V140 HydrophobicContact CB-CG2 4.31Å; V105-V140 CarbonylContact O-C 3.57Å; V105-V140 WeakPolarHBondContact O-CA 3.32Å; V105-Y141 PolarHBondContact O-N 3.23Å
106	V	93.6	Very high	85.2	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	114.7	175.1	179.3	0	0	0	0	108.1	C81 V82 I83 M84 Y141 A143 M527	C81-V106 VanDerWaalsContact SG-CG2 3.55Å; V82-V106 PolarHBondContact O-N 3.38Å; I83-V106 WeakPolarHBondContact CA-O 3.44Å; M84-V106 PolarHBondContact N-O 2.88Å; V106-Y141 CarbonylContact C-O 3.49Å; V106-Y141 WeakPolarHBondContact CA-O 3.48Å; V106-A143 HydrophobicContact CG1-CB 4.27Å; V106-M527 HydrophobicContact CG2-CE 3.99Å; V106-M527 HydrophobicContact CG2-SD 4.13Å
107	I	93.7	Very high	84.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119	176.2	-60.4	168.1	0	0	0	108.1	M84 L86 F89 V105 L109 M131 V140 Y141 F142 A143	M84-I107 HydrophobicContact CG-CB 4.34Å; M84-I107 HydrophobicContact CG-CG1 3.66Å; M84-I107 CarbonylContact O-C 3.55Å; M84-I107 WeakPolarHBondContact O-CA 3.47Å; M84-I107 HydrophobicContact SD-CD1 4.26Å; M84-I107 HydrophobicContact SD-CG1 3.67Å; L86-I107 HydrophobicContact CD1-CG2 4.43Å; F89-I107 HydrophobicContact CD2-CD1 4.35Å; F89-I107 HydrophobicContact CE2-CD1 3.89Å; V105-I107 HydrophobicContact CG1-CG1 4.19Å; I107-L109 HydrophobicContact CG2-CD2 4.27Å; I107-M131 HydrophobicContact CD1-CE 3.96Å; I107-V140 HydrophobicContact CD1-CG1 3.96Å; I107-Y141 PolarHBondContact N-O 3.19Å; I107-F142 HydrophobicContact CB-CD1 3.79Å; I107-F142 HydrophobicContact CB-CE1 3.89Å; I107-F142 HydrophobicContact CD1-CD1 4.28Å; I107-F142 HydrophobicContact CD1-CE1 3.51Å; I107-F142 HydrophobicContact CD1-CZ 3.8Å; I107-F142 HydrophobicContact CG1-CE1 4.26Å; I107-F142 HydrophobicContact CG2-CD1 4.01Å; I107-F142 HydrophobicContact CG2-CE1 4.04Å; I107-F142 WeakPolarHBondContact O-CA 3.33Å; I107-A143 PolarHBondContact O-N 2.99Å
108	I	92.8	Very high	84.4	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	122	177.5	-57.2	175.4	0	0	0	108.7	I83 M84 R85 L86 A143 E145 L149	I83-I108 HydrophobicContact CG2-CD1 3.48Å; I83-I108 VanDerWaalsContact CG2-CD1 3.48Å; I83-I108 HydrophobicContact CG2-CG1 4.01Å; M84-I108 PolarHBondContact O-N 2.86Å; R85-I108 HydrophobicContact CG-CB 4.5Å; R85-I108 HydrophobicContact CG-CD1 4.5Å; L86-I108 WeakPolarHBondContact CB-O 3.45Å; L86-I108 PolarHBondContact N-O 2.88Å; I108-A143 CarbonylContact C-O 3.49Å; I108-A143 WeakPolarHBondContact CA-O 3.5Å; I108-E145 HydrophobicContact CG2-CB 4.26Å; I108-E145 HydrophobicContact CG2-CG 3.34Å; I108-L149 HydrophobicContact CD1-CD2 3.98Å; I108-L149 HydrophobicContact CD1-CG 3.86Å; I108-L149 HydrophobicContact CG1-CD2 3.9Å; I108-L149 HydrophobicContact CG1-CG 4.33Å; I108-L149 HydrophobicContact CG2-CD2 4.29Å
109	L	91.2	Very high	84.1	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.1	-178.2	-64.3	176.9	0	0	0	111	L86 I107 M113 F142 A143 E144 E145 L231 I396	L86-L109 HydrophobicContact CB-CD2 4.36Å; L86-L109 HydrophobicContact CD1-CD2 4.1Å; L86-L109 HydrophobicContact CD2-CD2 3.97Å; L86-L109 HydrophobicContact CG-CD2 4.37Å; I107-L109 HydrophobicContact CG2-CD2 4.27Å; L109-M113 HydrophobicContact CB-CE 4.2Å; L109-M113 HydrophobicContact CD2-CE 4.26Å; L109-F142 HydrophobicContact CD1-CB 3.85Å; L109-F142 HydrophobicContact CD1-CD1 3.98Å; L109-F142 HydrophobicContact CD1-CG 4.31Å; L109-F142 HydrophobicContact CD2-CD1 4.11Å; L109-F142 HydrophobicContact CG-CB 4.42Å; L109-F142 HydrophobicContact CG-CD1 4.13Å; L109-A143 PolarHBondContact N-O 3.24Å; L109-E144 CarbonylContact O-C 3.54Å; L109-E145 WeakPolarHBondContact O-CG 3.48Å; L109-E145 PolarHBondContact O-N 2.85Å; L109-L231 HydrophobicContact CD1-CD1 3.39Å; L109-I396 HydrophobicContact CD1-CD1 3.89Å; L109-I396 HydrophobicContact CD2-CD1 4.3Å
110	P	87	Confident	83.9	Confident	15 Å²	15	47.1 Å²	47.1	10%	0.097	27%	0.27	C	S	.	.			trans	-66.6	144.2	178.8	29.4	-34.9	0	0	0	112.4	L86 N112 M113 M116 E145	L86-P110 HydrophobicContact CD2-CG 4.3Å; P110-N112 PolarHBondContact O-N 3.19Å; P110-M113 HydrophobicContact CG-SD 3.81Å; P110-M116 HydrophobicContact CG-CG 3.65Å; P110-M116 HydrophobicContact CG-SD 3.88Å; P110-E145 WeakPolarHBondContact CA-OE2 3.43Å
111	K	79.3	Confident	83.7	Confident	135 Å²	135	44.4 Å²	44.4	59%	0.587	26%	0.258	S	S	*	.	S	Bend	trans	-57.7	-40.5	177.1	-67.2	-172.9	-175.3	178.5	0	111.8	E145	K111-E145 WeakPolarHBondContact CE-O 3.25Å; K111-E145 HydrophobicContact CG-CB 4.39Å
112	N	75.1	Confident	83.6	Confident	120 Å²	120	45.6 Å²	45.6	64%	0.642	25%	0.254	S	S	*	.			trans	-106.1	91.7	177.5	-73.6	-25.3	0	0	0	110.1	P110 S114 A115	P110-N112 PolarHBondContact O-N 3.19Å; N112-S114 PolarHBondContact O-N 2.86Å; N112-A115 HydrophobicContact CB-CB 4.02Å; N112-A115 WeakPolarHBondContact O-CB 3.35Å; N112-A115 PolarHBondContact O-N 3.33Å; N112-A115 VanDerWaalsContact O-N 3.13Å
113	M	70.6	Confident	83.5	Confident	30 Å²	30	50 Å²	50	15%	0.148	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-61.1	-32.5	178	-153.5	63.6	74.3	0	0	112.6	L86 L109 P110 A115 M116 M397	L86-M113 HydrophobicContact CD2-SD 3.91Å; L109-M113 HydrophobicContact CB-CE 4.2Å; L109-M113 HydrophobicContact CD2-CE 4.26Å; P110-M113 HydrophobicContact CG-SD 3.81Å; M113-A115 PolarHBondContact O-N 2.9Å; M113-M116 WeakPolarHBondContact O-CB 3.28Å; M113-M116 PolarHBondContact O-N 2.66Å; M113-M397 HydrophobicContact CE-CE 4.23Å; M113-M397 HydrophobicContact CE-SD 3.66Å; M113-M397 HydrophobicContact CG-CE 4.16Å; M113-M397 HydrophobicContact CG-SD 3.42Å; M113-M397 WeakPolarHBondContact CG-SD 3.41Å; M113-M397 HydrophobicContact SD-CE 3.46Å; M113-M397 WeakPolarHBondContact SD-CE 3.44Å; M113-M397 HydrophobicContact SD-SD 3.34Å
114	S	66.6	Low	83.6	Confident	52 Å²	52	49.2 Å²	49.2	36%	0.364	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-70	-12.5	178.9	-50.6	0	0	0	0	114.7	N112 A415	N112-S114 PolarHBondContact O-N 2.86Å; S114-A415 WeakPolarHBondContact O-CB 3.34Å; S114-A415 PolarHBondContact O-N 3Å
115	A	71.9	Confident	83.4	Confident	81 Å²	81	49.8 Å²	49.8	67%	0.669	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-88.3	-6.5	177.2	0	0	0	0	0	112.8	N112 M113	N112-A115 HydrophobicContact CB-CB 4.02Å; N112-A115 WeakPolarHBondContact O-CB 3.35Å; N112-A115 PolarHBondContact O-N 3.33Å; N112-A115 VanDerWaalsContact O-N 3.13Å; M113-A115 PolarHBondContact O-N 2.9Å
116	M	75.5	Confident	83.2	Confident	23 Å²	23	54.8 Å²	54.8	11%	0.113	29%	0.291	C	S	.	.	S	Bend	trans	-75	147	178.5	-73.2	-70.7	-72	0	0	111.5	L86 A87 P110 M113 Q118 I120 V121 A415	L86-M116 HydrophobicContact CD2-CE 4.18Å; L86-M116 HydrophobicContact CG-CE 4.41Å; A87-M116 HydrophobicContact CB-CE 4.23Å; P110-M116 HydrophobicContact CG-CG 3.65Å; P110-M116 HydrophobicContact CG-SD 3.88Å; M113-M116 WeakPolarHBondContact O-CB 3.28Å; M113-M116 PolarHBondContact O-N 2.66Å; M116-Q118 PolarHBondContact O-N 2.87Å; M116-I120 HydrophobicContact CE-CB 4.24Å; M116-I120 HydrophobicContact CE-CD1 4.19Å; M116-I120 HydrophobicContact CE-CG2 3.66Å; M116-V121 HydrophobicContact CB-CG2 3.73Å; M116-A415 WeakPolarHBondContact O-CB 3.17Å
117	P	80.6	Confident	83	Confident	72 Å²	72	55.6 Å²	55.6	47%	0.468	30%	0.296	S	S	.	.			trans	-56.4	136.7	171.3	-23.8	33.2	0	0	0	111.8	D119 I120 V121	P117-D119 PolarHBondContact O-N 2.97Å; P117-I120 HydrophobicContact CB-CD1 4.37Å; P117-I120 HydrophobicContact CB-CG1 4.39Å; P117-I120 HydrophobicContact CG-CD1 4.07Å; P117-I120 PolarHBondContact O-N 2.79Å; P117-I120 VanDerWaalsContact O-N 3.13Å; P117-V121 PolarHBondContact O-N 2.89Å
118	Q	78.9	Confident	82.9	Confident	111 Å²	111	55.6 Å²	55.6	52%	0.519	30%	0.296	S	S	.	.	H	α-helix	trans	-57.2	-34.8	-177.3	-69.9	-176.6	-5.7	0	0	112.7	M116 I120 V121 Q122 A415	M116-Q118 PolarHBondContact O-N 2.87Å; Q118-I120 PolarHBondContact O-N 3.11Å; Q118-V121 PolarHBondContact O-N 2.8Å; Q118-Q122 WeakPolarHBondContact O-CB 3.25Å; Q118-Q122 PolarHBondContact O-N 2.91Å; Q118-A415 HydrophobicContact CG-CB 3.71Å
119	D	83.6	Confident	82.6	Confident	130 Å²	130	58 Å²	58	70%	0.695	31%	0.311	S	S	*	.	H	α-helix	trans	-61.3	-43.4	179.1	-59.7	-26.9	0	0	0	112.2	P117 Q122 Q123	P117-D119 PolarHBondContact O-N 2.97Å; D119-Q122 PolarHBondContact O-N 2.94Å; D119-Q123 WeakPolarHBondContact O-CB 2.99Å; D119-Q123 PolarHBondContact O-N 3.45Å
120	I	84.6	Confident	82.5	Confident	46 Å²	46	62.6 Å²	62.6	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-69.3	-41.1	179.4	-60.2	177.5	0	0	0	110	M116 P117 Q118 Q123 F124	M116-I120 HydrophobicContact CE-CB 4.24Å; M116-I120 HydrophobicContact CE-CD1 4.19Å; M116-I120 HydrophobicContact CE-CG2 3.66Å; P117-I120 HydrophobicContact CB-CD1 4.37Å; P117-I120 HydrophobicContact CB-CG1 4.39Å; P117-I120 HydrophobicContact CG-CD1 4.07Å; P117-I120 PolarHBondContact O-N 2.79Å; P117-I120 VanDerWaalsContact O-N 3.13Å; Q118-I120 PolarHBondContact O-N 3.11Å; I120-Q123 PolarHBondContact O-N 3.19Å; I120-F124 WeakPolarHBondContact O-CB 3.15Å; I120-F124 PolarHBondContact O-N 3.36Å
121	V	84.2	Confident	82.6	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-62	-47.4	177.4	179.1	0	0	0	0	110	M116 P117 Q118 F124 M125 M397	M116-V121 HydrophobicContact CB-CG2 3.73Å; P117-V121 PolarHBondContact O-N 2.89Å; Q118-V121 PolarHBondContact O-N 2.8Å; V121-F124 PolarHBondContact O-N 3.36Å; V121-M125 HydrophobicContact CG1-CE 4.13Å; V121-M125 HydrophobicContact CG1-CG 4.39Å; V121-M125 HydrophobicContact CG1-SD 4.39Å; V121-M125 WeakPolarHBondContact O-CB 3.49Å; V121-M125 VanDerWaalsContact O-CG 3.23Å; V121-M125 WeakPolarHBondContact O-CG 3.14Å; V121-M125 PolarHBondContact O-N 2.71Å; V121-M397 HydrophobicContact CG1-CB 4.02Å; V121-M397 HydrophobicContact CG1-CG 4.11Å
122	Q	85	Confident	83	Confident	108 Å²	108	55.7 Å²	55.7	51%	0.505	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-45.5	178.6	-175	174.3	-11.7	0	0	112.2	Q118 D119 F124 M125 E126	Q118-Q122 WeakPolarHBondContact O-CB 3.25Å; Q118-Q122 PolarHBondContact O-N 2.91Å; D119-Q122 PolarHBondContact O-N 2.94Å; Q122-F124 VanDerWaalsContact C-N 3.32Å; Q122-F124 PolarHBondContact O-N 2.61Å; Q122-M125 HydrophobicContact CB-CE 4.27Å; Q122-M125 PolarHBondContact O-N 3.46Å; Q122-E126 PolarHBondContact NE2-OE1 2.91Å; Q122-E126 VanDerWaalsContact NE2-OE1 3.12Å; Q122-E126 WeakPolarHBondContact O-CG 3.29Å; Q122-E126 PolarHBondContact O-N 3.25Å
123	Q	87.5	Confident	83.6	Confident	98 Å²	98	53 Å²	53	46%	0.458	30%	0.296	S	S	.	.	H	α-helix	trans	-59.1	-44.6	176.3	-174.2	-179.9	4.8	0	0	111.3	D119 I120 E126 L127	D119-Q123 WeakPolarHBondContact O-CB 2.99Å; D119-Q123 PolarHBondContact O-N 3.45Å; I120-Q123 PolarHBondContact O-N 3.19Å; Q123-E126 PolarHBondContact O-N 2.83Å; Q123-L127 HydrophobicContact CG-CD1 4.14Å; Q123-L127 VanDerWaalsContact O-CG 3.25Å; Q123-L127 WeakPolarHBondContact O-CG 3.15Å; Q123-L127 PolarHBondContact O-N 3.24Å
124	F	88.8	Confident	84.3	Confident	3 Å²	3	55 Å²	55	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-43.3	178.2	-175.5	-103.3	0	0	0	112.1	L86 F89 I120 V121 Q122 E126 L127 E128 F142 V227 I396 M397	L86-F124 HydrophobicContact CD1-CB 4.48Å; L86-F124 HydrophobicContact CD1-CD1 4.25Å; L86-F124 HydrophobicContact CD1-CD2 3.42Å; L86-F124 VanDerWaalsContact CD1-CD2 3.42Å; L86-F124 HydrophobicContact CD1-CE1 4.32Å; L86-F124 HydrophobicContact CD1-CE2 3.54Å; L86-F124 HydrophobicContact CD1-CG 3.79Å; L86-F124 HydrophobicContact CD1-CZ 3.99Å; F89-F124 AromaticContact CD1-CD2 3.89Å; F89-F124 HydrophobicContact CD1-CD2 3.89Å; F89-F124 HydrophobicContact CD1-CE2 4.34Å; F89-F124 AromaticContact CE1-CD2 3.96Å; F89-F124 HydrophobicContact CE1-CD2 3.96Å; F89-F124 HydrophobicContact CE1-CE2 4.18Å; I120-F124 WeakPolarHBondContact O-CB 3.15Å; I120-F124 PolarHBondContact O-N 3.36Å; V121-F124 PolarHBondContact O-N 3.36Å; Q122-F124 VanDerWaalsContact C-N 3.32Å; Q122-F124 PolarHBondContact O-N 2.61Å; F124-E126 VanDerWaalsContact C-N 3.27Å; F124-E126 PolarHBondContact O-N 2.82Å; F124-L127 PolarHBondContact O-N 3.42Å; F124-E128 HydrophobicContact CD1-CG 3.88Å; F124-E128 VanDerWaalsContact CE1-CD 3.47Å; F124-E128 HydrophobicContact CE1-CG 3.48Å; F124-E128 VanDerWaalsContact CE1-CG 3.48Å; F124-E128 HydrophobicContact CE2-CG 4.47Å; F124-E128 HydrophobicContact CZ-CG 3.82Å; F124-E128 PolarHBondContact O-N 3.39Å; F124-F142 HydrophobicContact CZ-CE1 4.08Å; F124-V227 HydrophobicContact CZ-CG1 4.45Å; F124-I396 HydrophobicContact CE1-CD1 3.98Å; F124-I396 HydrophobicContact CE1-CG1 4.07Å; F124-I396 HydrophobicContact CZ-CD1 4.35Å; F124-M397 HydrophobicContact CB-CE 4.26Å; F124-M397 HydrophobicContact CD1-CE 3.29Å; F124-M397 HydrophobicContact CD1-CG 3.96Å; F124-M397 HydrophobicContact CD1-SD 4.09Å; F124-M397 HydrophobicContact CE1-CE 3.82Å; F124-M397 HydrophobicContact CE1-CG 4.45Å; F124-M397 HydrophobicContact CE1-SD 4.29Å; F124-M397 HydrophobicContact CG-CE 3.95Å
125	M	88.4	Confident	85.3	Confident	12 Å²	12	57.2 Å²	57.2	6%	0.059	31%	0.31	C	S	.	.	H	α-helix	trans	-57.2	-40.9	176.6	-72.1	-168.8	-66.4	0	0	111.7	V121 Q122 L127 P129 A391 Q392 S395 M397 P417	V121-M125 HydrophobicContact CG1-CE 4.13Å; V121-M125 HydrophobicContact CG1-CG 4.39Å; V121-M125 HydrophobicContact CG1-SD 4.39Å; V121-M125 WeakPolarHBondContact O-CB 3.49Å; V121-M125 VanDerWaalsContact O-CG 3.23Å; V121-M125 WeakPolarHBondContact O-CG 3.14Å; V121-M125 PolarHBondContact O-N 2.71Å; Q122-M125 HydrophobicContact CB-CE 4.27Å; Q122-M125 PolarHBondContact O-N 3.46Å; M125-L127 VanDerWaalsContact C-N 3.31Å; M125-L127 PolarHBondContact O-N 3.02Å; M125-P129 WeakPolarHBondContact O-CD 3.31Å; M125-A391 HydrophobicContact CB-CB 3.67Å; M125-A391 WeakPolarHBondContact O-CB 3.19Å; M125-Q392 HydrophobicContact CE-CG 4.45Å; M125-Q392 HydrophobicContact SD-CG 4.24Å; M125-S395 WeakPolarHBondContact CG-OG 3.09Å; M125-M397 HydrophobicContact CG-CB 4.19Å; M125-M397 HydrophobicContact CG-CG 4.11Å; M125-M397 HydrophobicContact SD-CB 4.45Å; M125-P417 HydrophobicContact SD-CG 3.81Å
126	E	88.8	Confident	86	Confident	105 Å²	105	53.7 Å²	53.7	49%	0.491	28%	0.281	S	S	.	.	H	α-helix	trans	-67.6	-30.8	178	-70.9	173.3	-169.1	0	0	112.4	Q122 Q123 F124 P129 A391	Q122-E126 PolarHBondContact NE2-OE1 2.91Å; Q122-E126 VanDerWaalsContact NE2-OE1 3.12Å; Q122-E126 WeakPolarHBondContact O-CG 3.29Å; Q122-E126 PolarHBondContact O-N 3.25Å; Q123-E126 PolarHBondContact O-N 2.83Å; F124-E126 VanDerWaalsContact C-N 3.27Å; F124-E126 PolarHBondContact O-N 2.82Å; E126-P129 WeakPolarHBondContact O-CD 3.18Å; E126-P129 WeakPolarHBondContact O-CG 3.38Å; E126-A391 HydrophobicContact CG-CB 4.21Å
127	L	89.4	Confident	86.6	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.099	30%	0.304	C	S	.	.	H	α-helix	trans	-83.6	-30.9	-179.3	-67	173.5	0	0	0	114	F89 Y91 Q123 F124 M125 E130 M131	F89-L127 HydrophobicContact CD1-CD1 4.23Å; F89-L127 HydrophobicContact CE1-CB 4.48Å; F89-L127 HydrophobicContact CE1-CD1 3.75Å; Y91-L127 HydrophobicContact CD2-CD2 3.83Å; Y91-L127 HydrophobicContact CG-CD2 3.76Å; Q123-L127 HydrophobicContact CG-CD1 4.14Å; Q123-L127 VanDerWaalsContact O-CG 3.25Å; Q123-L127 WeakPolarHBondContact O-CG 3.15Å; Q123-L127 PolarHBondContact O-N 3.24Å; F124-L127 PolarHBondContact O-N 3.42Å; M125-L127 VanDerWaalsContact C-N 3.31Å; M125-L127 PolarHBondContact O-N 3.02Å; L127-E130 WeakPolarHBondContact O-CB 3.22Å; L127-E130 PolarHBondContact O-N 3.13Å; L127-E130 VanDerWaalsContact O-N 3.1Å; L127-M131 WeakPolarHBondContact O-CG 3.44Å; L127-M131 PolarHBondContact O-N 3.38Å
128	E	90.2	Very high	87.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-49.6	-50.3	178.3	-80.3	-176	105.9	0	0	114.9	F124 E130 M131 L132 V227 S395 I396	F124-E128 HydrophobicContact CD1-CG 3.88Å; F124-E128 VanDerWaalsContact CE1-CD 3.47Å; F124-E128 HydrophobicContact CE1-CG 3.48Å; F124-E128 VanDerWaalsContact CE1-CG 3.48Å; F124-E128 HydrophobicContact CE2-CG 4.47Å; F124-E128 HydrophobicContact CZ-CG 3.82Å; F124-E128 PolarHBondContact O-N 3.39Å; E128-E130 VanDerWaalsContact C-N 3.29Å; E128-E130 PolarHBondContact O-N 2.93Å; E128-M131 PolarHBondContact O-N 3.38Å; E128-L132 PolarHBondContact O-N 2.89Å; E128-L132 VanDerWaalsContact O-N 3.07Å; E128-V227 HydrophobicContact CG-CB 4.17Å; E128-V227 HydrophobicContact CG-CG1 4.2Å; E128-V227 WeakPolarHBondContact OE1-CG1 3.32Å; E128-S395 WeakPolarHBondContact OE2-CA 3.35Å; E128-S395 WeakPolarHBondContact OE2-CB 3.47Å; E128-S395 PolarHBondContact OE2-OG 2.85Å; E128-I396 WeakPolarHBondContact OE1-CG1 3.38Å; E128-I396 PolarHBondContact OE1-N 3.15Å
129	P	88.3	Confident	87.7	Confident	51 Å²	51	50.5 Å²	50.5	33%	0.331	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-33.1	179.1	25.9	-34.4	0	0	0	112.1	M125 E126 L132 A133	M125-P129 WeakPolarHBondContact O-CD 3.31Å; E126-P129 WeakPolarHBondContact O-CD 3.18Å; E126-P129 WeakPolarHBondContact O-CG 3.38Å; P129-L132 PolarHBondContact O-N 2.71Å; P129-A133 VanDerWaalsContact O-CB 3.32Å; P129-A133 WeakPolarHBondContact O-CB 3.41Å; P129-A133 PolarHBondContact O-N 3.02Å
130	E	87.9	Confident	88.2	Confident	100 Å²	100	44.3 Å²	44.3	47%	0.467	23%	0.23	S	C	.	.	H	α-helix	trans	-68.4	-40.2	175.7	-60.9	-169.2	163.4	0	0	111.5	L127 E128 L132 A133 M134	L127-E130 WeakPolarHBondContact O-CB 3.22Å; L127-E130 PolarHBondContact O-N 3.13Å; L127-E130 VanDerWaalsContact O-N 3.1Å; E128-E130 VanDerWaalsContact C-N 3.29Å; E128-E130 PolarHBondContact O-N 2.93Å; E130-L132 VanDerWaalsContact C-N 3.32Å; E130-L132 PolarHBondContact O-N 3.08Å; E130-A133 PolarHBondContact O-N 3.03Å; E130-M134 PolarHBondContact O-N 3.04Å
131	M	88.9	Confident	88.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-40.5	174.8	-70.2	176.7	67.2	0	0	112	M48 F89 Y94 I107 L127 E128 F142	M48-M131 HydrophobicContact SD-CB 4.48Å; M48-M131 HydrophobicContact SD-CE 4.41Å; F89-M131 HydrophobicContact CE1-SD 4.24Å; F89-M131 HydrophobicContact CZ-CE 4.14Å; F89-M131 HydrophobicContact CZ-SD 3.63Å; Y94-M131 HydrophobicContact CD1-CG 4.37Å; Y94-M131 HydrophobicContact CD2-CE 4.38Å; Y94-M131 HydrophobicContact CE1-CE 4.15Å; Y94-M131 HydrophobicContact CE1-CG 3.94Å; Y94-M131 HydrophobicContact CE2-CE 3.93Å; I107-M131 HydrophobicContact CD1-CE 3.96Å; L127-M131 WeakPolarHBondContact O-CG 3.44Å; L127-M131 PolarHBondContact O-N 3.38Å; E128-M131 PolarHBondContact O-N 3.38Å; M131-F142 HydrophobicContact CE-CZ 4.37Å
132	L	88.5	Confident	89.1	Confident	5 Å²	5	42 Å²	42	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-73.7	-35.5	178.4	-75.7	176.8	0	0	0	113.3	M48 Q49 G59 E128 P129 E130 M134 F225 V227	M48-L132 HydrophobicContact CG-CD2 3.93Å; M48-L132 HydrophobicContact SD-CD2 4.39Å; Q49-L132 HydrophobicContact CB-CD2 4.06Å; Q49-L132 HydrophobicContact CG-CD2 4.11Å; G59-L132 PolarHBondContact N-O 2.5Å; G59-L132 VanDerWaalsContact N-O 3.13Å; E128-L132 PolarHBondContact O-N 2.89Å; E128-L132 VanDerWaalsContact O-N 3.07Å; P129-L132 PolarHBondContact O-N 2.71Å; E130-L132 VanDerWaalsContact C-N 3.32Å; E130-L132 PolarHBondContact O-N 3.08Å; L132-M134 PolarHBondContact O-N 3.45Å; L132-F225 HydrophobicContact CD1-CD1 4.45Å; L132-F225 HydrophobicContact CD1-CE1 3.46Å; L132-F225 VanDerWaalsContact CD1-CE1 3.46Å; L132-F225 HydrophobicContact CD1-CZ 3.74Å; L132-V227 HydrophobicContact CD2-CG2 4.08Å; L132-V227 HydrophobicContact CG-CB 4.42Å; L132-V227 HydrophobicContact CG-CG2 4.17Å
133	A	87	Confident	89.5	Confident	65 Å²	65	36.9 Å²	36.9	54%	0.537	19%	0.194	S	C	.	.	H	α-helix	trans	-65.4	-24.4	178.2	0	0	0	0	0	112.6	P129 E130	P129-A133 VanDerWaalsContact O-CB 3.32Å; P129-A133 WeakPolarHBondContact O-CB 3.41Å; P129-A133 PolarHBondContact O-N 3.02Å; E130-A133 PolarHBondContact O-N 3.03Å
134	M	86.1	Confident	89.7	Confident	70 Å²	70	36.3 Å²	36.3	35%	0.345	19%	0.191	S	C	.	.	S	Bend	trans	-84.6	118.2	178	-170.4	177.8	175	0	0	111.3	L98 E130 L132 T136	L98-M134 HydrophobicContact CD1-CE 4.13Å; L98-M134 HydrophobicContact CD1-SD 3.97Å; E130-M134 PolarHBondContact O-N 3.04Å; L132-M134 PolarHBondContact O-N 3.45Å; M134-T136 HydrophobicContact CB-CG2 4.43Å; M134-T136 HydrophobicContact CE-CG2 4.16Å; M134-T136 HydrophobicContact CG-CG2 3.88Å; M134-T136 PolarHBondContact O-N 3.1Å; M134-T136 HydrophobicContact SD-CG2 4.07Å
135	E	86.8	Confident	89.7	Confident	100 Å²	100	38.8 Å²	38.8	47%	0.467	20%	0.203	S	C	.	.			trans	-67.7	122.2	167.5	-176.2	177.5	-154.6	0	0	109.8	P57 R61	P57-E135 HydrophobicContact CB-CB 4.26Å; P57-E135 HydrophobicContact CB-CG 3.86Å; P57-E135 WeakPolarHBondContact CB-OE1 3.45Å; P57-E135 VanDerWaalsContact CG-CD 3.41Å; P57-E135 HydrophobicContact CG-CG 4.44Å; P57-E135 VanDerWaalsContact CG-OE1 3.26Å; P57-E135 WeakPolarHBondContact CG-OE1 3.31Å; P57-E135 WeakPolarHBondContact CG-OE2 3.47Å; R61-E135 IonicContact CZ-OE1 3.84Å; R61-E135 IonicContact NE-OE1 2.74Å; R61-E135 PolarHBondContact NE-OE1 3.07Å; R61-E135 VanDerWaalsContact NE-OE1 3.1Å; R61-E135 IonicContact NH2-OE1 2.7Å
136	T	87.2	Confident	89.7	Confident	7 Å²	7	40.8 Å²	40.8	4%	0.043	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-129.1	133.7	-179.7	53.6	0	0	0	0	111.3	G59 T60 R61 L98 M134	G59-T136 PolarHBondContact O-N 2.83Å; G59-T136 PolarHBondContact O-OG1 2.94Å; T60-T136 CarbonylContact C-O 3.55Å; T60-T136 VanDerWaalsContact CA-O 3.31Å; T60-T136 WeakPolarHBondContact CA-O 3.31Å; R61-T136 PolarHBondContact N-O 3.12Å; L98-T136 HydrophobicContact CD1-CG2 3.71Å; L98-T136 HydrophobicContact CD2-CG2 4.04Å; M134-T136 HydrophobicContact CB-CG2 4.43Å; M134-T136 HydrophobicContact CE-CG2 4.16Å; M134-T136 HydrophobicContact CG-CG2 3.88Å; M134-T136 PolarHBondContact O-N 3.1Å; M134-T136 HydrophobicContact SD-CG2 4.07Å
137	I	88.2	Confident	89.7	Confident	119 Å²	119	41.8 Å²	41.8	61%	0.61	22%	0.222	S	C	*	.	S	Bend	trans	-77.2	-30	174.5	-61.4	166.7	0	0	0	110.3	N62	N62-I137 VanDerWaalsContact CB-O 3.24Å; N62-I137 WeakPolarHBondContact CB-O 3.35Å; N62-I137 VanDerWaalsContact CG-O 3.31Å; N62-I137 PolarHBondContact N-O 3.27Å; N62-I137 WeakPolarHBondContact ND2-CG2 3.44Å; N62-I137 PolarHBondContact ND2-O 2.96Å
138	V	90.9	Very high	89.6	Confident	18 Å²	18	45.6 Å²	45.6	11%	0.109	24%	0.24	C	C	.	.	S	Bend	trans	-69.7	126.4	-179.4	-177.7	0	0	0	0	109.5	T60 L98 A102 V105 V140	T60-V138 WeakPolarHBondContact CG2-O 3.49Å; L98-V138 HydrophobicContact CD2-CB 3.82Å; L98-V138 HydrophobicContact CD2-CG1 4.3Å; L98-V138 HydrophobicContact CD2-CG2 4.1Å; A102-V138 HydrophobicContact CB-CG1 4.38Å; A102-V138 WeakPolarHBondContact O-CG1 3.46Å; A102-V138 WeakPolarHBondContact O-CG2 3.49Å; V105-V138 HydrophobicContact CG2-CG1 4.29Å; V138-V140 PolarHBondContact O-N 2.86Å
139	P	91.6	Very high	89.6	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.013	24%	0.24	C	C	.	.			trans	-69.5	132.2	174.7	26.6	-29	0	0	0	110.4	N62 G103 A104 V105 Y141	N62-P139 HydrophobicContact CB-CG 4.37Å; N62-P139 WeakPolarHBondContact O-CB 3.25Å; G103-P139 VanDerWaalsContact O-CD 3.3Å; G103-P139 WeakPolarHBondContact O-CD 3.39Å; A104-P139 CarbonylContact C-O 3.48Å; A104-P139 WeakPolarHBondContact CA-O 3.43Å; A104-P139 HydrophobicContact CB-CG 3.84Å; V105-P139 PolarHBondContact N-O 3.06Å; P139-Y141 HydrophobicContact CB-CD2 4.32Å; P139-Y141 HydrophobicContact CB-CE2 3.61Å; P139-Y141 HydrophobicContact CG-CE2 4.06Å
140	V	93.5	Very high	89.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.7	173.7	-175.7	0	0	0	0	107.5	M48 T60 Y94 V105 I107 V138 F142	M48-V140 HydrophobicContact CB-CB 3.95Å; M48-V140 HydrophobicContact CB-CG1 4.49Å; M48-V140 WeakPolarHBondContact CB-O 3.34Å; M48-V140 HydrophobicContact CE-CG2 4.26Å; M48-V140 PolarHBondContact N-O 2.52Å; M48-V140 HydrophobicContact SD-CB 4.19Å; M48-V140 HydrophobicContact SD-CG1 4.43Å; M48-V140 HydrophobicContact SD-CG2 4.45Å; T60-V140 HydrophobicContact CG2-CB 3.96Å; T60-V140 HydrophobicContact CG2-CG2 3.86Å; Y94-V140 HydrophobicContact CE2-CG1 4.46Å; Y94-V140 HydrophobicContact CE2-CG2 3.92Å; V105-V140 HydrophobicContact CB-CG1 4.41Å; V105-V140 HydrophobicContact CB-CG2 4.31Å; V105-V140 CarbonylContact O-C 3.57Å; V105-V140 WeakPolarHBondContact O-CA 3.32Å; I107-V140 HydrophobicContact CD1-CG1 3.96Å; V138-V140 PolarHBondContact O-N 2.86Å; V140-F142 HydrophobicContact CG1-CE2 4.16Å; V140-F142 HydrophobicContact CG1-CZ 4.29Å
141	Y	94	Very high	89.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	145.9	-179.3	-66.7	-73.6	0	0	0	110.2	V45 Y46 R47 A63 A104 V105 V106 I107 P139 T185 Q525 M527	V45-Y141 HydrophobicContact CB-CD1 4.02Å; V45-Y141 HydrophobicContact CB-CG 4.31Å; V45-Y141 HydrophobicContact CG2-CD1 3.81Å; V45-Y141 HydrophobicContact CG2-CE1 4.18Å; V45-Y141 HydrophobicContact CG2-CG 4.36Å; Y46-Y141 CarbonylContact O-C 3.53Å; Y46-Y141 WeakPolarHBondContact O-CA 3.38Å; R47-Y141 HydrophobicContact CB-CD1 3.97Å; R47-Y141 HydrophobicContact CB-CE1 3.87Å; R47-Y141 HydrophobicContact CG-CD1 4.22Å; R47-Y141 HydrophobicContact CG-CE1 3.91Å; A63-Y141 PolarHBondContact O-OH 3.46Å; A104-Y141 HydrophobicContact CB-CD2 4.44Å; A104-Y141 HydrophobicContact CB-CE2 4.46Å; V105-Y141 PolarHBondContact O-N 3.23Å; V106-Y141 CarbonylContact C-O 3.49Å; V106-Y141 WeakPolarHBondContact CA-O 3.48Å; I107-Y141 PolarHBondContact N-O 3.19Å; P139-Y141 HydrophobicContact CB-CD2 4.32Å; P139-Y141 HydrophobicContact CB-CE2 3.61Å; P139-Y141 HydrophobicContact CG-CE2 4.06Å; Y141-T185 HydrophobicContact CE2-CG2 4.19Å; Y141-Q525 PolarHBondContact OH-OE1 3.25Å; Y141-Q525 VanDerWaalsContact OH-OE1 3.06Å; Y141-M527 HydrophobicContact CD2-CE 3.77Å; Y141-M527 HydrophobicContact CE2-CE 4.07Å; Y141-M527 HydrophobicContact CG-CE 4.16Å
142	F	94.4	Very high	89.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.8	172.5	-64.3	-88	0	0	0	108.3	Y46 M48 I107 L109 F124 M131 V140 V227 A228 L231	Y46-F142 PolarHBondContact N-O 3.1Å; Y46-F142 PolarHBondContact O-N 3.31Å; M48-F142 HydrophobicContact CB-CE2 4.1Å; I107-F142 HydrophobicContact CB-CD1 3.79Å; I107-F142 HydrophobicContact CB-CE1 3.89Å; I107-F142 HydrophobicContact CD1-CD1 4.28Å; I107-F142 HydrophobicContact CD1-CE1 3.51Å; I107-F142 HydrophobicContact CD1-CZ 3.8Å; I107-F142 HydrophobicContact CG1-CE1 4.26Å; I107-F142 HydrophobicContact CG2-CD1 4.01Å; I107-F142 HydrophobicContact CG2-CE1 4.04Å; I107-F142 WeakPolarHBondContact O-CA 3.33Å; L109-F142 HydrophobicContact CD1-CB 3.85Å; L109-F142 HydrophobicContact CD1-CD1 3.98Å; L109-F142 HydrophobicContact CD1-CG 4.31Å; L109-F142 HydrophobicContact CD2-CD1 4.11Å; L109-F142 HydrophobicContact CG-CB 4.42Å; L109-F142 HydrophobicContact CG-CD1 4.13Å; F124-F142 HydrophobicContact CZ-CE1 4.08Å; M131-F142 HydrophobicContact CE-CZ 4.37Å; V140-F142 HydrophobicContact CG1-CE2 4.16Å; V140-F142 HydrophobicContact CG1-CZ 4.29Å; F142-V227 HydrophobicContact CD2-CG1 4.42Å; F142-V227 HydrophobicContact CE1-CG1 3.9Å; F142-V227 HydrophobicContact CE2-CB 4.32Å; F142-V227 HydrophobicContact CE2-CG1 3.66Å; F142-V227 HydrophobicContact CE2-CG2 3.76Å; F142-V227 HydrophobicContact CZ-CB 4.15Å; F142-V227 HydrophobicContact CZ-CG1 3.35Å; F142-V227 HydrophobicContact CZ-CG2 3.65Å; F142-A228 HydrophobicContact CD2-CB 3.85Å; F142-A228 HydrophobicContact CE2-CB 4.39Å; F142-A228 HydrophobicContact CG-CB 4.39Å; F142-L231 HydrophobicContact CB-CD1 3.95Å
143	A	93.5	Very high	89.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.5	177.5	0	0	0	0	0	108.8	F43 V45 V106 I107 I108 L109 L149	F43-A143 HydrophobicContact CD2-CB 3.87Å; F43-A143 HydrophobicContact CE2-CB 3.76Å; V45-A143 HydrophobicContact CG1-CB 4.22Å; V106-A143 HydrophobicContact CG1-CB 4.27Å; I107-A143 PolarHBondContact O-N 2.99Å; I108-A143 CarbonylContact C-O 3.49Å; I108-A143 WeakPolarHBondContact CA-O 3.5Å; L109-A143 PolarHBondContact N-O 3.24Å; A143-L149 HydrophobicContact CB-CD2 3.9Å
144	E	90.9	Very high	89.5	Confident	86 Å²	86	44.1 Å²	44.1	40%	0.402	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	146	168.3	-70.6	174.4	-156.5	0	0	109.7	Y46 L109 D146	Y46-E144 HydrophobicContact CE2-CG 4.43Å; L109-E144 CarbonylContact O-C 3.54Å; E144-D146 PolarHBondContact O-N 3.48Å
145	E	89	Confident	89.4	Confident	55 Å²	55	44.8 Å²	44.8	26%	0.257	23%	0.231	S	C	.	.			trans	-57.2	130	176.9	-86.3	178	-179	0	0	110.6	I108 L109 P110 K111 L150	I108-E145 HydrophobicContact CG2-CB 4.26Å; I108-E145 HydrophobicContact CG2-CG 3.34Å; L109-E145 WeakPolarHBondContact O-CG 3.48Å; L109-E145 PolarHBondContact O-N 2.85Å; P110-E145 WeakPolarHBondContact CA-OE2 3.43Å; K111-E145 WeakPolarHBondContact CE-O 3.25Å; K111-E145 HydrophobicContact CG-CB 4.39Å; E145-L150 HydrophobicContact CG-CD2 4.46Å
146	D	89.6	Confident	89.2	Confident	55 Å²	55	40.3 Å²	40.3	29%	0.294	21%	0.21	S	C	.	.			trans	-132	149	168	-161.1	6.3	0	0	0	109.8	H41 E144 E148 L149 L150	H41-D146 IonicContact CE1-OD2 2.97Å; H41-D146 PolarHBondContact CE1-OD2 2.89Å; H41-D146 IonicContact NE2-OD2 2.87Å; H41-D146 PolarHBondContact NE2-OD2 3.18Å; E144-D146 PolarHBondContact O-N 3.48Å; D146-E148 PolarHBondContact O-N 3.07Å; D146-L149 HydrophobicContact CB-CB 4.14Å; D146-L149 PolarHBondContact O-N 3.39Å; D146-L149 VanDerWaalsContact O-N 3.12Å; D146-L150 WeakPolarHBondContact O-CG 3.38Å; D146-L150 PolarHBondContact O-N 3.48Å
147	D	88.4	Confident	89.1	Confident	125 Å²	125	42 Å²	42	67%	0.668	22%	0.219	S	C	*	.	H	α-helix	trans	-61.9	-37.8	-174.8	-68.6	-23.4	0	0	0	110.6	S151	D147-S151 PolarHBondContact O-N 3.17Å
148	E	87.7	Confident	88.6	Confident	99 Å²	99	40.8 Å²	40.8	46%	0.463	22%	0.217	S	C	.	.	H	α-helix	trans	-69.3	-41.7	175.5	-65.8	-171.9	-175.4	0	0	111.6	H41 D146 L150 S151 I152	H41-E148 IonicContact CE1-OE2 3.07Å; H41-E148 PolarHBondContact CE1-OE2 3.07Å; H41-E148 IonicContact CG-OE2 2.8Å; H41-E148 IonicContact ND1-OE2 3.36Å; H41-E148 PolarHBondContact ND1-OE2 3.42Å; D146-E148 PolarHBondContact O-N 3.07Å; E148-L150 VanDerWaalsContact C-N 3.33Å; E148-L150 PolarHBondContact O-N 3.23Å; E148-S151 WeakPolarHBondContact O-CB 3.32Å; E148-S151 PolarHBondContact O-N 3.42Å; E148-S151 VanDerWaalsContact O-N 3.13Å; E148-S151 PolarHBondContact O-OG 2.92Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.01Å
149	L	88.8	Confident	87.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-38.8	175.9	-174.6	62.9	0	0	0	112	F43 I108 A143 D146 S151 I152 Y153	F43-L149 HydrophobicContact CD1-CD1 4.44Å; F43-L149 HydrophobicContact CD2-CD2 4.3Å; F43-L149 HydrophobicContact CE1-CD1 3.93Å; F43-L149 HydrophobicContact CE2-CD1 4.16Å; F43-L149 HydrophobicContact CE2-CD2 4.2Å; F43-L149 HydrophobicContact CZ-CD1 3.77Å; I108-L149 HydrophobicContact CD1-CD2 3.98Å; I108-L149 HydrophobicContact CD1-CG 3.86Å; I108-L149 HydrophobicContact CG1-CD2 3.9Å; I108-L149 HydrophobicContact CG1-CG 4.33Å; I108-L149 HydrophobicContact CG2-CD2 4.29Å; A143-L149 HydrophobicContact CB-CD2 3.9Å; D146-L149 HydrophobicContact CB-CB 4.14Å; D146-L149 PolarHBondContact O-N 3.39Å; D146-L149 VanDerWaalsContact O-N 3.12Å; L149-S151 VanDerWaalsContact C-N 3.34Å; L149-I152 PolarHBondContact O-N 3.44Å; L149-Y153 PolarHBondContact O-N 3.24Å
150	L	89.4	Confident	86.9	Confident	46 Å²	46	41.9 Å²	41.9	24%	0.241	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-37	173.2	-70.4	172.3	0	0	0	111.7	E145 D146 E148 I152 Y153 T154	E145-L150 HydrophobicContact CG-CD2 4.46Å; D146-L150 WeakPolarHBondContact O-CG 3.38Å; D146-L150 PolarHBondContact O-N 3.48Å; E148-L150 VanDerWaalsContact C-N 3.33Å; E148-L150 PolarHBondContact O-N 3.23Å; L150-I152 VanDerWaalsContact C-N 3.34Å; L150-Y153 PolarHBondContact O-N 3.41Å; L150-T154 WeakPolarHBondContact O-CG2 3.38Å; L150-T154 PolarHBondContact O-N 3.2Å; L150-T154 PolarHBondContact O-OG1 2.98Å
151	S	87.8	Confident	85.8	Confident	47 Å²	47	44.3 Å²	44.3	33%	0.329	24%	0.243	S	C	.	.	H	α-helix	trans	-63.6	-40	173.5	86.9	0	0	0	0	111.8	D147 E148 L149 T154 Q155	D147-S151 PolarHBondContact O-N 3.17Å; E148-S151 WeakPolarHBondContact O-CB 3.32Å; E148-S151 PolarHBondContact O-N 3.42Å; E148-S151 VanDerWaalsContact O-N 3.13Å; E148-S151 PolarHBondContact O-OG 2.92Å; L149-S151 VanDerWaalsContact C-N 3.34Å; S151-T154 WeakPolarHBondContact CA-OG1 3.38Å; S151-T154 PolarHBondContact O-N 3.43Å; S151-T154 PolarHBondContact O-OG1 3.34Å; S151-Q155 WeakPolarHBondContact O-CB 3.42Å; S151-Q155 WeakPolarHBondContact O-CG 3.32Å; S151-Q155 PolarHBondContact O-N 3.24Å
152	I	86.5	Confident	84.4	Confident	6 Å²	6	45.6 Å²	45.6	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-43.7	175.1	-65.2	166.6	0	0	0	110.2	H41 I83 E148 L149 L150 Q155 T156 F181 M183 A529	H41-I152 HydrophobicContact CB-CD1 4.28Å; I83-I152 HydrophobicContact CD1-CG2 4.46Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.01Å; L149-I152 PolarHBondContact O-N 3.44Å; L150-I152 VanDerWaalsContact C-N 3.34Å; I152-Q155 PolarHBondContact O-N 3.38Å; I152-T156 HydrophobicContact CG2-CG2 4.32Å; I152-T156 WeakPolarHBondContact O-CB 3.39Å; I152-T156 VanDerWaalsContact O-CG2 3.31Å; I152-T156 WeakPolarHBondContact O-CG2 3.28Å; I152-T156 PolarHBondContact O-N 3.26Å; I152-T156 PolarHBondContact O-OG1 3.35Å; I152-F181 HydrophobicContact CD1-CD1 4.49Å; I152-F181 HydrophobicContact CD1-CE1 4.48Å; I152-F181 HydrophobicContact CG1-CD1 4.18Å; I152-F181 HydrophobicContact CG1-CE1 3.9Å; I152-F181 HydrophobicContact CG1-CZ 4.18Å; I152-F181 HydrophobicContact CG2-CB 4.2Å; I152-F181 HydrophobicContact CG2-CD1 4.04Å; I152-F181 HydrophobicContact CG2-CD2 3.92Å; I152-F181 HydrophobicContact CG2-CE1 4.4Å; I152-F181 HydrophobicContact CG2-CE2 4.27Å; I152-F181 HydrophobicContact CG2-CG 3.78Å; I152-F181 HydrophobicContact CG2-CZ 4.49Å; I152-M183 HydrophobicContact CG2-CE 3.97Å; I152-A529 HydrophobicContact CD1-CB 3.83Å
153	Y	88.8	Confident	82.8	Confident	16 Å²	16	48.7 Å²	48.7	6%	0.063	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-48.3	176.8	177.2	-106.2	0	0	0	111.9	T71 I83 R85 D88 L149 L150 Q155 T156 L157	T71-Y153 HydrophobicContact CG2-CD2 4.05Å; T71-Y153 HydrophobicContact CG2-CE2 3.86Å; I83-Y153 HydrophobicContact CB-CD2 4.23Å; I83-Y153 HydrophobicContact CG2-CD2 3.69Å; I83-Y153 HydrophobicContact CG2-CE2 4.4Å; R85-Y153 HydrophobicContact CG-CD1 4.07Å; R85-Y153 HydrophobicContact CG-CE1 3.78Å; R85-Y153 HydrophobicContact CG-CE2 4.32Å; R85-Y153 HydrophobicContact CG-CG 4.45Å; R85-Y153 VanDerWaalsContact NE-CE1 3.3Å; D88-Y153 PolarHBondContact OD2-OH 3.07Å; L149-Y153 PolarHBondContact O-N 3.24Å; L150-Y153 PolarHBondContact O-N 3.41Å; Y153-Q155 PolarHBondContact O-N 3.08Å; Y153-T156 WeakPolarHBondContact CA-OG1 3.43Å; Y153-T156 PolarHBondContact O-N 3.19Å; Y153-T156 PolarHBondContact O-OG1 3.21Å; Y153-L157 HydrophobicContact CE1-CD2 4.48Å; Y153-L157 VanDerWaalsContact O-CB 3.29Å; Y153-L157 WeakPolarHBondContact O-CB 3.41Å; Y153-L157 PolarHBondContact O-N 2.91Å
154	T	87.4	Confident	81.1	Confident	75 Å²	75	53.2 Å²	53.2	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-66.3	-38.6	179.9	52	0	0	0	0	112.8	L150 S151 L157 T158	L150-T154 WeakPolarHBondContact O-CG2 3.38Å; L150-T154 PolarHBondContact O-N 3.2Å; L150-T154 PolarHBondContact O-OG1 2.98Å; S151-T154 WeakPolarHBondContact CA-OG1 3.38Å; S151-T154 PolarHBondContact O-N 3.43Å; S151-T154 PolarHBondContact O-OG1 3.34Å; T154-L157 PolarHBondContact O-N 3.34Å; T154-T158 PolarHBondContact O-N 3.43Å; T154-T158 PolarHBondContact O-OG1 2.96Å
155	Q	83.3	Confident	79.4	Confident	85 Å²	85	53.7 Å²	53.7	40%	0.397	31%	0.31	S	S	.	.	H	α-helix	trans	-66	-42.3	174.9	-72.6	177.9	29.8	0	0	112.5	S151 I152 Y153 S159 F181	S151-Q155 WeakPolarHBondContact O-CB 3.42Å; S151-Q155 WeakPolarHBondContact O-CG 3.32Å; S151-Q155 PolarHBondContact O-N 3.24Å; I152-Q155 PolarHBondContact O-N 3.38Å; Y153-Q155 PolarHBondContact O-N 3.08Å; Q155-S159 WeakPolarHBondContact O-CB 3.33Å; Q155-S159 PolarHBondContact O-N 3.45Å; Q155-S159 PolarHBondContact O-OG 3.31Å; Q155-F181 HydrophobicContact CB-CE2 4.06Å
156	T	83.4	Confident	78.1	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-67.9	-37.3	176.1	51.4	0	0	0	0	111.5	A69 I152 Y153 S159 S160 F181	A69-T156 HydrophobicContact CB-CG2 4.47Å; I152-T156 HydrophobicContact CG2-CG2 4.32Å; I152-T156 WeakPolarHBondContact O-CB 3.39Å; I152-T156 VanDerWaalsContact O-CG2 3.31Å; I152-T156 WeakPolarHBondContact O-CG2 3.28Å; I152-T156 PolarHBondContact O-N 3.26Å; I152-T156 PolarHBondContact O-OG1 3.35Å; Y153-T156 WeakPolarHBondContact CA-OG1 3.43Å; Y153-T156 PolarHBondContact O-N 3.19Å; Y153-T156 PolarHBondContact O-OG1 3.21Å; T156-S159 PolarHBondContact O-N 3.35Å; T156-S160 PolarHBondContact O-N 3.42Å; T156-S160 PolarHBondContact O-OG 3.37Å; T156-S160 VanDerWaalsContact O-OG 3.04Å; T156-F181 HydrophobicContact CG2-CD2 3.7Å; T156-F181 HydrophobicContact CG2-CE2 4.43Å
157	L	83.8	Confident	76.9	Confident	44 Å²	44	54.8 Å²	54.8	23%	0.23	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-49.3	174.8	-172	68.3	0	0	0	111.7	T71 E73 Y153 T154 S159 S160 S161	T71-L157 HydrophobicContact CG2-CB 4.04Å; T71-L157 HydrophobicContact CG2-CD1 4.09Å; E73-L157 VanDerWaalsContact CD-CD1 3.5Å; E73-L157 HydrophobicContact CG-CD1 4.26Å; E73-L157 VanDerWaalsContact OE2-CD1 3.31Å; E73-L157 WeakPolarHBondContact OE2-CD1 3.28Å; Y153-L157 HydrophobicContact CE1-CD2 4.48Å; Y153-L157 VanDerWaalsContact O-CB 3.29Å; Y153-L157 WeakPolarHBondContact O-CB 3.41Å; Y153-L157 PolarHBondContact O-N 2.91Å; T154-L157 PolarHBondContact O-N 3.34Å; L157-S159 PolarHBondContact O-N 2.88Å; L157-S160 PolarHBondContact O-N 2.91Å; L157-S160 VanDerWaalsContact O-N 3.13Å; L157-S161 PolarHBondContact O-N 3.36Å; L157-S161 PolarHBondContact O-OG 2.87Å; L157-S161 VanDerWaalsContact O-OG 3.09Å
158	T	78.5	Confident	75.6	Confident	92 Å²	92	52.5 Å²	52.5	56%	0.564	32%	0.322	S	S	*	.	H	α-helix	trans	-60.9	-36	177.3	-50.8	0	0	0	0	111.4	T154 S161 S162	T154-T158 PolarHBondContact O-N 3.43Å; T154-T158 PolarHBondContact O-OG1 2.96Å; T158-S161 PolarHBondContact O-OG 3.23Å; T158-S162 WeakPolarHBondContact O-CB 3.41Å; T158-S162 PolarHBondContact O-N 2.92Å; T158-S162 PolarHBondContact O-OG 2.97Å
159	S	73.4	Confident	74.3	Confident	36 Å²	36	51.2 Å²	51.2	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-72.8	-32.7	177.2	-57.1	0	0	0	0	112.8	Q155 T156 L157 S162 Q163	Q155-S159 WeakPolarHBondContact O-CB 3.33Å; Q155-S159 PolarHBondContact O-N 3.45Å; Q155-S159 PolarHBondContact O-OG 3.31Å; T156-S159 PolarHBondContact O-N 3.35Å; L157-S159 PolarHBondContact O-N 2.88Å; S159-S162 PolarHBondContact O-OG 3.43Å; S159-Q163 WeakPolarHBondContact O-CG 3.27Å
160	S	73.1	Confident	73.2	Confident	7 Å²	7	56.3 Å²	56.3	5%	0.049	35%	0.352	C	S	.	.	H	α-helix	trans	-76.9	-41.7	177.7	-62.6	0	0	0	0	112.4	T71 T156 L157 Q163	T71-S160 VanDerWaalsContact OG1-CB 3.28Å; T71-S160 WeakPolarHBondContact OG1-CB 3.16Å; T71-S160 PolarHBondContact OG1-OG 3.41Å; T156-S160 PolarHBondContact O-N 3.42Å; T156-S160 PolarHBondContact O-OG 3.37Å; T156-S160 VanDerWaalsContact O-OG 3.04Å; L157-S160 PolarHBondContact O-N 2.91Å; L157-S160 VanDerWaalsContact O-N 3.13Å; S160-Q163 PolarHBondContact O-N 3.5Å
161	S	70.3	Confident	72	Confident	52 Å²	52	55.7 Å²	55.7	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-73.5	-31.6	-178	60.4	0	0	0	0	113.1	L157 T158 Q163 S164	L157-S161 PolarHBondContact O-N 3.36Å; L157-S161 PolarHBondContact O-OG 2.87Å; L157-S161 VanDerWaalsContact O-OG 3.09Å; T158-S161 PolarHBondContact O-OG 3.23Å; S161-Q163 VanDerWaalsContact C-N 3.28Å; S161-Q163 PolarHBondContact O-N 3.44Å; S161-S164 PolarHBondContact O-OG 3.27Å
162	S	65.3	Low	70.9	Confident	26 Å²	26	58.1 Å²	58.1	18%	0.182	36%	0.359	C	S	.	.	H	α-helix	trans	-69.1	-23.3	175.3	51.2	0	0	0	0	113.4	T158 S159 S164 L166	T158-S162 WeakPolarHBondContact O-CB 3.41Å; T158-S162 PolarHBondContact O-N 2.92Å; T158-S162 PolarHBondContact O-OG 2.97Å; S159-S162 PolarHBondContact O-OG 3.43Å; S162-S164 VanDerWaalsContact C-N 3.32Å; S162-S164 PolarHBondContact O-N 3.42Å; S162-L166 WeakPolarHBondContact O-CD1 3.26Å; S162-L166 VanDerWaalsContact O-CG 3.29Å; S162-L166 WeakPolarHBondContact O-CG 3.2Å
163	Q	60.9	Low	69.9	Low	66 Å²	66	63.4 Å²	63.4	31%	0.308	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.8	-179.8	-76.3	-176.9	-20.6	0	0	114.1	S159 S160 S161 T175	S159-Q163 WeakPolarHBondContact O-CG 3.27Å; S160-Q163 PolarHBondContact O-N 3.5Å; S161-Q163 VanDerWaalsContact C-N 3.28Å; S161-Q163 PolarHBondContact O-N 3.44Å; Q163-T175 PolarHBondContact NE2-OG1 3.06Å
164	S	56.6	Low	68.8	Low	95 Å²	95	67.4 Å²	67.4	66%	0.664	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.5	-177.1	62	0	0	0	0	114.3	S161 S162	S161-S164 PolarHBondContact O-OG 3.27Å; S162-S164 VanDerWaalsContact C-N 3.32Å; S162-S164 PolarHBondContact O-N 3.42Å
165	S	55.1	Low	67.8	Low	95 Å²	95	64.9 Å²	64.9	66%	0.664	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-8.3	-171.6	54.2	0	0	0	0	115
166	L	62.7	Low	66.8	Low	58 Å²	58	61 Å²	61	30%	0.304	37%	0.372	S	S	.	.	S	Bend	trans	-99.1	152.7	-173.6	-68.2	173.8	0	0	0	113	S162 E170 V171 H174	S162-L166 WeakPolarHBondContact O-CD1 3.26Å; S162-L166 VanDerWaalsContact O-CG 3.29Å; S162-L166 WeakPolarHBondContact O-CG 3.2Å; L166-E170 HydrophobicContact CB-CB 4.16Å; L166-E170 HydrophobicContact CD2-CB 4.47Å; L166-V171 HydrophobicContact CB-CG2 3.65Å; L166-V171 WeakPolarHBondContact O-CG2 3.46Å; L166-H174 HydrophobicContact CD1-CB 4.43Å
167	S	63.9	Low	65.8	Low	75 Å²	75	64.9 Å²	64.9	52%	0.524	40%	0.396	S	S	.	.			trans	-66	151.3	173.3	178.1	0	0	0	0	111.3	A169 E170 V171	S167-A169 PolarHBondContact O-N 3.42Å; S167-E170 PolarHBondContact N-OE2 3.24Å; S167-E170 CarbonylContact O-C 3.6Å; S167-E170 WeakPolarHBondContact O-CA 3.22Å; S167-E170 WeakPolarHBondContact O-CB 3.27Å; S167-E170 PolarHBondContact O-N 2.82Å; S167-V171 WeakPolarHBondContact O-CG2 3.24Å; S167-V171 PolarHBondContact O-N 3.22Å
168	A	60.3	Low	65	Low	78 Å²	78	64 Å²	64	65%	0.645	40%	0.396	S	S	*	.	H	α-helix	trans	-53.6	-34.9	-175.1	0	0	0	0	0	114.3	L172	A168-L172 VanDerWaalsContact O-CG 3.3Å; A168-L172 WeakPolarHBondContact O-CG 3.41Å; A168-L172 PolarHBondContact O-N 2.96Å; A168-L172 VanDerWaalsContact O-N 3.16Å
169	A	61.1	Low	64.5	Low	72 Å²	72	61.6 Å²	61.6	60%	0.595	38%	0.379	S	S	*	.	H	α-helix	trans	-73.3	-37.7	176.4	0	0	0	0	0	112.6	S167 L172 L173	S167-A169 PolarHBondContact O-N 3.42Å; A169-L172 PolarHBondContact O-N 3.39Å; A169-L173 PolarHBondContact O-N 3.05Å; A169-L173 VanDerWaalsContact O-N 3.1Å
170	E	64.9	Low	64.6	Low	106 Å²	106	60.3 Å²	60.3	50%	0.495	37%	0.372	S	S	.	.	H	α-helix	trans	-69	-41.2	174.5	-70.9	173.9	160.4	0	0	110.6	L166 S167 L172 L173 H174	L166-E170 HydrophobicContact CB-CB 4.16Å; L166-E170 HydrophobicContact CD2-CB 4.47Å; S167-E170 PolarHBondContact N-OE2 3.24Å; S167-E170 CarbonylContact O-C 3.6Å; S167-E170 WeakPolarHBondContact O-CA 3.22Å; S167-E170 WeakPolarHBondContact O-CB 3.27Å; S167-E170 PolarHBondContact O-N 2.82Å; E170-L172 VanDerWaalsContact C-N 3.28Å; E170-L172 PolarHBondContact O-N 3.19Å; E170-L173 PolarHBondContact O-N 3.46Å; E170-H174 VanDerWaalsContact O-CB 3.31Å; E170-H174 WeakPolarHBondContact O-CB 3.48Å; E170-H174 PolarHBondContact O-N 3.44Å
171	V	65.6	Low	65.2	Low	33 Å²	33	60.5 Å²	60.5	20%	0.2	37%	0.372	C	S	.	.	H	α-helix	trans	-57.3	-41.9	173.9	173.7	0	0	0	0	110.9	L166 S167 T175	L166-V171 HydrophobicContact CB-CG2 3.65Å; L166-V171 WeakPolarHBondContact O-CG2 3.46Å; S167-V171 WeakPolarHBondContact O-CG2 3.24Å; S167-V171 PolarHBondContact O-N 3.22Å; V171-T175 WeakPolarHBondContact O-CB 3.34Å; V171-T175 PolarHBondContact O-N 2.9Å; V171-T175 PolarHBondContact O-OG1 2.8Å
172	L	63.3	Low	65.9	Low	98 Å²	98	60.9 Å²	60.9	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-66.8	-42.7	177.1	-71.9	172.4	0	0	0	112.3	A168 A169 E170 T175 A176 I536	A168-L172 VanDerWaalsContact O-CG 3.3Å; A168-L172 WeakPolarHBondContact O-CG 3.41Å; A168-L172 PolarHBondContact O-N 2.96Å; A168-L172 VanDerWaalsContact O-N 3.16Å; A169-L172 PolarHBondContact O-N 3.39Å; E170-L172 VanDerWaalsContact C-N 3.28Å; E170-L172 PolarHBondContact O-N 3.19Å; L172-T175 PolarHBondContact O-N 2.9Å; L172-A176 VanDerWaalsContact O-CB 3.28Å; L172-A176 WeakPolarHBondContact O-CB 3.34Å; L172-A176 PolarHBondContact O-N 2.81Å; L172-I536 HydrophobicContact CD2-CD1 4.19Å
173	L	65.8	Low	67	Low	117 Å²	117	59.7 Å²	59.7	61%	0.613	36%	0.359	S	S	*	.	H	α-helix	trans	-67	-43.9	177.9	-160.8	98.5	0	0	0	111.5	A169 E170 A176 T177	A169-L173 PolarHBondContact O-N 3.05Å; A169-L173 VanDerWaalsContact O-N 3.1Å; E170-L173 PolarHBondContact O-N 3.46Å; L173-A176 PolarHBondContact O-N 2.94Å; L173-T177 WeakPolarHBondContact O-CG2 3.28Å; L173-T177 PolarHBondContact O-N 3.11Å; L173-T177 VanDerWaalsContact O-N 3.1Å; L173-T177 PolarHBondContact O-OG1 3.42Å
174	H	65.9	Low	68.3	Low	100 Å²	100	58.2 Å²	58.2	46%	0.463	36%	0.355	S	S	.	.	H	α-helix	trans	-66.4	-40.3	177.3	-127.1	-84	0	0	0	110.9	L166 E170 T177 A178	L166-H174 HydrophobicContact CD1-CB 4.43Å; E170-H174 VanDerWaalsContact O-CB 3.31Å; E170-H174 WeakPolarHBondContact O-CB 3.48Å; E170-H174 PolarHBondContact O-N 3.44Å; H174-T177 PolarHBondContact O-N 3.36Å; H174-T177 PolarHBondContact O-OG1 2.7Å; H174-A178 WeakPolarHBondContact O-CA 3.25Å; H174-A178 WeakPolarHBondContact O-CB 3.45Å; H174-A178 PolarHBondContact O-N 3.15Å
175	T	66.4	Low	69.9	Low	22 Å²	22	54.1 Å²	54.1	14%	0.135	33%	0.326	C	S	.	.	H	α-helix	trans	-68.6	-36.1	176.2	-55.6	0	0	0	0	111.6	Q163 V171 L172 T177 P534 I536	Q163-T175 PolarHBondContact NE2-OG1 3.06Å; V171-T175 WeakPolarHBondContact O-CB 3.34Å; V171-T175 PolarHBondContact O-N 2.9Å; V171-T175 PolarHBondContact O-OG1 2.8Å; L172-T175 PolarHBondContact O-N 2.9Å; T175-T177 VanDerWaalsContact C-N 3.33Å; T175-T177 PolarHBondContact O-N 2.99Å; T175-P534 HydrophobicContact CG2-CB 4.49Å; T175-P534 VanDerWaalsContact O-CG 3.28Å; T175-P534 WeakPolarHBondContact O-CG 3.07Å; T175-I536 HydrophobicContact CG2-CD1 3.89Å
176	A	62.5	Low	71.1	Confident	3 Å²	3	53 Å²	53	3%	0.025	32%	0.318	C	S	.	.	H	α-helix	trans	-68.1	-31.6	176.9	0	0	0	0	0	113.9	L172 L173 I536 L540	L172-A176 VanDerWaalsContact O-CB 3.28Å; L172-A176 WeakPolarHBondContact O-CB 3.34Å; L172-A176 PolarHBondContact O-N 2.81Å; L173-A176 PolarHBondContact O-N 2.94Å; A176-I536 HydrophobicContact CB-CG2 4.16Å; A176-L540 HydrophobicContact CB-CD1 3.19Å
177	T	63.1	Low	71.8	Confident	87 Å²	87	51 Å²	51	53%	0.534	31%	0.311	S	S	.	.	H	α-helix	trans	-94	-25	-177.9	51.3	0	0	0	0	112.7	L173 H174 T175	L173-T177 WeakPolarHBondContact O-CG2 3.28Å; L173-T177 PolarHBondContact O-N 3.11Å; L173-T177 VanDerWaalsContact O-N 3.1Å; L173-T177 PolarHBondContact O-OG1 3.42Å; H174-T177 PolarHBondContact O-N 3.36Å; H174-T177 PolarHBondContact O-OG1 2.7Å; T175-T177 VanDerWaalsContact C-N 3.33Å; T175-T177 PolarHBondContact O-N 2.99Å
178	A	65.8	Low	72.8	Confident	26 Å²	26	50.1 Å²	50.1	22%	0.215	31%	0.308	C	S	.	.	S	Bend	trans	-61.4	149.3	176	0	0	0	0	0	111.6	H174 P534	H174-A178 WeakPolarHBondContact O-CA 3.25Å; H174-A178 WeakPolarHBondContact O-CB 3.45Å; H174-A178 PolarHBondContact O-N 3.15Å; A178-P534 WeakPolarHBondContact O-CD 3.12Å
179	N	68.5	Low	74	Confident	41 Å²	41	50.3 Å²	50.3	22%	0.219	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-93.6	119.2	174.9	-54.3	-68.6	0	0	0	107.8	R531 K533	N179-R531 HydrophobicContact CB-CG 4.04Å; N179-R531 PolarHBondContact ND2-NH2 3.14Å; N179-R531 PolarHBondContact OD1-NE 2.72Å; N179-R531 VanDerWaalsContact OD1-NE 3.14Å; N179-R531 PolarHBondContact OD1-NH2 2.78Å; N179-K533 PolarHBondContact OD1-NZ 2.91Å
180	G	75.9	Confident	75.3	Confident	9 Å²	9	47.8 Å²	47.8	9%	0.093	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	147.9	167.4	0	0	0	0	0	109.5	V532	G180-V532 WeakPolarHBondContact CA-O 3.25Å; G180-V532 PolarHBondContact N-O 3.35Å; G180-V532 PolarHBondContact O-N 3Å; G180-V532 VanDerWaalsContact O-O 3.13Å
181	F	84.4	Confident	76.4	Confident	12 Å²	12	49.6 Å²	49.6	5%	0.053	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.9	167.9	-69.8	-81	0	0	0	108	E68 A69 I152 Q155 T156 Y530	E68-F181 CarbonylContact C-O 3.51Å; E68-F181 WeakPolarHBondContact CA-O 3.36Å; A69-F181 HydrophobicContact CB-CB 4.13Å; A69-F181 PolarHBondContact N-O 3.28Å; I152-F181 HydrophobicContact CD1-CD1 4.49Å; I152-F181 HydrophobicContact CD1-CE1 4.48Å; I152-F181 HydrophobicContact CG1-CD1 4.18Å; I152-F181 HydrophobicContact CG1-CE1 3.9Å; I152-F181 HydrophobicContact CG1-CZ 4.18Å; I152-F181 HydrophobicContact CG2-CB 4.2Å; I152-F181 HydrophobicContact CG2-CD1 4.04Å; I152-F181 HydrophobicContact CG2-CD2 3.92Å; I152-F181 HydrophobicContact CG2-CE1 4.4Å; I152-F181 HydrophobicContact CG2-CE2 4.27Å; I152-F181 HydrophobicContact CG2-CG 3.78Å; I152-F181 HydrophobicContact CG2-CZ 4.49Å; Q155-F181 HydrophobicContact CB-CE2 4.06Å; T156-F181 HydrophobicContact CG2-CD2 3.7Å; T156-F181 HydrophobicContact CG2-CE2 4.43Å; F181-Y530 CarbonylContact C-O 3.46Å; F181-Y530 WeakPolarHBondContact CA-O 3.46Å
182	Q	86.8	Confident	77.5	Confident	59 Å²	59	50.7 Å²	50.7	28%	0.276	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.8	175	-175	168.6	0.4	0	0	108.5	N66 V184 Y530 V532	N66-Q182 PolarHBondContact OD1-NE2 2.94Å; Q182-V184 HydrophobicContact CG-CG2 4.21Å; Q182-Y530 PolarHBondContact N-O 3.33Å; Q182-Y530 PolarHBondContact O-N 3.41Å; Q182-V532 HydrophobicContact CB-CB 4.42Å; Q182-V532 HydrophobicContact CB-CG2 3.7Å
183	M	87.9	Confident	78.7	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.9	178.1	-63.9	-60.1	-174.7	0	0	109.1	F43 L65 N66 T67 A69 C81 I83 I152 M527 A529	F43-M183 HydrophobicContact CE1-CE 4.48Å; F43-M183 HydrophobicContact CE1-SD 4.24Å; F43-M183 HydrophobicContact CZ-SD 4.4Å; L65-M183 HydrophobicContact CD2-CB 3.75Å; L65-M183 HydrophobicContact CG-CB 4.49Å; N66-M183 WeakPolarHBondContact CA-O 3.27Å; T67-M183 PolarHBondContact N-O 3.49Å; T67-M183 PolarHBondContact O-N 3.4Å; A69-M183 HydrophobicContact CB-CE 4.31Å; A69-M183 HydrophobicContact CB-CG 4.04Å; C81-M183 HydrophobicContact CB-CB 4.39Å; C81-M183 HydrophobicContact CB-CG 4.47Å; I83-M183 HydrophobicContact CD1-CE 3.78Å; I152-M183 HydrophobicContact CG2-CE 3.97Å; M183-M527 HydrophobicContact CB-CG 4.33Å; M183-M527 HydrophobicContact CB-SD 3.88Å; M183-M527 HydrophobicContact CG-SD 4.15Å; M183-M527 HydrophobicContact SD-CG 4.4Å; M183-M527 HydrophobicContact SD-SD 4.13Å; M183-A529 HydrophobicContact CE-CB 3.91Å; M183-A529 HydrophobicContact SD-CB 3.56Å; M183-A529 VanDerWaalsContact SD-CB 3.56Å
184	V	88.8	Confident	79.2	Confident	35 Å²	35	47.3 Å²	47.3	21%	0.212	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.9	179.1	-175.2	0	0	0	0	109.5	L65 N66 Q182 M527 N528 Y530	L65-V184 WeakPolarHBondContact O-CA 3.23Å; N66-V184 WeakPolarHBondContact OD1-CG2 3.38Å; Q182-V184 HydrophobicContact CG-CG2 4.21Å; V184-M527 WeakPolarHBondContact O-CA 3.5Å; V184-N528 PolarHBondContact N-O 2.95Å; V184-N528 PolarHBondContact O-N 3.43Å; V184-Y530 HydrophobicContact CB-CD2 4.31Å; V184-Y530 HydrophobicContact CB-CE2 4.01Å; V184-Y530 HydrophobicContact CG2-CD2 3.86Å; V184-Y530 HydrophobicContact CG2-CE2 3.98Å
185	T	88.4	Confident	79.9	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.055	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.2	172.3	51.7	0	0	0	0	110.1	L65 Y141 G187 M527	L65-T185 HydrophobicContact CB-CG2 3.71Å; L65-T185 PolarHBondContact N-OG1 3.48Å; L65-T185 PolarHBondContact O-N 3.5Å; L65-T185 VanDerWaalsContact O-N 3.13Å; L65-T185 PolarHBondContact O-OG1 3.02Å; Y141-T185 HydrophobicContact CE2-CG2 4.19Å; T185-G187 PolarHBondContact O-N 2.82Å; T185-M527 HydrophobicContact CG2-CE 3.8Å
186	S	81.4	Confident	80.9	Confident	73 Å²	73	47 Å²	47	51%	0.51	28%	0.281	S	S	.	.			trans	-76.3	-10.3	176.5	-55.5	0	0	0	0	113.5	T526	S186-T526 PolarHBondContact N-O 2.9Å; S186-T526 PolarHBondContact OG-OG1 2.58Å
187	G	77.9	Confident	82.2	Confident	15 Å²	15	46.9 Å²	46.9	16%	0.155	28%	0.28	C	S	.	.	S	Bend	trans	-80.3	158.3	-175.3	0	0	0	0	0	114.7	T185	T185-G187 PolarHBondContact O-N 2.82Å
188	A	83.6	Confident	83.5	Confident	56 Å²	56	42.9 Å²	42.9	46%	0.463	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-81.6	172.9	171.7	0	0	0	0	0	111.4
189	Q	86.3	Confident	84.8	Confident	82 Å²	82	41.7 Å²	41.7	38%	0.383	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-62.2	144.4	170.1	-75.8	-57.4	-13.7	0	0	111.2	A63 I64	A63-Q189 VanDerWaalsContact N-OE1 3.1Å; I64-Q189 HydrophobicContact CD1-CB 4.35Å; I64-Q189 HydrophobicContact CD1-CG 3.51Å; I64-Q189 HydrophobicContact CG1-CG 3.91Å; I64-Q189 VanDerWaalsContact CG1-NE2 3.3Å
190	S	87.4	Confident	86.1	Confident	20 Å²	20	39.7 Å²	39.7	14%	0.14	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-55.4	132.9	173.7	-157.6	0	0	0	0	111.9	R47 Q50 Y520 D521	R47-S190 PolarHBondContact NH1-OG 3.5Å; Q50-S190 VanDerWaalsContact OE1-CB 3.3Å; Q50-S190 PolarHBondContact OE1-OG 2.8Å; S190-Y520 WeakPolarHBondContact OG-CB 3.26Å; S190-D521 PolarHBondContact OG-O 3.37Å
191	K	89.1	Confident	86.9	Confident	143 Å²	143	39.3 Å²	39.3	62%	0.622	23%	0.23	S	C	*	.			trans	-124.1	143.1	175.2	-67.2	-178.6	-176.4	176.1	0	110.7	Y520 D521	K191-Y520 WeakPolarHBondContact O-CA 3.48Å; K191-D521 PolarHBondContact N-OD1 3.5Å; K191-D521 PolarHBondContact O-N 2.85Å
192	A	88.7	Confident	87.3	Confident	57 Å²	57	39.1 Å²	39.1	47%	0.471	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	134.4	174.1	0	0	0	0	0	110.9	V518 F519 Y520	A192-V518 HydrophobicContact CB-CG1 3.73Å; A192-F519 WeakPolarHBondContact CA-O 3.38Å; A192-Y520 HydrophobicContact CB-CD1 4.21Å; A192-Y520 HydrophobicContact CB-CE1 3.85Å
193	I	87.4	Confident	87.6	Confident	56 Å²	56	36.3 Å²	36.3	29%	0.287	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.2	176.3	-54.6	171.1	0	0	0	107.7	W196 F519 D521	I193-W196 HydrophobicContact CG2-CB 4.1Å; I193-W196 HydrophobicContact CG2-CE3 4.29Å; I193-F519 PolarHBondContact N-O 2.96Å; I193-D521 HydrophobicContact CD1-CB 4.2Å; I193-D521 HydrophobicContact CG1-CB 4.39Å
194	S	76.2	Confident	87.7	Confident	88 Å²	88	38.1 Å²	38.1	62%	0.615	22%	0.223	S	C	*	.	S	Bend	trans	-86.8	-21.3	-173.1	54.1	0	0	0	0	115.1
195	D	81.4	Confident	87.8	Confident	83 Å²	83	36.9 Å²	36.9	44%	0.444	22%	0.215	S	C	.	.	S	Bend	trans	-118.6	29.4	-173.6	-79.1	-40	0	0	0	113.1	K512	D195-K512 WeakPolarHBondContact OD1-CE 3.47Å; D195-K512 IonicContact OD1-NZ 3.46Å; D195-K512 PolarHBondContact OD1-NZ 2.87Å; D195-K512 IonicContact OD2-NZ 3.61Å; D195-K512 PolarHBondContact OD2-NZ 2.84Å; D195-K512 VanDerWaalsContact OD2-NZ 3.13Å
196	W	87.7	Confident	87.8	Confident	32 Å²	32	38.7 Å²	38.7	12%	0.121	23%	0.226	C	C	.	.			trans	-68.3	132.6	175.5	-168.1	-99.9	0	0	0	111	I193 A479 Q480 V482 D483 F519	I193-W196 HydrophobicContact CG2-CB 4.1Å; I193-W196 HydrophobicContact CG2-CE3 4.29Å; W196-A479 VanDerWaalsContact CE2-O 3.23Å; W196-A479 WeakPolarHBondContact CZ2-O 3.48Å; W196-A479 PolarHBondContact NE1-O 3.39Å; W196-Q480 VanDerWaalsContact CH2-O 3.26Å; W196-Q480 WeakPolarHBondContact CH2-O 3.35Å; W196-Q480 VanDerWaalsContact CZ2-C 3.46Å; W196-Q480 WeakPolarHBondContact CZ2-O 3.43Å; W196-V482 VanDerWaalsContact CZ2-C 3.44Å; W196-V482 VanDerWaalsContact CZ2-O 3.27Å; W196-V482 WeakPolarHBondContact CZ2-O 3.48Å; W196-D483 HydrophobicContact CH2-CB 3.76Å; W196-D483 HydrophobicContact CZ2-CB 4.36Å; W196-D483 HydrophobicContact CZ3-CB 4.12Å; W196-F519 HydrophobicContact CB-CD2 4.27Å; W196-F519 AromaticContact CD1-CD2 3.31Å; W196-F519 AromaticContact CD1-CE2 3.4Å; W196-F519 VanDerWaalsContact CD1-CE2 3.4Å; W196-F519 HydrophobicContact CD2-CD2 4.36Å; W196-F519 AromaticContact CG-CD2 3.73Å; W196-F519 HydrophobicContact CG-CD2 3.73Å; W196-F519 HydrophobicContact CG-CE2 4.26Å; W196-F519 AromaticContact NE1-CD2 3.66Å; W196-F519 AromaticContact NE1-CE2 3.63Å
197	A	89.4	Confident	87.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	130	174.2	0	0	0	0	0	112.4	K484 V508 K509	A197-K484 HydrophobicContact CB-CD 3.53Å; A197-K484 HydrophobicContact CB-CG 3.81Å; A197-V508 CarbonylContact C-O 3.6Å; A197-V508 WeakPolarHBondContact CA-O 3.45Å; A197-V508 WeakPolarHBondContact CB-O 3.28Å; A197-K509 HydrophobicContact CB-CG 3.67Å
198	I	91.6	Very high	88.1	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.015	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.1	174	-62.1	170.2	0	0	0	107.4	G273 G274 Q280 V508 F517 F519	I198-G273 WeakPolarHBondContact CG2-O 3.37Å; I198-G274 VanDerWaalsContact CG2-N 3.31Å; I198-Q280 HydrophobicContact CD1-CB 4.27Å; I198-V508 HydrophobicContact CB-CB 4.28Å; I198-V508 PolarHBondContact N-O 2.89Å; I198-V508 PolarHBondContact O-N 2.85Å; I198-F517 HydrophobicContact CD1-CD2 4.39Å; I198-F517 HydrophobicContact CD1-CE1 4Å; I198-F517 HydrophobicContact CD1-CE2 3.82Å; I198-F517 HydrophobicContact CD1-CZ 3.59Å; I198-F517 HydrophobicContact CG1-CE2 4.26Å; I198-F517 HydrophobicContact CG1-CZ 4.1Å; I198-F519 HydrophobicContact CD1-CE2 4.42Å
199	T	92.8	Very high	87.5	Confident	1 Å²	1	39 Å²	39	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.2	179.6	-51.1	0	0	0	0	109.8	Y222 G273 V489 R505 H506 Y507	T199-Y222 PolarHBondContact O-OH 3.43Å; T199-G273 WeakPolarHBondContact O-CA 3.44Å; T199-V489 HydrophobicContact CG2-CG1 3.72Å; T199-R505 HydrophobicContact CG2-CB 4.33Å; T199-H506 CarbonylContact C-O 3.48Å; T199-H506 WeakPolarHBondContact CA-O 3.33Å; T199-Y507 HydrophobicContact CG2-CD1 4Å; T199-Y507 HydrophobicContact CG2-CE1 3.68Å; T199-Y507 WeakPolarHBondContact OG1-CD1 3.31Å; T199-Y507 WeakPolarHBondContact OG1-CE1 3.44Å
200	S	94.4	Very high	87	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.1	172	-59.4	0	0	0	0	109	V271 G273 G281 R505 H506	S200-V271 WeakPolarHBondContact CA-O 3.19Å; S200-G273 PolarHBondContact OG-N 3.38Å; S200-G281 WeakPolarHBondContact OG-CA 3.2Å; S200-R505 CarbonylContact O-C 2.96Å; S200-R505 WeakPolarHBondContact O-CA 3.45Å; S200-H506 PolarHBondContact N-O 3.26Å; S200-H506 PolarHBondContact O-N 3.46Å
201	L	94.3	Very high	86.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.9	-174.8	-60.1	173.2	0	0	0	109.8	F270 V271 V489 L492 E493 L496 K504 R505	L201-F270 CarbonylContact O-C 3.52Å; L201-F270 WeakPolarHBondContact O-CA 2.97Å; L201-F270 VanDerWaalsContact O-CD2 3.25Å; L201-F270 WeakPolarHBondContact O-CD2 3.32Å; L201-V271 HydrophobicContact CB-CB 4.37Å; L201-V271 PolarHBondContact N-O 3.22Å; L201-V271 PolarHBondContact O-N 2.92Å; L201-V489 HydrophobicContact CD1-CG1 4.38Å; L201-V489 HydrophobicContact CD2-CG1 4.14Å; L201-V489 HydrophobicContact CG-CG1 4.46Å; L201-L492 HydrophobicContact CD1-CB 3.48Å; L201-L492 VanDerWaalsContact CD1-CB 3.48Å; L201-L492 HydrophobicContact CD1-CD1 4.36Å; L201-E493 HydrophobicContact CD1-CB 4.24Å; L201-E493 HydrophobicContact CD2-CB 4.17Å; L201-L496 HydrophobicContact CB-CD1 3.99Å; L201-L496 HydrophobicContact CD1-CD1 4.11Å; L201-K504 WeakPolarHBondContact CA-O 3.19Å; L201-R505 HydrophobicContact CD2-CB 4.44Å; L201-R505 HydrophobicContact CD2-CG 3.74Å
202	E	92.8	Very high	85.6	Confident	8 Å²	8	40 Å²	40	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.6	173.5	-179.9	-174.1	160.2	0	0	109	R204 L268 F269 F270 W285 V503 K504 H506	E202-R204 IonicContact OE1-NH2 2.88Å; E202-R204 PolarHBondContact OE1-NH2 2.82Å; E202-L268 HydrophobicContact CG-CD1 4.34Å; E202-L268 HydrophobicContact CG-CD2 3.75Å; E202-L268 HydrophobicContact CG-CG 4.04Å; E202-L268 WeakPolarHBondContact OE1-CD1 3.33Å; E202-F269 CarbonylContact C-O 3.5Å; E202-F269 WeakPolarHBondContact CA-O 3.37Å; E202-F270 HydrophobicContact CB-CD2 4.27Å; E202-W285 PolarHBondContact OE2-NE1 2.72Å; E202-V503 CarbonylContact O-C 3.28Å; E202-V503 WeakPolarHBondContact O-CA 3.47Å; E202-K504 PolarHBondContact N-O 3.37Å; E202-K504 PolarHBondContact O-N 3.47Å; E202-H506 IonicContact OE2-CD2 3.7Å; E202-H506 IonicContact OE2-CE1 3.67Å; E202-H506 IonicContact OE2-NE2 2.82Å; E202-H506 PolarHBondContact OE2-NE2 3.43Å
203	G	92.5	Very high	85.3	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	149	169.2	0	0	0	0	0	111.5	F269	G203-F269 PolarHBondContact N-O 2.72Å; G203-F269 PolarHBondContact O-N 3.48Å
204	R	90.5	Very high	85.4	Confident	39 Å²	39	38.8 Å²	38.8	15%	0.147	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.9	-171	-167.1	175.3	-66.7	-178.7	-0.7	112.8	E202 T206 E211 K501	E202-R204 IonicContact OE1-NH2 2.88Å; E202-R204 PolarHBondContact OE1-NH2 2.82Å; R204-T206 HydrophobicContact CG-CG2 4.38Å; R204-E211 IonicContact NH1-OE1 3.39Å; R204-E211 PolarHBondContact NH1-OE1 3.47Å; R204-K501 PolarHBondContact N-O 3.32Å; R204-K501 PolarHBondContact O-N 3.3Å
205	L	90.6	Very high	86	Confident	9 Å²	9	35 Å²	35	5%	0.047	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	115.7	162.6	-61.4	175.8	0	0	0	108.5	F252 Y256 L267 F269 L500	L205-F252 HydrophobicContact CD1-CB 3.93Å; L205-Y256 HydrophobicContact CB-CD1 4.03Å; L205-Y256 HydrophobicContact CB-CE1 4.36Å; L205-Y256 HydrophobicContact CB-CG 4.31Å; L205-Y256 HydrophobicContact CD1-CD2 4.42Å; L205-Y256 HydrophobicContact CD1-CG 4.4Å; L205-L267 HydrophobicContact CB-CB 4.25Å; L205-L267 HydrophobicContact CD1-CD1 4.49Å; L205-L267 PolarHBondContact N-O 2.83Å; L205-L267 PolarHBondContact O-N 2.86Å; L205-F269 HydrophobicContact CD1-CE2 3.89Å; L205-F269 HydrophobicContact CG-CE2 4.35Å; L205-L500 HydrophobicContact CD1-CD2 3.88Å; L205-L500 HydrophobicContact CD2-CD2 3.81Å; L205-L500 HydrophobicContact CG-CD2 3.61Å
206	T	87.6	Confident	86.6	Confident	47 Å²	47	31 Å²	31	29%	0.288	18%	0.184	S	C	.	.			trans	-84.3	136.7	-180	54.5	0	0	0	0	111.1	R204 H262 N266	R204-T206 HydrophobicContact CG-CG2 4.38Å; T206-H262 PolarHBondContact O-CE1 3.03Å; T206-N266 WeakPolarHBondContact CA-OD1 3.33Å
207	G	83.7	Confident	86.9	Confident	5 Å²	5	29.6 Å²	29.6	5%	0.052	18%	0.178	C	C	.	.			trans	-80.2	178.8	172.8	0	0	0	0	0	113.4	G209 G210 H262 A263 Y265 N266	G207-G209 PolarHBondContact O-N 3.03Å; G207-G210 PolarHBondContact O-N 3.35Å; G207-H262 PolarHBondContact O-CE1 2.95Å; G207-A263 WeakPolarHBondContact CA-O 3.37Å; G207-Y265 WeakPolarHBondContact CA-O 3.29Å; G207-N266 PolarHBondContact N-OD1 3.3Å
208	V	81.8	Confident	87.2	Confident	104 Å²	104	29.7 Å²	29.7	63%	0.63	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-31.2	-170.6	-179.6	0	0	0	0	112.4	H262 A263	V208-H262 HydrophobicContact CG2-CB 3.47Å; V208-H262 VanDerWaalsContact CG2-CB 3.47Å; V208-H262 WeakPolarHBondContact CG2-ND1 3.27Å; V208-H262 WeakPolarHBondContact CG2-O 3.37Å; V208-H262 PolarHBondContact N-CE1 2.9Å; V208-H262 VanDerWaalsContact N-CE1 3.35Å; V208-H262 PolarHBondContact N-ND1 3.07Å; V208-A263 PolarHBondContact N-O 3.5Å
209	G	71.1	Confident	87.4	Confident	42 Å²	42	29.5 Å²	29.5	43%	0.433	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	12.3	-176.3	0	0	0	0	0	114.8	G207	G207-G209 PolarHBondContact O-N 3.03Å
210	G	75.9	Confident	87.6	Confident	30 Å²	30	29.5 Å²	29.5	31%	0.309	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	68.1	-146.8	-179.6	0	0	0	0	0	113.3	G207 D212 N266	G207-G210 PolarHBondContact O-N 3.35Å; G210-D212 VanDerWaalsContact C-N 3.32Å; G210-D212 PolarHBondContact O-N 3.38Å; G210-N266 PolarHBondContact O-ND2 2.77Å; G210-N266 PolarHBondContact O-OD1 2.83Å
211	E	70.1	Confident	87.6	Confident	99 Å²	99	29.5 Å²	29.5	46%	0.463	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-77.1	-14.3	-171.1	-57.4	-165.4	135.9	0	0	114.5	R204 L213 L297 N301	R204-E211 IonicContact NH1-OE1 3.39Å; R204-E211 PolarHBondContact NH1-OE1 3.47Å; E211-L213 PolarHBondContact O-N 2.78Å; E211-L297 HydrophobicContact CB-CD1 4.35Å; E211-L297 HydrophobicContact CB-CD2 3.84Å; E211-L297 VanDerWaalsContact CD-CD1 3.48Å; E211-L297 HydrophobicContact CG-CD1 4.35Å; E211-L297 WeakPolarHBondContact OE1-CD1 3.43Å; E211-N301 PolarHBondContact O-ND2 3.43Å; E211-N301 VanDerWaalsContact O-ND2 3.1Å
212	D	76.9	Confident	87.5	Confident	137 Å²	137	29.6 Å²	29.6	73%	0.733	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-77.2	-9	-179.6	-63.9	-28.5	0	0	0	113.3	G210	G210-D212 VanDerWaalsContact C-N 3.32Å; G210-D212 PolarHBondContact O-N 3.38Å
213	L	83.2	Confident	87.4	Confident	35 Å²	35	29.2 Å²	29.2	18%	0.183	18%	0.176	C	C	.	.	S	Bend	trans	-80	151.1	178.6	-68.5	175.8	0	0	0	112.3	E211 T215 A264 N266	E211-L213 PolarHBondContact O-N 2.78Å; L213-T215 PolarHBondContact O-N 2.96Å; L213-A264 WeakPolarHBondContact CD2-O 3.22Å; L213-N266 PolarHBondContact O-ND2 2.91Å; L213-N266 VanDerWaalsContact O-ND2 3.11Å
214	P	88.9	Confident	87.4	Confident	52 Å²	52	29.2 Å²	29.2	34%	0.338	18%	0.176	S	C	.	.			trans	-58.7	135.7	174.3	-19.9	30.7	0	0	0	111.7	Y265 N266 N301 A303	P214-Y265 HydrophobicContact CB-CD1 3.86Å; P214-Y265 HydrophobicContact CB-CE1 3.73Å; P214-Y265 HydrophobicContact CG-CE1 4.24Å; P214-Y265 WeakPolarHBondContact O-CA 3.08Å; P214-Y265 WeakPolarHBondContact O-CD1 3.43Å; P214-N266 PolarHBondContact O-N 2.77Å; P214-N301 CarbonylContact C-O 3.39Å; P214-N301 WeakPolarHBondContact CA-O 3.36Å; P214-A303 HydrophobicContact CB-CB 3.98Å
215	T	90	Very high	87.5	Confident	9 Å²	9	28.5 Å²	28.5	6%	0.055	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.2	-177.8	-55.6	0	0	0	0	110.4	L213 V217 N266 L268 N301 V302 A303	L213-T215 PolarHBondContact O-N 2.96Å; T215-V217 HydrophobicContact CG2-CG2 4.37Å; T215-N266 CarbonylContact C-O 3.58Å; T215-N266 WeakPolarHBondContact CA-O 3.29Å; T215-N266 HydrophobicContact CG2-CB 4.02Å; T215-N266 WeakPolarHBondContact OG1-CB 3.36Å; T215-L268 HydrophobicContact CG2-CB 3.88Å; T215-N301 PolarHBondContact N-O 2.69Å; T215-V302 WeakPolarHBondContact O-CA 3.19Å; T215-A303 PolarHBondContact O-N 3.35Å
216	I	93.2	Very high	87.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.4	168.9	-59.7	166.4	0	0	0	107.5	Y265 N266 L267 L268 A303 F304 I439	I216-Y265 HydrophobicContact CD1-CD1 3.91Å; I216-Y265 HydrophobicContact CD1-CE1 4.44Å; I216-Y265 HydrophobicContact CD1-CG 4.17Å; I216-Y265 HydrophobicContact CG1-CD1 4.04Å; I216-N266 PolarHBondContact N-O 3.07Å; I216-L267 HydrophobicContact CB-CD2 3.84Å; I216-L267 HydrophobicContact CD1-CD2 4.3Å; I216-L267 HydrophobicContact CG2-CD2 4.37Å; I216-L267 WeakPolarHBondContact O-CA 3.43Å; I216-L268 PolarHBondContact O-N 3.16Å; I216-A303 HydrophobicContact CG1-CB 4.21Å; I216-F304 HydrophobicContact CB-CZ 4.39Å; I216-F304 HydrophobicContact CD1-CE1 3.83Å; I216-F304 HydrophobicContact CD1-CZ 3.78Å; I216-F304 HydrophobicContact CG1-CD1 4.32Å; I216-F304 HydrophobicContact CG1-CE1 3.8Å; I216-F304 HydrophobicContact CG1-CE2 4.47Å; I216-F304 HydrophobicContact CG1-CZ 3.89Å; I216-F304 HydrophobicContact CG2-CD2 4Å; I216-F304 HydrophobicContact CG2-CE1 4.3Å; I216-F304 HydrophobicContact CG2-CE2 3.43Å; I216-F304 VanDerWaalsContact CG2-CE2 3.43Å; I216-F304 HydrophobicContact CG2-CZ 3.61Å; I216-I439 HydrophobicContact CD1-CD1 4.49Å; I216-I439 HydrophobicContact CD1-CG1 3.8Å
217	V	94.1	Very high	87.7	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119.9	-179.4	-175.1	0	0	0	0	108.3	T215 V219 L268 W285 V302 F304 V305 L306	T215-V217 HydrophobicContact CG2-CG2 4.37Å; V217-V219 HydrophobicContact CG1-CG2 3.56Å; V217-L268 CarbonylContact C-O 3.6Å; V217-L268 WeakPolarHBondContact CA-O 3.4Å; V217-L268 HydrophobicContact CG1-CD2 4.04Å; V217-L268 HydrophobicContact CG2-CB 4.36Å; V217-W285 HydrophobicContact CG1-CH2 4.18Å; V217-V302 HydrophobicContact CG2-CG1 4.34Å; V217-V302 HydrophobicContact CG2-CG2 4.41Å; V217-F304 PolarHBondContact N-O 2.86Å; V217-V305 HydrophobicContact CB-CB 4.33Å; V217-V305 HydrophobicContact CB-CG1 4.05Å; V217-V305 HydrophobicContact CB-CG2 4.02Å; V217-V305 HydrophobicContact CG1-CG1 4.13Å; V217-V305 HydrophobicContact CG2-CG2 4.32Å; V217-V305 CarbonylContact O-C 3.47Å; V217-V305 VanDerWaalsContact O-CA 3.31Å; V217-V305 WeakPolarHBondContact O-CA 3.34Å; V217-L306 PolarHBondContact O-N 3.4Å
218	V	96.3	Very high	88.2	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119.2	172.1	-177.2	0	0	0	0	108	L245 L248 L268 F269 F270 L306 L308 L435	V218-L245 HydrophobicContact CG1-CD1 4.31Å; V218-L245 HydrophobicContact CG1-CG 4.37Å; V218-L248 HydrophobicContact CG1-CD1 4.39Å; V218-L268 PolarHBondContact N-O 3.14Å; V218-F269 HydrophobicContact CB-CD1 4.02Å; V218-F269 HydrophobicContact CB-CE1 4.2Å; V218-F269 HydrophobicContact CG1-CD1 4.38Å; V218-F269 HydrophobicContact CG1-CE1 4.49Å; V218-F269 HydrophobicContact CG2-CE1 4.35Å; V218-F269 WeakPolarHBondContact O-CA 3.18Å; V218-F270 PolarHBondContact O-N 2.89Å; V218-L306 CarbonylContact C-O 3.54Å; V218-L306 WeakPolarHBondContact CA-O 3.09Å; V218-L308 HydrophobicContact CG1-CD1 3.85Å; V218-L308 HydrophobicContact CG1-CG 4.31Å; V218-L435 HydrophobicContact CG2-CD1 4.45Å
219	V	95.6	Very high	88.7	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.6	-173.1	-170.6	0	0	0	0	110.4	V217 F270 V305 L306 C307 L308 E368 F372	V217-V219 HydrophobicContact CG1-CG2 3.56Å; V219-F270 VanDerWaalsContact CA-O 3.28Å; V219-F270 WeakPolarHBondContact CA-O 3.11Å; V219-F270 HydrophobicContact CG1-CD1 3.71Å; V219-F270 HydrophobicContact CG1-CE1 4.48Å; V219-F270 HydrophobicContact CG2-CB 4.28Å; V219-F270 HydrophobicContact CG2-CD1 4.28Å; V219-V305 HydrophobicContact CG2-CG1 3.56Å; V219-L306 PolarHBondContact N-O 3.02Å; V219-C307 CarbonylContact O-C 3.56Å; V219-C307 WeakPolarHBondContact O-CA 3.23Å; V219-L308 PolarHBondContact O-N 3.04Å; V219-E368 HydrophobicContact CG1-CG 4.47Å; V219-E368 WeakPolarHBondContact CG1-OE1 3.37Å; V219-E368 WeakPolarHBondContact CG1-OE2 3.3Å; V219-F372 HydrophobicContact CG2-CE2 4.23Å; V219-F372 HydrophobicContact CG2-CZ 3.86Å
220	A	96	Very high	89.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.6	163.4	0	0	0	0	0	108.7	V242 L245 F270 V271 S272 L308	A220-V242 HydrophobicContact CB-CG2 4.23Å; A220-L245 HydrophobicContact CB-CB 4.13Å; A220-L245 HydrophobicContact CB-CD1 3.59Å; A220-F270 PolarHBondContact N-O 2.78Å; A220-F270 VanDerWaalsContact N-O 3.11Å; A220-V271 CarbonylContact O-C 3.54Å; A220-V271 VanDerWaalsContact O-CA 3.23Å; A220-V271 WeakPolarHBondContact O-CA 3.49Å; A220-V271 WeakPolarHBondContact O-CG1 3.48Å; A220-S272 PolarHBondContact O-N 2.98Å; A220-L308 HydrophobicContact CB-CB 4.34Å
221	H	94.3	Very high	90.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.7	172.3	58.7	95	0	0	0	111	N238 V242 S272 Y279 D309 E368	H221-N238 PolarHBondContact CE1-ND2 3.19Å; H221-N238 PolarHBondContact CE1-OD1 2.86Å; H221-N238 VanDerWaalsContact ND1-CG 3.32Å; H221-N238 PolarHBondContact ND1-ND2 3.39Å; H221-N238 PolarHBondContact NE2-OD1 3.32Å; H221-N238 WeakPolarHBondContact O-CB 3.47Å; H221-V242 WeakPolarHBondContact O-CG2 3.35Å; H221-S272 VanDerWaalsContact CA-O 3.25Å; H221-S272 WeakPolarHBondContact CA-O 3.41Å; H221-S272 WeakPolarHBondContact CA-OG 3.3Å; H221-S272 WeakPolarHBondContact CB-OG 3.39Å; H221-Y279 AromaticContact CD2-CE1 3.85Å; H221-Y279 AromaticContact NE2-CE1 3.89Å; H221-D309 IonicContact NE2-OD2 3.33Å; H221-E368 IonicContact CD2-OE2 3.9Å
222	Y	93.1	Very high	91.4	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.008	9%	0.088	C	C	.	.			trans	-94.4	-3.4	-179.4	67.6	-102.2	0	0	0	113.7	T199 V271 S272 R477 V482 L492	T199-Y222 PolarHBondContact O-OH 3.43Å; Y222-V271 HydrophobicContact CD1-CG1 3.72Å; Y222-V271 HydrophobicContact CG-CG1 4.42Å; Y222-S272 VanDerWaalsContact CD1-O 3.28Å; Y222-S272 WeakPolarHBondContact CD1-O 3.46Å; Y222-S272 PolarHBondContact N-O 3.39Å; Y222-S272 VanDerWaalsContact N-O 3.11Å; Y222-R477 PolarHBondContact O-NH1 3.48Å; Y222-V482 HydrophobicContact CE2-CB 4.45Å; Y222-V482 HydrophobicContact CE2-CG1 3.89Å; Y222-V482 HydrophobicContact CE2-CG2 4.37Å; Y222-L492 HydrophobicContact CD1-CD1 3.92Å; Y222-L492 HydrophobicContact CG-CD1 4.02Å
223	D	91.3	Very high	92	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.065	C	C	.	.			trans	-73	148	-176.7	-47.1	-87.2	0	0	0	112.5	N238 G273 G274 G275 K276 R477	D223-N238 PolarHBondContact O-ND2 2.83Å; D223-G273 WeakPolarHBondContact OD2-CA 3.23Å; D223-G274 PolarHBondContact OD1-N 3.23Å; D223-G274 WeakPolarHBondContact OD2-CA 3.37Å; D223-G274 PolarHBondContact OD2-N 2.97Å; D223-G275 PolarHBondContact OD2-N 3.47Å; D223-K276 HydrophobicContact CB-CG 4.32Å; D223-R477 WeakPolarHBondContact CA-O 3.4Å
224	T	92.3	Very high	92.2	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.058	C	C	.	.	B	Isolated β-bridge	trans	-110.5	158.6	172.5	62.6	0	0	0	0	109.8	S232 Y233 R477 A478	T224-S232 WeakPolarHBondContact CB-O 3.41Å; T224-S232 PolarHBondContact OG1-O 2.99Å; T224-S232 PolarHBondContact OG1-OG 2.73Å; T224-Y233 VanDerWaalsContact CG2-O 3.26Å; T224-Y233 WeakPolarHBondContact CG2-O 3.47Å; T224-R477 HydrophobicContact CG2-CB 3.87Å; T224-R477 PolarHBondContact N-O 3.35Å; T224-R477 VanDerWaalsContact N-O 3.13Å; T224-R477 WeakPolarHBondContact OG1-CA 3.02Å; T224-R477 PolarHBondContact OG1-N 2.89Å; T224-R477 PolarHBondContact OG1-O 2.85Å; T224-A478 PolarHBondContact OG1-N 2.92Å
225	F	91.4	Very high	92.2	Very high	25 Å²	25	9.8 Å²	9.8	11%	0.11	4%	0.042	C	C	.	.			trans	-150.6	141.1	-179.1	-170.3	-86.8	0	0	0	110.1	Y51 L132 K276 F277 S394 S395	Y51-F225 HydrophobicContact CE1-CE2 4.02Å; Y51-F225 HydrophobicContact CE1-CZ 4.13Å; L132-F225 HydrophobicContact CD1-CD1 4.45Å; L132-F225 HydrophobicContact CD1-CE1 3.46Å; L132-F225 VanDerWaalsContact CD1-CE1 3.46Å; L132-F225 HydrophobicContact CD1-CZ 3.74Å; F225-K276 HydrophobicContact CB-CB 3.78Å; F225-K276 HydrophobicContact CB-CD 3.96Å; F225-K276 HydrophobicContact CB-CG 3.65Å; F225-K276 HydrophobicContact CD2-CB 3.98Å; F225-K276 HydrophobicContact CG-CB 4.16Å; F225-F277 HydrophobicContact CD2-CZ 4.18Å; F225-F277 HydrophobicContact CE2-CE1 4.08Å; F225-F277 HydrophobicContact CE2-CZ 4.08Å; F225-S394 CarbonylContact O-C 3.49Å; F225-S394 VanDerWaalsContact O-C 3.28Å; F225-S394 WeakPolarHBondContact O-CA 3.43Å; F225-S395 PolarHBondContact O-N 2.94Å
226	G	91.1	Very high	92.2	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.039	C	C	.	.			trans	-176.3	173.7	-180	0	0	0	0	0	109.6	Q49 A228	Q49-G226 VanDerWaalsContact CD-O 3.3Å; Q49-G226 WeakPolarHBondContact CG-O 3.47Å; Q49-G226 PolarHBondContact NE2-O 2.8Å; G226-A228 PolarHBondContact O-N 3.44Å
227	V	92.3	Very high	92	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	4%	0.04	C	C	.	.	S	Bend	trans	-58.8	-33.7	-174.8	70.8	0	0	0	0	113.6	M48 Q49 F124 E128 L132 F142 I396	M48-V227 CarbonylContact C-O 3.53Å; M48-V227 WeakPolarHBondContact CA-O 3.45Å; M48-V227 HydrophobicContact CB-CG2 4.5Å; M48-V227 HydrophobicContact CG-CG2 3.68Å; M48-V227 HydrophobicContact SD-CG2 3.52Å; M48-V227 VanDerWaalsContact SD-CG2 3.52Å; Q49-V227 WeakPolarHBondContact CG-O 3.48Å; Q49-V227 PolarHBondContact N-O 3.13Å; F124-V227 HydrophobicContact CZ-CG1 4.45Å; E128-V227 HydrophobicContact CG-CB 4.17Å; E128-V227 HydrophobicContact CG-CG1 4.2Å; E128-V227 WeakPolarHBondContact OE1-CG1 3.32Å; L132-V227 HydrophobicContact CD2-CG2 4.08Å; L132-V227 HydrophobicContact CG-CB 4.42Å; L132-V227 HydrophobicContact CG-CG2 4.17Å; F142-V227 HydrophobicContact CD2-CG1 4.42Å; F142-V227 HydrophobicContact CE1-CG1 3.9Å; F142-V227 HydrophobicContact CE2-CB 4.32Å; F142-V227 HydrophobicContact CE2-CG1 3.66Å; F142-V227 HydrophobicContact CE2-CG2 3.76Å; F142-V227 HydrophobicContact CZ-CB 4.15Å; F142-V227 HydrophobicContact CZ-CG1 3.35Å; F142-V227 HydrophobicContact CZ-CG2 3.65Å; V227-I396 HydrophobicContact CG1-CD1 3.92Å; V227-I396 HydrophobicContact CG1-CG1 4.45Å; V227-I396 HydrophobicContact CG1-CG2 3.9Å
228	A	93	Very high	91.7	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	4%	0.04	C	C	.	.	S	Bend	trans	-118.8	122.2	175.5	0	0	0	0	0	110.2	F142 G226 W230 L231 S232 I396	F142-A228 HydrophobicContact CD2-CB 3.85Å; F142-A228 HydrophobicContact CE2-CB 4.39Å; F142-A228 HydrophobicContact CG-CB 4.39Å; G226-A228 PolarHBondContact O-N 3.44Å; A228-W230 PolarHBondContact O-N 2.86Å; A228-L231 HydrophobicContact CB-CB 4.2Å; A228-L231 HydrophobicContact CB-CD1 4.09Å; A228-L231 HydrophobicContact CB-CG 4.31Å; A228-L231 PolarHBondContact O-N 3.27Å; A228-S232 PolarHBondContact O-N 2.68Å; A228-I396 HydrophobicContact CB-CG2 4.45Å
229	P	92.5	Very high	91.5	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.04	C	C	.	.	G	3₁₀ helix	trans	-63.9	-41	-172.9	-16.7	30	0	0	0	112.1	Q49 L231 S232 A478 L481 L523	Q49-P229 HydrophobicContact CB-CG 4.26Å; Q49-P229 HydrophobicContact CG-CG 3.64Å; P229-L231 PolarHBondContact O-N 2.78Å; P229-S232 PolarHBondContact O-N 3.3Å; P229-S232 VanDerWaalsContact O-N 3.17Å; P229-S232 PolarHBondContact O-OG 2.93Å; P229-A478 HydrophobicContact CB-CB 3.68Å; P229-L481 HydrophobicContact CB-CD1 4.24Å; P229-L481 HydrophobicContact CB-CG 4.36Å; P229-L523 HydrophobicContact CB-CD1 4.27Å; P229-L523 HydrophobicContact CG-CD1 3.94Å; P229-L523 HydrophobicContact CG-CD2 3.98Å; P229-L523 HydrophobicContact CG-CG 4.4Å
230	W	92.3	Very high	91.3	Very high	88 Å²	88	9.5 Å²	9.5	33%	0.333	4%	0.04	S	C	.	.	G	3₁₀ helix	trans	-66.6	-20.7	-179.7	-80	93.7	0	0	0	114.4	Y46 A228 P476 L481 K524	Y46-W230 HydrophobicContact CD1-CB 3.36Å; Y46-W230 AromaticContact CD1-CG 3.92Å; Y46-W230 HydrophobicContact CD1-CG 3.92Å; Y46-W230 HydrophobicContact CE1-CB 3.76Å; Y46-W230 HydrophobicContact CE1-CG 4.27Å; Y46-W230 HydrophobicContact CG-CB 4.18Å; A228-W230 PolarHBondContact O-N 2.86Å; W230-P476 HydrophobicContact CE3-CG 4.23Å; W230-P476 WeakPolarHBondContact O-CB 3.38Å; W230-P476 WeakPolarHBondContact O-CG 3.28Å; W230-L481 HydrophobicContact CD2-CD1 4.04Å; W230-L481 HydrophobicContact CD2-CD2 4.22Å; W230-L481 HydrophobicContact CE3-CD1 4.44Å; W230-L481 HydrophobicContact CG-CD1 4.13Å; W230-L481 HydrophobicContact CG-CD2 4.46Å; W230-L481 HydrophobicContact CZ2-CD2 3.91Å; W230-K524 HydrophobicContact CD2-CB 4.18Å; W230-K524 HydrophobicContact CD2-CD 4.21Å; W230-K524 HydrophobicContact CE3-CD 4.29Å; W230-K524 HydrophobicContact CG-CB 4.22Å; W230-K524 HydrophobicContact CH2-CD 4.48Å; W230-K524 HydrophobicContact CZ2-CB 4.29Å; W230-K524 HydrophobicContact CZ2-CD 4.4Å; W230-K524 HydrophobicContact CZ3-CD 4.42Å
231	L	90.8	Very high	91.2	Very high	13 Å²	13	9.5 Å²	9.5	7%	0.068	4%	0.04	C	C	.	.	G	3₁₀ helix	trans	-100.6	-2	177.9	-63.4	176.2	0	0	0	112.5	Y46 L109 F142 A228 P229 Y233 I396	Y46-L231 HydrophobicContact CD2-CD1 3.74Å; Y46-L231 HydrophobicContact CD2-CD2 3.74Å; Y46-L231 HydrophobicContact CD2-CG 3.76Å; Y46-L231 HydrophobicContact CE2-CD1 4.42Å; Y46-L231 HydrophobicContact CE2-CD2 3.62Å; Y46-L231 HydrophobicContact CE2-CG 4.18Å; Y46-L231 HydrophobicContact CG-CD1 4.23Å; Y46-L231 HydrophobicContact CG-CD2 4.35Å; Y46-L231 HydrophobicContact CG-CG 4.03Å; L109-L231 HydrophobicContact CD1-CD1 3.39Å; F142-L231 HydrophobicContact CB-CD1 3.95Å; A228-L231 HydrophobicContact CB-CB 4.2Å; A228-L231 HydrophobicContact CB-CD1 4.09Å; A228-L231 HydrophobicContact CB-CG 4.31Å; A228-L231 PolarHBondContact O-N 3.27Å; P229-L231 PolarHBondContact O-N 2.78Å; L231-Y233 VanDerWaalsContact O-CD2 3.27Å; L231-Y233 WeakPolarHBondContact O-CD2 3.25Å; L231-Y233 PolarHBondContact O-N 3.19Å; L231-I396 HydrophobicContact CB-CB 4.24Å; L231-I396 HydrophobicContact CB-CG2 4.18Å; L231-I396 HydrophobicContact CD1-CD1 4.49Å
232	S	91.4	Very high	91.3	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.007	4%	0.04	C	C	.	.			trans	-85.8	90.4	179.9	66.1	0	0	0	0	112.1	T224 A228 P229 P476	T224-S232 WeakPolarHBondContact CB-O 3.41Å; T224-S232 PolarHBondContact OG1-O 2.99Å; T224-S232 PolarHBondContact OG1-OG 2.73Å; A228-S232 PolarHBondContact O-N 2.68Å; P229-S232 PolarHBondContact O-N 3.3Å; P229-S232 VanDerWaalsContact O-N 3.17Å; P229-S232 PolarHBondContact O-OG 2.93Å; S232-P476 WeakPolarHBondContact O-CA 3.47Å
233	Y	89.5	Confident	91.3	Very high	62 Å²	62	9.4 Å²	9.4	24%	0.243	4%	0.039	C	C	.	.			trans	-84	-33.8	177.4	-64.5	-79.3	0	0	0	113.2	T224 L231 V399 T473 R477	T224-Y233 VanDerWaalsContact CG2-O 3.26Å; T224-Y233 WeakPolarHBondContact CG2-O 3.47Å; L231-Y233 VanDerWaalsContact O-CD2 3.27Å; L231-Y233 WeakPolarHBondContact O-CD2 3.25Å; L231-Y233 PolarHBondContact O-N 3.19Å; Y233-V399 HydrophobicContact CD2-CG2 4.39Å; Y233-T473 WeakPolarHBondContact CD1-O 3.13Å; Y233-R477 PolarHBondContact O-NH2 3.24Å
234	G	87.9	Confident	91.5	Very high	3 Å²	3	9.4 Å²	9.4	3%	0.031	4%	0.039	C	C	.	.			trans	54	63.7	175	0	0	0	0	0	112.8	S237 G239 D398 R477	G234-S237 VanDerWaalsContact O-O 3.06Å; G234-G239 PolarHBondContact O-N 3.05Å; G234-D398 VanDerWaalsContact C-OD2 3.31Å; G234-D398 VanDerWaalsContact CA-OD2 3.22Å; G234-D398 WeakPolarHBondContact CA-OD2 3.24Å; G234-D398 PolarHBondContact N-O 3.16Å; G234-R477 PolarHBondContact O-NH2 2.99Å
235	A	88.1	Confident	91.7	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.039	C	C	.	.	I	π-helix	trans	-65.6	-60.5	-179	0	0	0	0	0	110.8	G239 S240 D398 R400 V419 T473	A235-G239 CarbonylContact O-C 3.54Å; A235-G239 VanDerWaalsContact O-CA 3.26Å; A235-G239 WeakPolarHBondContact O-CA 3.39Å; A235-S240 PolarHBondContact O-N 2.73Å; A235-D398 PolarHBondContact N-O 2.69Å; A235-D398 PolarHBondContact N-OD1 3.13Å; A235-D398 PolarHBondContact N-OD2 3.04Å; A235-R400 HydrophobicContact CB-CB 4.31Å; A235-V419 HydrophobicContact CB-CG2 3.95Å; A235-V419 WeakPolarHBondContact O-CG2 3.41Å; A235-T473 HydrophobicContact CB-CG2 3.48Å; A235-T473 VanDerWaalsContact CB-CG2 3.48Å
236	D	90.1	Very high	91.9	Very high	2 Å²	2	8.2 Å²	8.2	1%	0.011	3%	0.034	C	C	.	.	I	π-helix	trans	-81.2	-37.3	176.3	-167.1	18.3	0	0	0	111.2	N238 S240 T310 G312 H384 D398 V419	D236-N238 VanDerWaalsContact C-N 3.34Å; D236-N238 PolarHBondContact O-N 3.48Å; D236-S240 PolarHBondContact O-OG 3.44Å; D236-S240 PolarHBondContact OD1-OG 3.42Å; D236-S240 VanDerWaalsContact OD1-OG 3.09Å; D236-T310 WeakPolarHBondContact O-CA 3.39Å; D236-G312 WeakPolarHBondContact OD1-CA 3.26Å; D236-G312 PolarHBondContact OD1-N 3.21Å; D236-H384 IonicContact OD2-CE1 4Å; D236-H384 PolarHBondContact OD2-CE1 2.89Å; D236-H384 IonicContact OD2-ND1 2.99Å; D236-H384 IonicContact OD2-NE2 3.74Å; D236-D398 PolarHBondContact N-OD1 2.95Å; D236-D398 PolarHBondContact N-OD2 2.82Å; D236-V419 HydrophobicContact CB-CG2 3.79Å
237	S	88.9	Confident	92.1	Very high	3 Å²	3	8.3 Å²	8.3	2%	0.021	3%	0.034	C	C	.	.	I	π-helix	trans	-68.9	91.4	174	-159.9	0	0	0	0	111.1	G234 G239 K276 R393 D398	G234-S237 VanDerWaalsContact O-O 3.06Å; S237-G239 PolarHBondContact O-N 3.09Å; S237-K276 PolarHBondContact OG-NZ 3.25Å; S237-R393 PolarHBondContact OG-O 3.01Å; S237-D398 WeakPolarHBondContact CA-OD2 3.39Å; S237-D398 WeakPolarHBondContact CB-OD2 3.32Å; S237-D398 PolarHBondContact N-OD2 3.22Å
238	N	88.4	Confident	92.3	Very high	1 Å²	1	8.3 Å²	8.3	1%	0.005	4%	0.035	C	C	.	.	I	π-helix	trans	67.5	-13.6	175.4	-21	-61.2	0	0	0	116.2	H221 D223 D236 S240 G241 V242 K276 D309	H221-N238 PolarHBondContact CE1-ND2 3.19Å; H221-N238 PolarHBondContact CE1-OD1 2.86Å; H221-N238 VanDerWaalsContact ND1-CG 3.32Å; H221-N238 PolarHBondContact ND1-ND2 3.39Å; H221-N238 PolarHBondContact NE2-OD1 3.32Å; H221-N238 WeakPolarHBondContact O-CB 3.47Å; D223-N238 PolarHBondContact O-ND2 2.83Å; D236-N238 VanDerWaalsContact C-N 3.34Å; D236-N238 PolarHBondContact O-N 3.48Å; N238-S240 VanDerWaalsContact C-N 3.29Å; N238-G241 PolarHBondContact O-N 2.79Å; N238-V242 VanDerWaalsContact O-CG2 3.32Å; N238-V242 WeakPolarHBondContact O-CG2 3.47Å; N238-V242 PolarHBondContact O-N 3.02Å; N238-K276 WeakPolarHBondContact ND2-CE 3.42Å; N238-K276 PolarHBondContact ND2-NZ 2.64Å; N238-D309 PolarHBondContact OD1-OD1 2.99Å
239	G	91.1	Very high	92.4	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.035	C	C	.	.	I	π-helix	trans	-56.7	-47.1	161.9	0	0	0	0	0	111.1	G234 A235 S237 S243 L472	G234-G239 PolarHBondContact O-N 3.05Å; A235-G239 CarbonylContact O-C 3.54Å; A235-G239 VanDerWaalsContact O-CA 3.26Å; A235-G239 WeakPolarHBondContact O-CA 3.39Å; S237-G239 PolarHBondContact O-N 3.09Å; G239-S243 WeakPolarHBondContact O-CB 3.28Å; G239-S243 PolarHBondContact O-N 3.48Å; G239-S243 PolarHBondContact O-OG 3.32Å; G239-L472 WeakPolarHBondContact O-CD1 3.47Å
240	S	92.4	Very high	92.4	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-62	-44.4	174.3	66.6	0	0	0	0	113.1	A235 D236 N238 S243 M244 L311 G312	A235-S240 PolarHBondContact O-N 2.73Å; D236-S240 PolarHBondContact O-OG 3.44Å; D236-S240 PolarHBondContact OD1-OG 3.42Å; D236-S240 VanDerWaalsContact OD1-OG 3.09Å; N238-S240 VanDerWaalsContact C-N 3.29Å; S240-S243 WeakPolarHBondContact CA-OG 3.46Å; S240-S243 PolarHBondContact O-N 3.13Å; S240-S243 PolarHBondContact O-OG 2.7Å; S240-M244 PolarHBondContact O-N 3Å; S240-L311 PolarHBondContact OG-N 2.83Å; S240-G312 VanDerWaalsContact CB-N 3.31Å; S240-G312 PolarHBondContact OG-N 2.97Å
241	G	93.9	Very high	92.5	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-61	-46.1	178.4	0	0	0	0	0	113.2	N238 M244 L245	N238-G241 PolarHBondContact O-N 2.79Å; G241-M244 PolarHBondContact O-N 3.31Å; G241-L245 PolarHBondContact O-N 3.42Å
242	V	95.2	Very high	92.6	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-65.6	-42.4	176.1	174.3	0	0	0	0	111.2	A220 H221 N238 M244 L245 L246 V271 L472 L492	A220-V242 HydrophobicContact CB-CG2 4.23Å; H221-V242 WeakPolarHBondContact O-CG2 3.35Å; N238-V242 VanDerWaalsContact O-CG2 3.32Å; N238-V242 WeakPolarHBondContact O-CG2 3.47Å; N238-V242 PolarHBondContact O-N 3.02Å; V242-M244 VanDerWaalsContact C-N 3.29Å; V242-M244 PolarHBondContact O-N 2.99Å; V242-L245 WeakPolarHBondContact O-CB 3.4Å; V242-L245 PolarHBondContact O-N 2.96Å; V242-L245 VanDerWaalsContact O-N 3.16Å; V242-L246 HydrophobicContact CG1-CD1 4.15Å; V242-L246 HydrophobicContact CG1-CG 4.33Å; V242-L246 WeakPolarHBondContact O-CG 3.31Å; V242-L246 PolarHBondContact O-N 2.98Å; V242-V271 HydrophobicContact CG2-CG1 4.25Å; V242-L472 HydrophobicContact CB-CD1 4.05Å; V242-L472 HydrophobicContact CG1-CD1 4.02Å; V242-L492 HydrophobicContact CG1-CD2 3.97Å
243	S	94.7	Very high	92.6	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-60.5	-39.7	178.1	71.4	0	0	0	0	112.3	G239 S240 E247 L424 V469	G239-S243 WeakPolarHBondContact O-CB 3.28Å; G239-S243 PolarHBondContact O-N 3.48Å; G239-S243 PolarHBondContact O-OG 3.32Å; S240-S243 WeakPolarHBondContact CA-OG 3.46Å; S240-S243 PolarHBondContact O-N 3.13Å; S240-S243 PolarHBondContact O-OG 2.7Å; S243-E247 WeakPolarHBondContact O-CB 3.44Å; S243-E247 PolarHBondContact O-N 3.37Å; S243-E247 VanDerWaalsContact O-N 3.09Å; S243-L424 WeakPolarHBondContact OG-CD2 3.45Å; S243-V469 WeakPolarHBondContact OG-CG2 3.18Å
244	M	95.4	Very high	92.6	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-66.2	-43.2	173.8	-173.3	-176.4	-46.8	0	0	111.8	S240 G241 V242 L246 E247 L248 L308 L311 L424 N427 A428 V431	S240-M244 PolarHBondContact O-N 3Å; G241-M244 PolarHBondContact O-N 3.31Å; V242-M244 VanDerWaalsContact C-N 3.29Å; V242-M244 PolarHBondContact O-N 2.99Å; M244-L246 VanDerWaalsContact C-N 3.33Å; M244-L246 PolarHBondContact O-N 2.83Å; M244-E247 PolarHBondContact O-N 3.39Å; M244-L248 HydrophobicContact CG-CD1 4.13Å; M244-L248 HydrophobicContact CG-CG 4.28Å; M244-L248 WeakPolarHBondContact O-CB 3.28Å; M244-L248 VanDerWaalsContact O-CG 3.26Å; M244-L248 WeakPolarHBondContact O-CG 3.46Å; M244-L248 PolarHBondContact O-N 3.4Å; M244-L308 HydrophobicContact CB-CD1 4.34Å; M244-L308 HydrophobicContact CG-CD1 4.13Å; M244-L308 HydrophobicContact SD-CD1 4.04Å; M244-L308 HydrophobicContact SD-CD2 4.03Å; M244-L311 HydrophobicContact CE-CB 3.33Å; M244-L311 HydrophobicContact CE-CD1 3.3Å; M244-L311 HydrophobicContact CE-CG 3.88Å; M244-L311 HydrophobicContact SD-CD1 3.73Å; M244-L424 HydrophobicContact CE-CD1 3.92Å; M244-N427 HydrophobicContact CE-CB 4.3Å; M244-A428 HydrophobicContact CG-CB 3.89Å; M244-V431 HydrophobicContact SD-CB 4.3Å; M244-V431 HydrophobicContact SD-CG2 4.1Å
245	L	96.3	Very high	92.7	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-58.2	-45.6	177.3	-175.8	153.6	0	0	0	111.7	V218 A220 G241 V242 E247 L248 A249 F269 V271 L308 L496	V218-L245 HydrophobicContact CG1-CD1 4.31Å; V218-L245 HydrophobicContact CG1-CG 4.37Å; A220-L245 HydrophobicContact CB-CB 4.13Å; A220-L245 HydrophobicContact CB-CD1 3.59Å; G241-L245 PolarHBondContact O-N 3.42Å; V242-L245 WeakPolarHBondContact O-CB 3.4Å; V242-L245 PolarHBondContact O-N 2.96Å; V242-L245 VanDerWaalsContact O-N 3.16Å; L245-E247 VanDerWaalsContact C-N 3.33Å; L245-E247 PolarHBondContact O-N 2.98Å; L245-L248 PolarHBondContact O-N 3.16Å; L245-A249 WeakPolarHBondContact O-CB 3.38Å; L245-A249 PolarHBondContact O-N 2.67Å; L245-F269 HydrophobicContact CD2-CB 4.22Å; L245-F269 HydrophobicContact CD2-CD1 4.08Å; L245-F269 HydrophobicContact CG-CD1 4.07Å; L245-V271 HydrophobicContact CD1-CG2 4.27Å; L245-V271 HydrophobicContact CD2-CG2 3.79Å; L245-L308 HydrophobicContact CB-CD1 4.24Å; L245-L496 HydrophobicContact CD2-CD2 4.24Å
246	L	95.8	Very high	92.7	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-64.1	-38	177.9	-68	179.6	0	0	0	112.1	V242 M244 A249 R250 V468 L492 L496	V242-L246 HydrophobicContact CG1-CD1 4.15Å; V242-L246 HydrophobicContact CG1-CG 4.33Å; V242-L246 WeakPolarHBondContact O-CG 3.31Å; V242-L246 PolarHBondContact O-N 2.98Å; M244-L246 VanDerWaalsContact C-N 3.33Å; M244-L246 PolarHBondContact O-N 2.83Å; L246-A249 PolarHBondContact O-N 2.94Å; L246-R250 PolarHBondContact O-N 2.98Å; L246-V468 HydrophobicContact CD1-CG1 3.86Å; L246-L492 HydrophobicContact CD1-CD2 4.04Å; L246-L496 HydrophobicContact CD2-CD2 3.59Å; L246-L496 HydrophobicContact CD2-CG 3.92Å
247	E	94.9	Very high	92.6	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-70.1	-40.7	176	-177.5	64.4	176.7	0	0	112.1	S243 M244 L245 A249 R250 L251 V460 Q461 H464 L465	S243-E247 WeakPolarHBondContact O-CB 3.44Å; S243-E247 PolarHBondContact O-N 3.37Å; S243-E247 VanDerWaalsContact O-N 3.09Å; M244-E247 PolarHBondContact O-N 3.39Å; L245-E247 VanDerWaalsContact C-N 3.33Å; L245-E247 PolarHBondContact O-N 2.98Å; E247-A249 VanDerWaalsContact C-N 3.33Å; E247-A249 PolarHBondContact O-N 3.37Å; E247-R250 WeakPolarHBondContact O-CB 3.39Å; E247-R250 PolarHBondContact O-N 3.47Å; E247-R250 IonicContact OE1-CZ 3.38Å; E247-R250 IonicContact OE1-NE 3.65Å; E247-R250 PolarHBondContact OE1-NE 2.85Å; E247-R250 IonicContact OE1-NH2 2.95Å; E247-R250 PolarHBondContact OE1-NH2 3.27Å; E247-R250 IonicContact OE2-CZ 3.12Å; E247-R250 IonicContact OE2-NE 2.82Å; E247-R250 PolarHBondContact OE2-NE 3.12Å; E247-R250 IonicContact OE2-NH2 3.78Å; E247-L251 WeakPolarHBondContact O-CG 3.4Å; E247-L251 PolarHBondContact O-N 3.36Å; E247-V460 HydrophobicContact CG-CG1 4.1Å; E247-V460 WeakPolarHBondContact OE1-CA 3.18Å; E247-Q461 PolarHBondContact OE1-N 2.84Å; E247-H464 IonicContact OE2-CD2 2.78Å; E247-H464 PolarHBondContact OE2-CD2 2.89Å; E247-H464 IonicContact OE2-CG 2.61Å; E247-L465 HydrophobicContact CB-CD2 3.74Å; E247-L465 HydrophobicContact CG-CD2 4.07Å; E247-L465 HydrophobicContact CG-CG 4.35Å
248	L	95.2	Very high	92.4	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-60.7	-43.1	172.3	-68.9	174.2	0	0	0	110.9	V218 M244 L245 R250 L251 F252 F269 L308 V431 A432 L435	V218-L248 HydrophobicContact CG1-CD1 4.39Å; M244-L248 HydrophobicContact CG-CD1 4.13Å; M244-L248 HydrophobicContact CG-CG 4.28Å; M244-L248 WeakPolarHBondContact O-CB 3.28Å; M244-L248 VanDerWaalsContact O-CG 3.26Å; M244-L248 WeakPolarHBondContact O-CG 3.46Å; M244-L248 PolarHBondContact O-N 3.4Å; L245-L248 PolarHBondContact O-N 3.16Å; L248-R250 VanDerWaalsContact C-N 3.31Å; L248-R250 PolarHBondContact O-N 2.9Å; L248-L251 PolarHBondContact O-N 3.47Å; L248-F252 HydrophobicContact CB-CD2 4.37Å; L248-F252 HydrophobicContact CD2-CE2 4.22Å; L248-F252 WeakPolarHBondContact O-CB 3.47Å; L248-F252 VanDerWaalsContact O-CD2 3.24Å; L248-F252 WeakPolarHBondContact O-CD2 3.41Å; L248-F252 PolarHBondContact O-N 3.01Å; L248-F269 HydrophobicContact CB-CE1 4.07Å; L248-L308 HydrophobicContact CD1-CD1 3.84Å; L248-V431 HydrophobicContact CD1-CG1 3.95Å; L248-V431 HydrophobicContact CD2-CG1 4.47Å; L248-A432 HydrophobicContact CD2-CB 3.62Å; L248-L435 HydrophobicContact CD1-CD1 4.35Å
249	A	94.9	Very high	92	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-57.9	-43.3	174.6	0	0	0	0	0	111.6	L245 L246 E247 S253 F269 L500	L245-A249 WeakPolarHBondContact O-CB 3.38Å; L245-A249 PolarHBondContact O-N 2.67Å; L246-A249 PolarHBondContact O-N 2.94Å; E247-A249 VanDerWaalsContact C-N 3.33Å; E247-A249 PolarHBondContact O-N 3.37Å; A249-S253 WeakPolarHBondContact O-CB 3.41Å; A249-S253 PolarHBondContact O-N 3.06Å; A249-F269 HydrophobicContact CB-CD1 4.1Å; A249-F269 HydrophobicContact CB-CD2 4.44Å; A249-F269 HydrophobicContact CB-CE1 4.03Å; A249-F269 HydrophobicContact CB-CE2 4.38Å; A249-F269 HydrophobicContact CB-CG 4.3Å; A249-F269 HydrophobicContact CB-CZ 4.18Å; A249-L500 HydrophobicContact CB-CD1 4.3Å; A249-L500 HydrophobicContact CB-CD2 3.99Å; A249-L500 HydrophobicContact CB-CG 4.26Å
250	R	93.8	Very high	91.6	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.015	17%	0.172	C	C	.	.	H	α-helix	trans	-61.3	-45.5	175.3	-174.8	-172.4	73.3	72.7	-11.7	112.4	L246 E247 L248 K254 Q459 Y499	L246-R250 PolarHBondContact O-N 2.98Å; E247-R250 WeakPolarHBondContact O-CB 3.39Å; E247-R250 PolarHBondContact O-N 3.47Å; E247-R250 IonicContact OE1-CZ 3.38Å; E247-R250 IonicContact OE1-NE 3.65Å; E247-R250 PolarHBondContact OE1-NE 2.85Å; E247-R250 IonicContact OE1-NH2 2.95Å; E247-R250 PolarHBondContact OE1-NH2 3.27Å; E247-R250 IonicContact OE2-CZ 3.12Å; E247-R250 IonicContact OE2-NE 2.82Å; E247-R250 PolarHBondContact OE2-NE 3.12Å; E247-R250 IonicContact OE2-NH2 3.78Å; L248-R250 VanDerWaalsContact C-N 3.31Å; L248-R250 PolarHBondContact O-N 2.9Å; R250-K254 PolarHBondContact O-N 3.32Å; R250-Q459 PolarHBondContact NH2-O 3.37Å; R250-Y499 HydrophobicContact CB-CD1 4.29Å; R250-Y499 HydrophobicContact CB-CD2 4.36Å; R250-Y499 HydrophobicContact CB-CE1 4.24Å; R250-Y499 HydrophobicContact CB-CE2 4.29Å; R250-Y499 HydrophobicContact CB-CG 4.36Å; R250-Y499 HydrophobicContact CG-CD1 4.08Å; R250-Y499 HydrophobicContact CG-CE1 3.62Å; R250-Y499 HydrophobicContact CG-CE2 4.28Å
251	L	93.1	Very high	91.1	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-66.7	-49.2	-178.6	-70.2	-179	0	0	0	111.9	E247 L248 K254 L255 A432 F454 M458 V460	E247-L251 WeakPolarHBondContact O-CG 3.4Å; E247-L251 PolarHBondContact O-N 3.36Å; L248-L251 PolarHBondContact O-N 3.47Å; L251-K254 PolarHBondContact O-N 2.88Å; L251-L255 PolarHBondContact O-N 2.96Å; L251-A432 HydrophobicContact CD1-CB 3.98Å; L251-F454 HydrophobicContact CB-CD1 4.28Å; L251-F454 HydrophobicContact CB-CE1 3.83Å; L251-F454 HydrophobicContact CB-CZ 4.48Å; L251-F454 HydrophobicContact CD1-CD1 4.15Å; L251-F454 HydrophobicContact CD1-CE1 4.32Å; L251-F454 HydrophobicContact CD1-CG 4.48Å; L251-F454 HydrophobicContact CD2-CD1 4.09Å; L251-F454 HydrophobicContact CD2-CE1 4.47Å; L251-F454 HydrophobicContact CG-CD1 4.42Å; L251-F454 HydrophobicContact CG-CE1 4.44Å; L251-M458 WeakPolarHBondContact CD2-O 3.37Å; L251-M458 WeakPolarHBondContact O-CE 3.33Å; L251-V460 HydrophobicContact CD1-CG2 3.91Å
252	F	92.8	Very high	90.4	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-70.6	-31.6	180	-76.5	-69.7	0	0	0	112.4	L205 L248 K254 L255 Y256 L267 F269 L435 A436 I439 F454	L205-F252 HydrophobicContact CD1-CB 3.93Å; L248-F252 HydrophobicContact CB-CD2 4.37Å; L248-F252 HydrophobicContact CD2-CE2 4.22Å; L248-F252 WeakPolarHBondContact O-CB 3.47Å; L248-F252 VanDerWaalsContact O-CD2 3.24Å; L248-F252 WeakPolarHBondContact O-CD2 3.41Å; L248-F252 PolarHBondContact O-N 3.01Å; F252-K254 PolarHBondContact O-N 3.44Å; F252-L255 HydrophobicContact CD1-CD2 3.57Å; F252-L255 HydrophobicContact CE1-CD2 3.94Å; F252-L255 WeakPolarHBondContact O-CB 3.16Å; F252-L255 PolarHBondContact O-N 3.13Å; F252-Y256 HydrophobicContact CB-CD2 4.42Å; F252-Y256 HydrophobicContact CD1-CE2 4.07Å; F252-Y256 WeakPolarHBondContact O-CB 3.32Å; F252-Y256 WeakPolarHBondContact O-CD2 3.45Å; F252-Y256 PolarHBondContact O-N 2.92Å; F252-L267 HydrophobicContact CB-CD1 3.69Å; F252-L267 HydrophobicContact CD1-CD1 3.58Å; F252-L267 HydrophobicContact CD2-CD1 4.11Å; F252-L267 HydrophobicContact CE1-CD1 4.26Å; F252-L267 HydrophobicContact CG-CD1 3.51Å; F252-F269 HydrophobicContact CB-CZ 4.34Å; F252-F269 HydrophobicContact CD2-CZ 4.3Å; F252-L435 HydrophobicContact CE2-CB 4.2Å; F252-L435 HydrophobicContact CE2-CD1 4.06Å; F252-L435 HydrophobicContact CZ-CB 3.7Å; F252-L435 HydrophobicContact CZ-CD1 4.4Å; F252-A436 HydrophobicContact CE1-CB 4.33Å; F252-A436 HydrophobicContact CZ-CB 4.43Å; F252-I439 HydrophobicContact CD1-CD1 4.22Å; F252-I439 HydrophobicContact CE1-CD1 3.52Å; F252-I439 HydrophobicContact CZ-CD1 3.94Å; F252-F454 HydrophobicContact CE1-CZ 4.34Å; F252-F454 HydrophobicContact CZ-CZ 4.33Å
253	S	92.8	Very high	89.9	Confident	17 Å²	17	43.9 Å²	43.9	12%	0.119	20%	0.197	C	C	.	.	H	α-helix	trans	-56.7	-47.6	173.3	177.9	0	0	0	0	112.3	A249 L255 Y256 T257 Y499	A249-S253 WeakPolarHBondContact O-CB 3.41Å; A249-S253 PolarHBondContact O-N 3.06Å; S253-L255 VanDerWaalsContact C-N 3.31Å; S253-L255 PolarHBondContact O-N 3.34Å; S253-Y256 PolarHBondContact O-N 2.93Å; S253-T257 PolarHBondContact O-N 3.1Å; S253-T257 PolarHBondContact O-OG1 3.33Å; S253-Y499 WeakPolarHBondContact CB-O 3.21Å; S253-Y499 PolarHBondContact OG-O 3.47Å
254	K	90.1	Very high	89.4	Confident	68 Å²	68	46.7 Å²	46.7	30%	0.296	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-40.9	177	-71.7	-176.5	-179.7	-173.9	0	111.9	R250 L251 F252 T257 Y258 Q457 M458	R250-K254 PolarHBondContact O-N 3.32Å; L251-K254 PolarHBondContact O-N 2.88Å; F252-K254 PolarHBondContact O-N 3.44Å; K254-T257 PolarHBondContact O-N 3.13Å; K254-Y258 WeakPolarHBondContact O-CD2 3.24Å; K254-Q457 PolarHBondContact NZ-O 3.43Å; K254-Q457 VanDerWaalsContact NZ-O 3.16Å; K254-M458 HydrophobicContact CB-CE 3.67Å; K254-M458 HydrophobicContact CB-SD 3.56Å; K254-M458 VanDerWaalsContact CB-SD 3.56Å; K254-M458 HydrophobicContact CD-CE 4.34Å; K254-M458 HydrophobicContact CD-SD 3.41Å; K254-M458 WeakPolarHBondContact CD-SD 3.4Å; K254-M458 HydrophobicContact CG-SD 4.16Å
255	L	89	Confident	89.1	Confident	15 Å²	15	49.2 Å²	49.2	8%	0.079	23%	0.23	C	C	.	.	H	α-helix	trans	-67.9	-41.1	-179.4	-174.9	88.7	0	0	0	112.4	L251 F252 S253 T257 T261 Y440 M458	L251-L255 PolarHBondContact O-N 2.96Å; F252-L255 HydrophobicContact CD1-CD2 3.57Å; F252-L255 HydrophobicContact CE1-CD2 3.94Å; F252-L255 WeakPolarHBondContact O-CB 3.16Å; F252-L255 PolarHBondContact O-N 3.13Å; S253-L255 VanDerWaalsContact C-N 3.31Å; S253-L255 PolarHBondContact O-N 3.34Å; L255-T257 VanDerWaalsContact C-N 3.31Å; L255-T261 PolarHBondContact O-OG1 3.07Å; L255-Y440 HydrophobicContact CD1-CE2 4.06Å; L255-Y440 WeakPolarHBondContact CD1-OH 3.5Å; L255-Y440 HydrophobicContact CD2-CE2 3.73Å; L255-Y440 WeakPolarHBondContact CD2-OH 3.46Å; L255-Y440 HydrophobicContact CG-CE2 4.24Å; L255-Y440 WeakPolarHBondContact CG-OH 3.47Å; L255-M458 HydrophobicContact CB-CE 4.34Å
256	Y	88	Confident	88.9	Confident	13 Å²	13	49.4 Å²	49.4	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-77.9	-15.1	178.2	-81.7	-114.6	0	0	0	112.9	L205 F252 S253 H262 A263 Y265 L267	L205-Y256 HydrophobicContact CB-CD1 4.03Å; L205-Y256 HydrophobicContact CB-CE1 4.36Å; L205-Y256 HydrophobicContact CB-CG 4.31Å; L205-Y256 HydrophobicContact CD1-CD2 4.42Å; L205-Y256 HydrophobicContact CD1-CG 4.4Å; F252-Y256 HydrophobicContact CB-CD2 4.42Å; F252-Y256 HydrophobicContact CD1-CE2 4.07Å; F252-Y256 WeakPolarHBondContact O-CB 3.32Å; F252-Y256 WeakPolarHBondContact O-CD2 3.45Å; F252-Y256 PolarHBondContact O-N 2.92Å; S253-Y256 PolarHBondContact O-N 2.93Å; Y256-H262 PolarHBondContact O-CD2 3.05Å; Y256-A263 HydrophobicContact CE1-CB 3.98Å; Y256-A263 HydrophobicContact CE2-CB 4.02Å; Y256-A263 VanDerWaalsContact OH-CB 3.31Å; Y256-A263 WeakPolarHBondContact OH-CB 3.49Å; Y256-Y265 WeakPolarHBondContact CE1-O 3.26Å; Y256-Y265 PolarHBondContact OH-O 2.74Å; Y256-Y265 VanDerWaalsContact OH-O 3.07Å; Y256-L267 HydrophobicContact CD2-CD1 4.44Å; Y256-L267 HydrophobicContact CE2-CD1 3.56Å; Y256-L267 HydrophobicContact CE2-CG 4.21Å; Y256-L267 WeakPolarHBondContact OH-CG 3.43Å
257	T	87.3	Confident	88.7	Confident	103 Å²	103	49.5 Å²	49.5	63%	0.632	23%	0.232	S	C	*	.	H	α-helix	trans	-69.4	-34.1	177.1	-62	0	0	0	0	112.3	S253 K254 L255	S253-T257 PolarHBondContact O-N 3.1Å; S253-T257 PolarHBondContact O-OG1 3.33Å; K254-T257 PolarHBondContact O-N 3.13Å; L255-T257 VanDerWaalsContact C-N 3.31Å
258	Y	84.8	Confident	88.6	Confident	157 Å²	157	49.5 Å²	49.5	62%	0.616	23%	0.232	S	C	*	.	S	Bend	trans	-89.2	130	-178.3	-62.6	-80.7	0	0	0	112	K254 R260 T261 H262	K254-Y258 WeakPolarHBondContact O-CD2 3.24Å; Y258-R260 PolarHBondContact O-N 2.75Å; Y258-R260 VanDerWaalsContact O-N 3.16Å; Y258-T261 WeakPolarHBondContact CB-OG1 3.13Å; Y258-T261 CarbonylContact O-C 3.45Å; Y258-T261 PolarHBondContact O-N 3.21Å; Y258-T261 VanDerWaalsContact O-N 3.17Å; Y258-T261 PolarHBondContact O-OG1 3.07Å; Y258-H262 PolarHBondContact O-N 3.02Å
259	K	80.7	Confident	88.7	Confident	199 Å²	199	49.5 Å²	49.5	87%	0.865	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.9	-180	-65.5	-172.5	178.6	-175.8	0	114
260	R	82.8	Confident	88.7	Confident	241 Å²	241	49.4 Å²	49.4	91%	0.909	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-31.6	-178.3	-165.8	178.2	83	166.4	3.8	112.9	Y258	Y258-R260 PolarHBondContact O-N 2.75Å; Y258-R260 VanDerWaalsContact O-N 3.16Å
261	T	81.3	Confident	88.7	Confident	43 Å²	43	49.2 Å²	49.2	26%	0.264	23%	0.23	S	C	.	.	S	Bend	trans	-101.3	9.4	179.4	52.5	0	0	0	0	111.3	L255 Y258 A263 Y440	L255-T261 PolarHBondContact O-OG1 3.07Å; Y258-T261 WeakPolarHBondContact CB-OG1 3.13Å; Y258-T261 CarbonylContact O-C 3.45Å; Y258-T261 PolarHBondContact O-N 3.21Å; Y258-T261 VanDerWaalsContact O-N 3.17Å; Y258-T261 PolarHBondContact O-OG1 3.07Å; T261-A263 PolarHBondContact O-N 3.41Å; T261-Y440 WeakPolarHBondContact O-CE1 3.11Å; T261-Y440 PolarHBondContact O-OH 2.78Å
262	H	80.6	Confident	88.8	Confident	54 Å²	54	49.2 Å²	49.2	25%	0.25	23%	0.23	C	C	.	.			trans	-66.9	124.6	-179.6	-153.4	-73.1	0	0	0	109.6	T206 G207 V208 Y256 Y258	T206-H262 PolarHBondContact O-CE1 3.03Å; G207-H262 PolarHBondContact O-CE1 2.95Å; V208-H262 HydrophobicContact CG2-CB 3.47Å; V208-H262 VanDerWaalsContact CG2-CB 3.47Å; V208-H262 WeakPolarHBondContact CG2-ND1 3.27Å; V208-H262 WeakPolarHBondContact CG2-O 3.37Å; V208-H262 PolarHBondContact N-CE1 2.9Å; V208-H262 VanDerWaalsContact N-CE1 3.35Å; V208-H262 PolarHBondContact N-ND1 3.07Å; Y256-H262 PolarHBondContact O-CD2 3.05Å; Y258-H262 PolarHBondContact O-N 3.02Å
263	A	83.1	Confident	88.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.008	23%	0.23	C	C	.	.			trans	-83.2	164	-170.8	0	0	0	0	0	113.3	G207 V208 Y256 T261 Y265 I439 Y440	G207-A263 WeakPolarHBondContact CA-O 3.37Å; V208-A263 PolarHBondContact N-O 3.5Å; Y256-A263 HydrophobicContact CE1-CB 3.98Å; Y256-A263 HydrophobicContact CE2-CB 4.02Å; Y256-A263 VanDerWaalsContact OH-CB 3.31Å; Y256-A263 WeakPolarHBondContact OH-CB 3.49Å; T261-A263 PolarHBondContact O-N 3.41Å; A263-Y265 VanDerWaalsContact C-N 3.3Å; A263-I439 HydrophobicContact CB-CG2 3.31Å; A263-Y440 HydrophobicContact CB-CE1 4.08Å
264	A	85.2	Confident	88.7	Confident	59 Å²	59	48.3 Å²	48.3	49%	0.488	22%	0.224	S	C	.	.	S	Bend	trans	-92	17.5	173.5	0	0	0	0	0	113.2	L213	L213-A264 WeakPolarHBondContact CD2-O 3.22Å
265	Y	89.6	Confident	88.6	Confident	54 Å²	54	45.1 Å²	45.1	21%	0.212	21%	0.21	C	C	.	.	S	Bend	trans	-124.4	152.4	173.9	-77.1	-91.2	0	0	0	109.7	G207 P214 I216 Y256 A263 A303 I439	G207-Y265 WeakPolarHBondContact CA-O 3.29Å; P214-Y265 HydrophobicContact CB-CD1 3.86Å; P214-Y265 HydrophobicContact CB-CE1 3.73Å; P214-Y265 HydrophobicContact CG-CE1 4.24Å; P214-Y265 WeakPolarHBondContact O-CA 3.08Å; P214-Y265 WeakPolarHBondContact O-CD1 3.43Å; I216-Y265 HydrophobicContact CD1-CD1 3.91Å; I216-Y265 HydrophobicContact CD1-CE1 4.44Å; I216-Y265 HydrophobicContact CD1-CG 4.17Å; I216-Y265 HydrophobicContact CG1-CD1 4.04Å; Y256-Y265 WeakPolarHBondContact CE1-O 3.26Å; Y256-Y265 PolarHBondContact OH-O 2.74Å; Y256-Y265 VanDerWaalsContact OH-O 3.07Å; A263-Y265 VanDerWaalsContact C-N 3.3Å; Y265-A303 HydrophobicContact CE1-CB 4.15Å; Y265-I439 HydrophobicContact CD2-CB 4.44Å; Y265-I439 HydrophobicContact CD2-CG2 4.29Å; Y265-I439 WeakPolarHBondContact CD2-O 3.36Å
266	N	90.8	Very high	88.7	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	139.7	165.5	-69.4	-39.9	0	0	0	108.9	T206 G207 G210 L213 P214 T215 I216	T206-N266 WeakPolarHBondContact CA-OD1 3.33Å; G207-N266 PolarHBondContact N-OD1 3.3Å; G210-N266 PolarHBondContact O-ND2 2.77Å; G210-N266 PolarHBondContact O-OD1 2.83Å; L213-N266 PolarHBondContact O-ND2 2.91Å; L213-N266 VanDerWaalsContact O-ND2 3.11Å; P214-N266 PolarHBondContact O-N 2.77Å; T215-N266 CarbonylContact C-O 3.58Å; T215-N266 WeakPolarHBondContact CA-O 3.29Å; T215-N266 HydrophobicContact CG2-CB 4.02Å; T215-N266 WeakPolarHBondContact OG1-CB 3.36Å; I216-N266 PolarHBondContact N-O 3.07Å
267	L	92.5	Very high	88.8	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	129	171.2	-60.8	177	0	0	0	109.7	L205 I216 F252 Y256 F269 I439	L205-L267 HydrophobicContact CB-CB 4.25Å; L205-L267 HydrophobicContact CD1-CD1 4.49Å; L205-L267 PolarHBondContact N-O 2.83Å; L205-L267 PolarHBondContact O-N 2.86Å; I216-L267 HydrophobicContact CB-CD2 3.84Å; I216-L267 HydrophobicContact CD1-CD2 4.3Å; I216-L267 HydrophobicContact CG2-CD2 4.37Å; I216-L267 WeakPolarHBondContact O-CA 3.43Å; F252-L267 HydrophobicContact CB-CD1 3.69Å; F252-L267 HydrophobicContact CD1-CD1 3.58Å; F252-L267 HydrophobicContact CD2-CD1 4.11Å; F252-L267 HydrophobicContact CE1-CD1 4.26Å; F252-L267 HydrophobicContact CG-CD1 3.51Å; Y256-L267 HydrophobicContact CD2-CD1 4.44Å; Y256-L267 HydrophobicContact CE2-CD1 3.56Å; Y256-L267 HydrophobicContact CE2-CG 4.21Å; Y256-L267 WeakPolarHBondContact OH-CG 3.43Å; L267-F269 HydrophobicContact CB-CE2 3.93Å; L267-F269 HydrophobicContact CB-CZ 4.48Å; L267-F269 HydrophobicContact CD1-CE2 4.48Å; L267-F269 HydrophobicContact CD1-CZ 4.44Å; L267-I439 HydrophobicContact CD1-CD1 4.16Å; L267-I439 HydrophobicContact CD2-CD1 3.86Å; L267-I439 HydrophobicContact CG-CD1 4.49Å
268	L	93	Very high	88.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122	175	-169.8	166.6	0	0	0	107.8	E202 T215 I216 V217 V218 F270 W285 L298	E202-L268 HydrophobicContact CG-CD1 4.34Å; E202-L268 HydrophobicContact CG-CD2 3.75Å; E202-L268 HydrophobicContact CG-CG 4.04Å; E202-L268 WeakPolarHBondContact OE1-CD1 3.33Å; T215-L268 HydrophobicContact CG2-CB 3.88Å; I216-L268 PolarHBondContact O-N 3.16Å; V217-L268 CarbonylContact C-O 3.6Å; V217-L268 WeakPolarHBondContact CA-O 3.4Å; V217-L268 HydrophobicContact CG1-CD2 4.04Å; V217-L268 HydrophobicContact CG2-CB 4.36Å; V218-L268 PolarHBondContact N-O 3.14Å; L268-F270 HydrophobicContact CD2-CB 3.86Å; L268-W285 HydrophobicContact CD1-CZ2 3.89Å; L268-W285 HydrophobicContact CD2-CZ2 4.06Å; L268-L298 HydrophobicContact CD1-CD2 4.13Å
269	F	95.7	Very high	89.2	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.7	175.1	-65.3	-90.5	0	0	0	108.2	E202 G203 L205 V218 L245 L248 A249 F252 L267 L500	E202-F269 CarbonylContact C-O 3.5Å; E202-F269 WeakPolarHBondContact CA-O 3.37Å; G203-F269 PolarHBondContact N-O 2.72Å; G203-F269 PolarHBondContact O-N 3.48Å; L205-F269 HydrophobicContact CD1-CE2 3.89Å; L205-F269 HydrophobicContact CG-CE2 4.35Å; V218-F269 HydrophobicContact CB-CD1 4.02Å; V218-F269 HydrophobicContact CB-CE1 4.2Å; V218-F269 HydrophobicContact CG1-CD1 4.38Å; V218-F269 HydrophobicContact CG1-CE1 4.49Å; V218-F269 HydrophobicContact CG2-CE1 4.35Å; V218-F269 WeakPolarHBondContact O-CA 3.18Å; L245-F269 HydrophobicContact CD2-CB 4.22Å; L245-F269 HydrophobicContact CD2-CD1 4.08Å; L245-F269 HydrophobicContact CG-CD1 4.07Å; L248-F269 HydrophobicContact CB-CE1 4.07Å; A249-F269 HydrophobicContact CB-CD1 4.1Å; A249-F269 HydrophobicContact CB-CD2 4.44Å; A249-F269 HydrophobicContact CB-CE1 4.03Å; A249-F269 HydrophobicContact CB-CE2 4.38Å; A249-F269 HydrophobicContact CB-CG 4.3Å; A249-F269 HydrophobicContact CB-CZ 4.18Å; F252-F269 HydrophobicContact CB-CZ 4.34Å; F252-F269 HydrophobicContact CD2-CZ 4.3Å; L267-F269 HydrophobicContact CB-CE2 3.93Å; L267-F269 HydrophobicContact CB-CZ 4.48Å; L267-F269 HydrophobicContact CD1-CE2 4.48Å; L267-F269 HydrophobicContact CD1-CZ 4.44Å; F269-L500 HydrophobicContact CB-CD1 3.71Å; F269-L500 HydrophobicContact CD2-CD1 3.78Å; F269-L500 HydrophobicContact CD2-CD2 3.52Å; F269-L500 HydrophobicContact CD2-CG 4.34Å; F269-L500 HydrophobicContact CE2-CD2 3.75Å; F269-L500 HydrophobicContact CG-CD1 3.96Å; F269-L500 HydrophobicContact CG-CD2 4.39Å
270	F	95.1	Very high	89.7	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.1	-179.3	-179.3	-120	0	0	0	109.6	L201 E202 V218 V219 A220 L268 T282 W285	L201-F270 CarbonylContact O-C 3.52Å; L201-F270 WeakPolarHBondContact O-CA 2.97Å; L201-F270 VanDerWaalsContact O-CD2 3.25Å; L201-F270 WeakPolarHBondContact O-CD2 3.32Å; E202-F270 HydrophobicContact CB-CD2 4.27Å; V218-F270 PolarHBondContact O-N 2.89Å; V219-F270 VanDerWaalsContact CA-O 3.28Å; V219-F270 WeakPolarHBondContact CA-O 3.11Å; V219-F270 HydrophobicContact CG1-CD1 3.71Å; V219-F270 HydrophobicContact CG1-CE1 4.48Å; V219-F270 HydrophobicContact CG2-CB 4.28Å; V219-F270 HydrophobicContact CG2-CD1 4.28Å; A220-F270 PolarHBondContact N-O 2.78Å; A220-F270 VanDerWaalsContact N-O 3.11Å; L268-F270 HydrophobicContact CD2-CB 3.86Å; F270-T282 HydrophobicContact CE1-CG2 4.25Å; F270-W285 HydrophobicContact CD1-CD2 4.46Å; F270-W285 AromaticContact CD2-CD1 3.92Å; F270-W285 HydrophobicContact CD2-CD2 4.34Å; F270-W285 HydrophobicContact CD2-CG 4.14Å; F270-W285 AromaticContact CD2-NE1 3.95Å; F270-W285 HydrophobicContact CE1-CB 4.16Å; F270-W285 HydrophobicContact CE1-CD2 4.29Å; F270-W285 HydrophobicContact CE1-CG 4.15Å; F270-W285 HydrophobicContact CE2-CB 3.88Å; F270-W285 AromaticContact CE2-CD1 3.48Å; F270-W285 VanDerWaalsContact CE2-CD1 3.48Å; F270-W285 HydrophobicContact CE2-CD2 4.17Å; F270-W285 AromaticContact CE2-CG 3.56Å; F270-W285 HydrophobicContact CE2-CG 3.56Å; F270-W285 AromaticContact CE2-NE1 4Å; F270-W285 HydrophobicContact CZ-CB 3.48Å; F270-W285 VanDerWaalsContact CZ-CB 3.48Å; F270-W285 AromaticContact CZ-CD1 4Å; F270-W285 HydrophobicContact CZ-CD2 4.16Å; F270-W285 AromaticContact CZ-CG 3.58Å; F270-W285 HydrophobicContact CZ-CG 3.58Å
271	V	95.5	Very high	90.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	105	173.8	-159.7	0	0	0	0	108.3	S200 L201 A220 Y222 V242 L245 L492 L496	S200-V271 WeakPolarHBondContact CA-O 3.19Å; L201-V271 HydrophobicContact CB-CB 4.37Å; L201-V271 PolarHBondContact N-O 3.22Å; L201-V271 PolarHBondContact O-N 2.92Å; A220-V271 CarbonylContact O-C 3.54Å; A220-V271 VanDerWaalsContact O-CA 3.23Å; A220-V271 WeakPolarHBondContact O-CA 3.49Å; A220-V271 WeakPolarHBondContact O-CG1 3.48Å; Y222-V271 HydrophobicContact CD1-CG1 3.72Å; Y222-V271 HydrophobicContact CG-CG1 4.42Å; V242-V271 HydrophobicContact CG2-CG1 4.25Å; L245-V271 HydrophobicContact CD1-CG2 4.27Å; L245-V271 HydrophobicContact CD2-CG2 3.79Å; V271-L492 HydrophobicContact CG1-CD1 4.38Å; V271-L496 HydrophobicContact CG2-CD1 3.9Å
272	S	94.3	Very high	90.7	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	143.6	-174.5	56.3	0	0	0	0	111.9	A220 H221 Y222 T282 E368	A220-S272 PolarHBondContact O-N 2.98Å; H221-S272 VanDerWaalsContact CA-O 3.25Å; H221-S272 WeakPolarHBondContact CA-O 3.41Å; H221-S272 WeakPolarHBondContact CA-OG 3.3Å; H221-S272 WeakPolarHBondContact CB-OG 3.39Å; Y222-S272 VanDerWaalsContact CD1-O 3.28Å; Y222-S272 WeakPolarHBondContact CD1-O 3.46Å; Y222-S272 PolarHBondContact N-O 3.39Å; Y222-S272 VanDerWaalsContact N-O 3.11Å; S272-T282 VanDerWaalsContact CB-OG1 3.22Å; S272-T282 WeakPolarHBondContact CB-OG1 3.3Å; S272-T282 PolarHBondContact OG-OG1 3.45Å; S272-E368 WeakPolarHBondContact CB-OE1 3.47Å; S272-E368 PolarHBondContact OG-OE1 2.83Å
273	G	92.6	Very high	91.2	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.053	C	C	.	.	S	Bend	trans	-103.2	160.2	166.5	0	0	0	0	0	111.1	I198 T199 S200 D223 G275 G281	I198-G273 WeakPolarHBondContact CG2-O 3.37Å; T199-G273 WeakPolarHBondContact O-CA 3.44Å; S200-G273 PolarHBondContact OG-N 3.38Å; D223-G273 WeakPolarHBondContact OD2-CA 3.23Å; G273-G275 PolarHBondContact O-N 3.41Å; G273-G281 WeakPolarHBondContact O-CA 3.3Å; G273-G281 PolarHBondContact O-N 3.42Å
274	G	90.1	Very high	91.5	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	S	Bend	trans	64.2	23	-174.7	0	0	0	0	0	114.8	I198 D223 K276 F277 Y279 Q280	I198-G274 VanDerWaalsContact CG2-N 3.31Å; D223-G274 PolarHBondContact OD1-N 3.23Å; D223-G274 WeakPolarHBondContact OD2-CA 3.37Å; D223-G274 PolarHBondContact OD2-N 2.97Å; G274-K276 VanDerWaalsContact C-N 3.34Å; G274-K276 PolarHBondContact O-N 3.14Å; G274-F277 CarbonylContact O-C 3.54Å; G274-F277 PolarHBondContact O-N 2.95Å; G274-F277 VanDerWaalsContact O-N 3.15Å; G274-Y279 WeakPolarHBondContact O-CA 3.22Å; G274-Y279 PolarHBondContact O-N 3.43Å; G274-Y279 VanDerWaalsContact O-N 3.14Å; G274-Q280 PolarHBondContact O-N 3.44Å
275	G	89.1	Confident	91.7	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.01	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-47.6	178	0	0	0	0	0	112.7	D223 G273 F277 Y279	D223-G275 PolarHBondContact OD2-N 3.47Å; G273-G275 PolarHBondContact O-N 3.41Å; G275-F277 VanDerWaalsContact C-N 3.28Å; G275-F277 PolarHBondContact O-N 3.22Å; G275-Y279 VanDerWaalsContact O-CD1 3.23Å; G275-Y279 WeakPolarHBondContact O-CD1 3.11Å; G275-Y279 WeakPolarHBondContact O-CE1 3Å; G275-Y279 PolarHBondContact O-N 2.94Å
276	K	90.3	Very high	91.7	Very high	20 Å²	20	8.3 Å²	8.3	9%	0.087	4%	0.035	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-16.5	179.8	-63.6	-69.1	-162.3	-166.5	0	114.1	D223 F225 S237 N238 G274 N278 M364 R393	D223-K276 HydrophobicContact CB-CG 4.32Å; F225-K276 HydrophobicContact CB-CB 3.78Å; F225-K276 HydrophobicContact CB-CD 3.96Å; F225-K276 HydrophobicContact CB-CG 3.65Å; F225-K276 HydrophobicContact CD2-CB 3.98Å; F225-K276 HydrophobicContact CG-CB 4.16Å; S237-K276 PolarHBondContact OG-NZ 3.25Å; N238-K276 WeakPolarHBondContact ND2-CE 3.42Å; N238-K276 PolarHBondContact ND2-NZ 2.64Å; G274-K276 VanDerWaalsContact C-N 3.34Å; G274-K276 PolarHBondContact O-N 3.14Å; K276-N278 PolarHBondContact O-N 3.34Å; K276-M364 WeakPolarHBondContact O-CE 3.38Å; K276-R393 WeakPolarHBondContact CE-O 3.44Å; K276-R393 PolarHBondContact NZ-O 2.9Å
277	F	89.7	Confident	91.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	55.1	175.4	-68	-76.5	0	0	0	110.1	Y51 L53 F225 G274 G275 Y279 Q280 A479 Q480 F519	Y51-F277 AromaticContact CD1-CE1 3.79Å; Y51-F277 HydrophobicContact CD1-CE1 3.79Å; Y51-F277 HydrophobicContact CD1-CZ 4.43Å; Y51-F277 HydrophobicContact CD2-CD1 4.25Å; Y51-F277 AromaticContact CD2-CE1 3.89Å; Y51-F277 HydrophobicContact CD2-CE1 3.89Å; Y51-F277 AromaticContact CE1-CE1 3.98Å; Y51-F277 HydrophobicContact CE1-CE1 3.98Å; Y51-F277 HydrophobicContact CE2-CD1 4.36Å; Y51-F277 HydrophobicContact CE2-CE1 4.08Å; Y51-F277 HydrophobicContact CG-CD1 4.49Å; Y51-F277 AromaticContact CG-CE1 3.74Å; Y51-F277 HydrophobicContact CG-CE1 3.74Å; L53-F277 HydrophobicContact CD1-CD1 4.39Å; L53-F277 HydrophobicContact CD2-CB 4.31Å; L53-F277 HydrophobicContact CD2-CD1 4.16Å; F225-F277 HydrophobicContact CD2-CZ 4.18Å; F225-F277 HydrophobicContact CE2-CE1 4.08Å; F225-F277 HydrophobicContact CE2-CZ 4.08Å; G274-F277 CarbonylContact O-C 3.54Å; G274-F277 PolarHBondContact O-N 2.95Å; G274-F277 VanDerWaalsContact O-N 3.15Å; G275-F277 VanDerWaalsContact C-N 3.28Å; G275-F277 PolarHBondContact O-N 3.22Å; F277-Y279 PolarHBondContact O-N 3.38Å; F277-Q280 WeakPolarHBondContact O-CG 3.43Å; F277-A479 HydrophobicContact CD2-CB 3.52Å; F277-A479 HydrophobicContact CE2-CB 3.53Å; F277-Q480 HydrophobicContact CZ-CG 4.41Å; F277-F519 AromaticContact CD1-CE1 3.86Å; F277-F519 HydrophobicContact CD1-CE1 3.86Å; F277-F519 HydrophobicContact CD1-CZ 4.3Å; F277-F519 HydrophobicContact CD2-CE1 4.15Å; F277-F519 AromaticContact CD2-CZ 3.9Å; F277-F519 HydrophobicContact CD2-CZ 3.9Å; F277-F519 AromaticContact CE1-CE1 3.72Å; F277-F519 HydrophobicContact CE1-CE1 3.72Å; F277-F519 HydrophobicContact CE1-CZ 4.43Å; F277-F519 HydrophobicContact CE2-CE1 4.02Å; F277-F519 HydrophobicContact CE2-CZ 4.04Å; F277-F519 HydrophobicContact CG-CE1 4.06Å; F277-F519 HydrophobicContact CG-CZ 4.03Å; F277-F519 AromaticContact CZ-CE1 3.81Å; F277-F519 HydrophobicContact CZ-CE1 3.81Å; F277-F519 HydrophobicContact CZ-CZ 4.31Å
278	N	89.8	Confident	91.1	Very high	8 Å²	8	11.7 Å²	11.7	4%	0.043	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	33.1	-179.9	-151.7	6.5	0	0	0	114.3	K276 Q280 D363 M364 L365 R371	K276-N278 PolarHBondContact O-N 3.34Å; N278-Q280 PolarHBondContact O-N 3.4Å; N278-D363 PolarHBondContact ND2-O 2.82Å; N278-M364 HydrophobicContact CB-SD 3.85Å; N278-L365 WeakPolarHBondContact OD1-CG 3.35Å; N278-L365 PolarHBondContact OD1-N 3.28Å; N278-R371 PolarHBondContact ND2-NH2 2.79Å; N278-R371 VanDerWaalsContact O-CZ 3.28Å; N278-R371 PolarHBondContact O-NE 3.46Å; N278-R371 PolarHBondContact O-NH2 3.35Å; N278-R371 PolarHBondContact OD1-NH2 2.86Å; N278-R371 VanDerWaalsContact OD1-NH2 3.08Å
279	Y	92.3	Very high	90.4	Very high	4 Å²	4	12.4 Å²	12.4	2%	0.016	6%	0.056	C	C	.	.	S	Bend	trans	55.1	46	174.7	-52.4	-75.1	0	0	0	114.7	H221 G274 G275 F277 G281 T282 K283 L365 A366 W367 E368 R371 R393	H221-Y279 AromaticContact CD2-CE1 3.85Å; H221-Y279 AromaticContact NE2-CE1 3.89Å; G274-Y279 WeakPolarHBondContact O-CA 3.22Å; G274-Y279 PolarHBondContact O-N 3.43Å; G274-Y279 VanDerWaalsContact O-N 3.14Å; G275-Y279 VanDerWaalsContact O-CD1 3.23Å; G275-Y279 WeakPolarHBondContact O-CD1 3.11Å; G275-Y279 WeakPolarHBondContact O-CE1 3Å; G275-Y279 PolarHBondContact O-N 2.94Å; F277-Y279 PolarHBondContact O-N 3.38Å; Y279-G281 PolarHBondContact O-N 3.31Å; Y279-T282 PolarHBondContact O-N 3.32Å; Y279-K283 PolarHBondContact O-N 3.1Å; Y279-L365 HydrophobicContact CD2-CB 4.2Å; Y279-L365 HydrophobicContact CE2-CB 4.19Å; Y279-A366 PolarHBondContact OH-O 3.47Å; Y279-W367 VanDerWaalsContact CZ-C 3.46Å; Y279-W367 VanDerWaalsContact OH-CA 3.3Å; Y279-W367 WeakPolarHBondContact OH-CA 3.46Å; Y279-E368 HydrophobicContact CD1-CB 3.62Å; Y279-E368 HydrophobicContact CD1-CG 3.55Å; Y279-E368 HydrophobicContact CE1-CB 3.43Å; Y279-E368 VanDerWaalsContact CE1-CB 3.43Å; Y279-E368 HydrophobicContact CE1-CG 3.9Å; Y279-E368 HydrophobicContact CG-CB 4.29Å; Y279-E368 HydrophobicContact CG-CG 4.15Å; Y279-E368 PolarHBondContact OH-N 2.88Å; Y279-R371 HydrophobicContact CD2-CG 4.32Å; Y279-R371 HydrophobicContact CG-CG 4.36Å; Y279-R393 PolarHBondContact OH-NH2 3.02Å
280	Q	90.8	Very high	89.5	Confident	5 Å²	5	13.1 Å²	13.1	2%	0.023	6%	0.059	C	C	.	.	H	α-helix	trans	-65.7	-37.1	-173.7	-72.1	-69.6	3.9	0	0	113.3	I198 G274 F277 N278 T282 K283 R284 E516 F517	I198-Q280 HydrophobicContact CD1-CB 4.27Å; G274-Q280 PolarHBondContact O-N 3.44Å; F277-Q280 WeakPolarHBondContact O-CG 3.43Å; N278-Q280 PolarHBondContact O-N 3.4Å; Q280-T282 VanDerWaalsContact C-N 3.34Å; Q280-T282 PolarHBondContact O-N 2.94Å; Q280-K283 PolarHBondContact O-N 3.36Å; Q280-R284 PolarHBondContact O-N 3.17Å; Q280-E516 PolarHBondContact NE2-OE2 2.82Å; Q280-E516 PolarHBondContact OE1-OE2 3.21Å; Q280-E516 VanDerWaalsContact OE1-OE2 3.13Å; Q280-F517 HydrophobicContact CB-CE1 4.49Å; Q280-F517 HydrophobicContact CG-CD1 4.06Å; Q280-F517 HydrophobicContact CG-CE1 4.41Å
281	G	91.1	Very high	88.3	Confident	1 Å²	1	17 Å²	17	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-56.8	-48.1	172.4	0	0	0	0	0	112.2	S200 G273 Y279 R284 W285	S200-G281 WeakPolarHBondContact OG-CA 3.2Å; G273-G281 WeakPolarHBondContact O-CA 3.3Å; G273-G281 PolarHBondContact O-N 3.42Å; Y279-G281 PolarHBondContact O-N 3.31Å; G281-R284 PolarHBondContact O-N 3.36Å; G281-W285 WeakPolarHBondContact O-CB 3.3Å; G281-W285 PolarHBondContact O-N 3.09Å
282	T	92.9	Very high	86.7	Confident	0 Å²	0	22 Å²	22	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.1	-40.7	-179.7	-45.5	0	0	0	0	112.1	F270 S272 Y279 Q280 W285 L286 E368 F372	F270-T282 HydrophobicContact CE1-CG2 4.25Å; S272-T282 VanDerWaalsContact CB-OG1 3.22Å; S272-T282 WeakPolarHBondContact CB-OG1 3.3Å; S272-T282 PolarHBondContact OG-OG1 3.45Å; Y279-T282 PolarHBondContact O-N 3.32Å; Q280-T282 VanDerWaalsContact C-N 3.34Å; Q280-T282 PolarHBondContact O-N 2.94Å; T282-W285 PolarHBondContact O-N 3.23Å; T282-L286 HydrophobicContact CG2-CD1 4.38Å; T282-L286 WeakPolarHBondContact O-CB 3.15Å; T282-L286 VanDerWaalsContact O-CG 3.25Å; T282-L286 WeakPolarHBondContact O-CG 3.48Å; T282-L286 PolarHBondContact O-N 3.29Å; T282-E368 HydrophobicContact CG2-CG 4.18Å; T282-E368 PolarHBondContact OG1-OE1 2.99Å; T282-F372 HydrophobicContact CG2-CD2 4.22Å; T282-F372 HydrophobicContact CG2-CE1 4.27Å; T282-F372 HydrophobicContact CG2-CE2 3.35Å; T282-F372 HydrophobicContact CG2-CZ 3.36Å
283	K	91.6	Very high	84.7	Confident	41 Å²	41	28 Å²	28	18%	0.178	14%	0.14	C	C	.	.	H	α-helix	trans	-58.5	-50.3	174.7	176.7	-177.2	164.1	-176.1	0	111.3	Y279 Q280 L286 E287 E516	Y279-K283 PolarHBondContact O-N 3.1Å; Q280-K283 PolarHBondContact O-N 3.36Å; K283-L286 WeakPolarHBondContact O-CB 3.46Å; K283-L286 PolarHBondContact O-N 3.4Å; K283-E287 WeakPolarHBondContact CE-OE1 3.5Å; K283-E287 WeakPolarHBondContact O-CG 3.36Å; K283-E287 PolarHBondContact O-N 3.35Å; K283-E516 IonicContact NZ-OE1 3.28Å; K283-E516 PolarHBondContact NZ-OE1 3.29Å; K283-E516 IonicContact NZ-OE2 3.8Å; K283-E516 PolarHBondContact NZ-OE2 2.77Å
284	R	88.9	Confident	82.6	Confident	81 Å²	81	35.4 Å²	35.4	31%	0.306	18%	0.18	S	C	.	.	H	α-helix	trans	-65.7	-42.8	-178.9	-175.7	66.2	-178.6	114.4	18	112	Q280 G281 L286 E287 D288 V508	Q280-R284 PolarHBondContact O-N 3.17Å; G281-R284 PolarHBondContact O-N 3.36Å; R284-L286 VanDerWaalsContact C-N 3.26Å; R284-L286 PolarHBondContact O-N 3.17Å; R284-E287 IonicContact NH1-OE2 2.98Å; R284-E287 WeakPolarHBondContact O-CB 3.26Å; R284-E287 PolarHBondContact O-N 3.28Å; R284-E287 VanDerWaalsContact O-N 3.16Å; R284-D288 IonicContact CZ-OD1 3.94Å; R284-D288 IonicContact CZ-OD2 3.84Å; R284-D288 VanDerWaalsContact CZ-OD2 3.23Å; R284-D288 IonicContact NE-OD1 3.34Å; R284-D288 IonicContact NE-OD2 2.75Å; R284-D288 IonicContact NH1-OD1 3.93Å; R284-D288 PolarHBondContact NH1-OD1 2.88Å; R284-D288 IonicContact NH1-OD2 3.07Å; R284-D288 IonicContact NH2-OD1 3.6Å; R284-D288 PolarHBondContact NH2-OD1 3.5Å; R284-D288 IonicContact NH2-OD2 3.1Å; R284-D288 PolarHBondContact NH2-OD2 3.4Å; R284-D288 VanDerWaalsContact NH2-OD2 3.07Å; R284-D288 PolarHBondContact O-N 2.67Å; R284-V508 HydrophobicContact CB-CB 4.17Å; R284-V508 HydrophobicContact CB-CG1 3.9Å; R284-V508 HydrophobicContact CB-CG2 3.36Å; R284-V508 HydrophobicContact CG-CB 4.3Å; R284-V508 HydrophobicContact CG-CG1 4.17Å; R284-V508 HydrophobicContact CG-CG2 3.71Å
285	W	89.6	Confident	80.8	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-59.7	-39.3	175.7	177.8	84.9	0	0	0	111.6	E202 V217 L268 F270 G281 T282 D288 N289 L298 F372 H506	E202-W285 PolarHBondContact OE2-NE1 2.72Å; V217-W285 HydrophobicContact CG1-CH2 4.18Å; L268-W285 HydrophobicContact CD1-CZ2 3.89Å; L268-W285 HydrophobicContact CD2-CZ2 4.06Å; F270-W285 HydrophobicContact CD1-CD2 4.46Å; F270-W285 AromaticContact CD2-CD1 3.92Å; F270-W285 HydrophobicContact CD2-CD2 4.34Å; F270-W285 HydrophobicContact CD2-CG 4.14Å; F270-W285 AromaticContact CD2-NE1 3.95Å; F270-W285 HydrophobicContact CE1-CB 4.16Å; F270-W285 HydrophobicContact CE1-CD2 4.29Å; F270-W285 HydrophobicContact CE1-CG 4.15Å; F270-W285 HydrophobicContact CE2-CB 3.88Å; F270-W285 AromaticContact CE2-CD1 3.48Å; F270-W285 VanDerWaalsContact CE2-CD1 3.48Å; F270-W285 HydrophobicContact CE2-CD2 4.17Å; F270-W285 AromaticContact CE2-CG 3.56Å; F270-W285 HydrophobicContact CE2-CG 3.56Å; F270-W285 AromaticContact CE2-NE1 4Å; F270-W285 HydrophobicContact CZ-CB 3.48Å; F270-W285 VanDerWaalsContact CZ-CB 3.48Å; F270-W285 AromaticContact CZ-CD1 4Å; F270-W285 HydrophobicContact CZ-CD2 4.16Å; F270-W285 AromaticContact CZ-CG 3.58Å; F270-W285 HydrophobicContact CZ-CG 3.58Å; G281-W285 WeakPolarHBondContact O-CB 3.3Å; G281-W285 PolarHBondContact O-N 3.09Å; T282-W285 PolarHBondContact O-N 3.23Å; W285-D288 PolarHBondContact O-N 3.36Å; W285-N289 VanDerWaalsContact CD1-ND2 3.3Å; W285-N289 PolarHBondContact NE1-ND2 2.8Å; W285-N289 VanDerWaalsContact NE1-ND2 3.17Å; W285-N289 WeakPolarHBondContact O-CB 3.44Å; W285-N289 PolarHBondContact O-N 3.14Å; W285-N289 PolarHBondContact O-ND2 3.16Å; W285-L298 HydrophobicContact CH2-CD1 3.26Å; W285-L298 HydrophobicContact CZ2-CD1 3.41Å; W285-L298 VanDerWaalsContact CZ2-CD1 3.41Å; W285-L298 HydrophobicContact CZ3-CD1 4.02Å; W285-F372 HydrophobicContact CE3-CE1 4.41Å; W285-F372 AromaticContact CZ3-CE1 3.76Å; W285-F372 HydrophobicContact CZ3-CE1 3.76Å; W285-F372 HydrophobicContact CZ3-CZ 4.34Å; W285-H506 AromaticContact CD1-CD2 3.62Å; W285-H506 AromaticContact CD1-CE1 3.93Å; W285-H506 AromaticContact CD1-NE2 3.51Å; W285-H506 AromaticContact NE1-NE2 3.77Å
286	L	89.6	Confident	79	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-45.6	173.2	-76.7	171.5	0	0	0	111.8	T282 K283 R284 D288 N289 L290 R371 F372 R375 L377	T282-L286 HydrophobicContact CG2-CD1 4.38Å; T282-L286 WeakPolarHBondContact O-CB 3.15Å; T282-L286 VanDerWaalsContact O-CG 3.25Å; T282-L286 WeakPolarHBondContact O-CG 3.48Å; T282-L286 PolarHBondContact O-N 3.29Å; K283-L286 WeakPolarHBondContact O-CB 3.46Å; K283-L286 PolarHBondContact O-N 3.4Å; R284-L286 VanDerWaalsContact C-N 3.26Å; R284-L286 PolarHBondContact O-N 3.17Å; L286-D288 PolarHBondContact O-N 2.69Å; L286-N289 PolarHBondContact O-N 3.03Å; L286-L290 HydrophobicContact CB-CD1 4Å; L286-L290 HydrophobicContact CD2-CD1 3.7Å; L286-L290 HydrophobicContact CG-CD1 4.44Å; L286-L290 WeakPolarHBondContact O-CB 3.4Å; L286-L290 WeakPolarHBondContact O-CD1 3.44Å; L286-L290 VanDerWaalsContact O-CG 3.28Å; L286-L290 WeakPolarHBondContact O-CG 3.46Å; L286-L290 PolarHBondContact O-N 3.26Å; L286-R371 HydrophobicContact CD1-CB 4.21Å; L286-F372 HydrophobicContact CD1-CD1 4.06Å; L286-F372 HydrophobicContact CD1-CE1 4.29Å; L286-F372 HydrophobicContact CD1-CG 4.37Å; L286-F372 HydrophobicContact CD2-CD1 3.71Å; L286-F372 HydrophobicContact CD2-CE1 3.76Å; L286-F372 HydrophobicContact CG-CD1 4.33Å; L286-F372 HydrophobicContact CG-CE1 4.23Å; L286-R375 HydrophobicContact CD1-CG 4.37Å; L286-L377 HydrophobicContact CD2-CD1 3.69Å
287	E	86.6	Confident	77.3	Confident	49 Å²	49	42 Å²	42	23%	0.229	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-44.8	175.6	-72.9	165.1	-176.3	0	0	112	K283 R284 N289 D291 R375	K283-E287 WeakPolarHBondContact CE-OE1 3.5Å; K283-E287 WeakPolarHBondContact O-CG 3.36Å; K283-E287 PolarHBondContact O-N 3.35Å; R284-E287 IonicContact NH1-OE2 2.98Å; R284-E287 WeakPolarHBondContact O-CB 3.26Å; R284-E287 PolarHBondContact O-N 3.28Å; R284-E287 VanDerWaalsContact O-N 3.16Å; E287-N289 PolarHBondContact O-N 2.99Å; E287-D291 WeakPolarHBondContact CA-OD2 3.37Å; E287-D291 WeakPolarHBondContact O-CA 3.26Å; E287-D291 WeakPolarHBondContact O-CB 3.43Å; E287-D291 PolarHBondContact O-N 2.91Å; E287-R375 VanDerWaalsContact CG-NH2 3.35Å
288	D	84.1	Confident	76	Confident	28 Å²	28	42.1 Å²	42.1	15%	0.15	23%	0.225	C	C	.	.	H	α-helix	trans	-67.2	-37.7	-179	-78	-24.8	0	0	0	113.1	R284 W285 L286 H292	R284-D288 IonicContact CZ-OD1 3.94Å; R284-D288 IonicContact CZ-OD2 3.84Å; R284-D288 VanDerWaalsContact CZ-OD2 3.23Å; R284-D288 IonicContact NE-OD1 3.34Å; R284-D288 IonicContact NE-OD2 2.75Å; R284-D288 IonicContact NH1-OD1 3.93Å; R284-D288 PolarHBondContact NH1-OD1 2.88Å; R284-D288 IonicContact NH1-OD2 3.07Å; R284-D288 IonicContact NH2-OD1 3.6Å; R284-D288 PolarHBondContact NH2-OD1 3.5Å; R284-D288 IonicContact NH2-OD2 3.1Å; R284-D288 PolarHBondContact NH2-OD2 3.4Å; R284-D288 VanDerWaalsContact NH2-OD2 3.07Å; R284-D288 PolarHBondContact O-N 2.67Å; W285-D288 PolarHBondContact O-N 3.36Å; L286-D288 PolarHBondContact O-N 2.69Å; D288-H292 WeakPolarHBondContact O-CB 3.42Å
289	N	79.9	Confident	74.5	Confident	16 Å²	16	46.4 Å²	46.4	9%	0.086	24%	0.244	C	C	.	.	H	α-helix	trans	-89.7	-22	-178.6	-70.8	-89.5	0	0	0	114.1	W285 L286 E287 L298	W285-N289 VanDerWaalsContact CD1-ND2 3.3Å; W285-N289 PolarHBondContact NE1-ND2 2.8Å; W285-N289 VanDerWaalsContact NE1-ND2 3.17Å; W285-N289 WeakPolarHBondContact O-CB 3.44Å; W285-N289 PolarHBondContact O-N 3.14Å; W285-N289 PolarHBondContact O-ND2 3.16Å; L286-N289 PolarHBondContact O-N 3.03Å; E287-N289 PolarHBondContact O-N 2.99Å; N289-L298 HydrophobicContact CB-CD1 3.57Å; N289-L298 HydrophobicContact CB-CG 4.29Å
290	L	76.3	Confident	73	Confident	15 Å²	15	53 Å²	53	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-99.1	-35.7	-179.8	-66.8	160.9	0	0	0	112.6	L286 Q299 R375 L377	L286-L290 HydrophobicContact CB-CD1 4Å; L286-L290 HydrophobicContact CD2-CD1 3.7Å; L286-L290 HydrophobicContact CG-CD1 4.44Å; L286-L290 WeakPolarHBondContact O-CB 3.4Å; L286-L290 WeakPolarHBondContact O-CD1 3.44Å; L286-L290 VanDerWaalsContact O-CG 3.28Å; L286-L290 WeakPolarHBondContact O-CG 3.46Å; L286-L290 PolarHBondContact O-N 3.26Å; L290-Q299 HydrophobicContact CD2-CB 4.39Å; L290-Q299 HydrophobicContact CD2-CG 3.43Å; L290-Q299 VanDerWaalsContact CD2-CG 3.43Å; L290-Q299 PolarHBondContact O-NE2 3.35Å; L290-R375 HydrophobicContact CD1-CB 3.84Å; L290-R375 HydrophobicContact CD1-CG 3.84Å; L290-L377 HydrophobicContact CD1-CD1 4.4Å
291	D	68.7	Low	72.4	Confident	82 Å²	82	54.9 Å²	54.9	44%	0.439	29%	0.29	S	S	.	.	S	Bend	trans	-93	-13.9	-171.4	-57	-33.6	0	0	0	112.2	E287 R375	E287-D291 WeakPolarHBondContact CA-OD2 3.37Å; E287-D291 WeakPolarHBondContact O-CA 3.26Å; E287-D291 WeakPolarHBondContact O-CB 3.43Å; E287-D291 PolarHBondContact O-N 2.91Å; D291-R375 IonicContact OD1-CZ 3.4Å; D291-R375 IonicContact OD1-NH1 3.4Å; D291-R375 PolarHBondContact OD1-NH1 2.9Å; D291-R375 IonicContact OD1-NH2 2.64Å; D291-R375 IonicContact OD2-CZ 3.61Å; D291-R375 IonicContact OD2-NH1 3.62Å; D291-R375 PolarHBondContact OD2-NH1 2.74Å; D291-R375 IonicContact OD2-NH2 3.19Å; D291-R375 PolarHBondContact OD2-NH2 2.81Å
292	H	63.8	Low	72.2	Confident	104 Å²	104	55.8 Å²	55.8	48%	0.481	30%	0.295	S	S	.	.			trans	-92.5	111.6	174.4	-67.3	22.7	0	0	0	110.8	D288 D294 S295	D288-H292 WeakPolarHBondContact O-CB 3.42Å; H292-D294 PolarHBondContact O-N 2.7Å; H292-S295 PolarHBondContact O-N 3.03Å; H292-S295 VanDerWaalsContact O-N 3.14Å
293	T	51.5	Low	72	Confident	126 Å²	126	56.3 Å²	56.3	77%	0.773	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-58.4	-21.8	-175.8	50.3	0	0	0	0	114.5
294	D	48.5	Very low	72	Confident	157 Å²	157	54.4 Å²	54.4	84%	0.84	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-90.7	-6.6	-176.6	-62.4	-16.6	0	0	0	113.5	H292	H292-D294 PolarHBondContact O-N 2.7Å
295	S	51.3	Low	72.3	Confident	63 Å²	63	50.5 Å²	50.5	44%	0.441	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-123.3	23.9	179.3	-66.6	0	0	0	0	113.2	H292 L297	H292-S295 PolarHBondContact O-N 3.03Å; H292-S295 VanDerWaalsContact O-N 3.14Å; S295-L297 PolarHBondContact O-N 3.26Å
296	S	52.8	Low	72.6	Confident	48 Å²	48	50.6 Å²	50.6	34%	0.336	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	35.3	-172.9	-170	0	0	0	0	115.3	L298	S296-L298 VanDerWaalsContact C-N 3.25Å; S296-L298 PolarHBondContact O-N 3.09Å
297	L	54.7	Low	72.9	Confident	47 Å²	47	50.4 Å²	50.4	25%	0.246	28%	0.277	C	S	.	.	H	α-helix	trans	-70.5	-23.1	174.3	-66.1	174.7	0	0	0	112.2	E211 S295 N301	E211-L297 HydrophobicContact CB-CD1 4.35Å; E211-L297 HydrophobicContact CB-CD2 3.84Å; E211-L297 VanDerWaalsContact CD-CD1 3.48Å; E211-L297 HydrophobicContact CG-CD1 4.35Å; E211-L297 WeakPolarHBondContact OE1-CD1 3.43Å; S295-L297 PolarHBondContact O-N 3.26Å; L297-N301 WeakPolarHBondContact O-CB 3.29Å
298	L	62.2	Low	73.4	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-95	-16.9	-174.6	-62.5	-173.7	0	0	0	115	L268 W285 N289 S296 V302	L268-L298 HydrophobicContact CD1-CD2 4.13Å; W285-L298 HydrophobicContact CH2-CD1 3.26Å; W285-L298 HydrophobicContact CZ2-CD1 3.41Å; W285-L298 VanDerWaalsContact CZ2-CD1 3.41Å; W285-L298 HydrophobicContact CZ3-CD1 4.02Å; N289-L298 HydrophobicContact CB-CD1 3.57Å; N289-L298 HydrophobicContact CB-CG 4.29Å; S296-L298 VanDerWaalsContact C-N 3.25Å; S296-L298 PolarHBondContact O-N 3.09Å; L298-V302 HydrophobicContact CB-CG2 3.88Å; L298-V302 HydrophobicContact CD2-CG2 3.67Å; L298-V302 HydrophobicContact CG-CG2 4.33Å; L298-V302 WeakPolarHBondContact O-CG2 3.34Å
299	Q	58.2	Low	73.8	Confident	97 Å²	97	47 Å²	47	45%	0.453	26%	0.26	S	S	.	.	H	α-helix	trans	-66.7	-46.3	-177.6	-84.4	-168.8	-6.8	0	0	112.2	L290	L290-Q299 HydrophobicContact CD2-CB 4.39Å; L290-Q299 HydrophobicContact CD2-CG 3.43Å; L290-Q299 VanDerWaalsContact CD2-CG 3.43Å; L290-Q299 PolarHBondContact O-NE2 3.35Å
300	D	60.6	Low	74.4	Confident	144 Å²	144	46.2 Å²	46.2	77%	0.77	26%	0.256	S	S	*	.	H	α-helix	trans	-109.3	-18.1	-172.1	-70	-24.6	0	0	0	113.8
301	N	78	Confident	75.1	Confident	44 Å²	44	45.6 Å²	45.6	24%	0.235	25%	0.253	C	S	.	.	H	α-helix	trans	-102.1	0.4	-175.4	-60.5	-9.6	0	0	0	113.9	E211 P214 T215 L297 A303	E211-N301 PolarHBondContact O-ND2 3.43Å; E211-N301 VanDerWaalsContact O-ND2 3.1Å; P214-N301 CarbonylContact C-O 3.39Å; P214-N301 WeakPolarHBondContact CA-O 3.36Å; T215-N301 PolarHBondContact N-O 2.69Å; L297-N301 WeakPolarHBondContact O-CB 3.29Å; N301-A303 PolarHBondContact O-N 2.91Å
302	V	86.4	Confident	76	Confident	19 Å²	19	41.7 Å²	41.7	12%	0.115	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.2	178.7	174	0	0	0	0	110.8	T215 V217 L298 V305 L377	T215-V302 WeakPolarHBondContact O-CA 3.19Å; V217-V302 HydrophobicContact CG2-CG1 4.34Å; V217-V302 HydrophobicContact CG2-CG2 4.41Å; L298-V302 HydrophobicContact CB-CG2 3.88Å; L298-V302 HydrophobicContact CD2-CG2 3.67Å; L298-V302 HydrophobicContact CG-CG2 4.33Å; L298-V302 WeakPolarHBondContact O-CG2 3.34Å; V302-V305 HydrophobicContact CG1-CG2 4.05Å; V302-L377 HydrophobicContact CB-CD2 4.17Å; V302-L377 HydrophobicContact CG1-CD2 4.41Å
303	A	87.9	Confident	76.9	Confident	12 Å²	12	38 Å²	38	10%	0.099	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	-52.1	176.2	0	0	0	0	0	111.3	P214 T215 I216 Y265 N301 P330 P378	P214-A303 HydrophobicContact CB-CB 3.98Å; T215-A303 PolarHBondContact O-N 3.35Å; I216-A303 HydrophobicContact CG1-CB 4.21Å; Y265-A303 HydrophobicContact CE1-CB 4.15Å; N301-A303 PolarHBondContact O-N 2.91Å; A303-P330 HydrophobicContact CB-CB 4.4Å; A303-P330 HydrophobicContact CB-CG 4.16Å; A303-P330 WeakPolarHBondContact O-CG 3.13Å; A303-P378 VanDerWaalsContact O-CG 3.24Å; A303-P378 WeakPolarHBondContact O-CG 3.41Å
304	F	92.8	Very high	78.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	165.8	171.8	62.5	-92.4	0	0	0	111.9	I216 V217 L306 P330 L334 P378 F380 L435 V438	I216-F304 HydrophobicContact CB-CZ 4.39Å; I216-F304 HydrophobicContact CD1-CE1 3.83Å; I216-F304 HydrophobicContact CD1-CZ 3.78Å; I216-F304 HydrophobicContact CG1-CD1 4.32Å; I216-F304 HydrophobicContact CG1-CE1 3.8Å; I216-F304 HydrophobicContact CG1-CE2 4.47Å; I216-F304 HydrophobicContact CG1-CZ 3.89Å; I216-F304 HydrophobicContact CG2-CD2 4Å; I216-F304 HydrophobicContact CG2-CE1 4.3Å; I216-F304 HydrophobicContact CG2-CE2 3.43Å; I216-F304 VanDerWaalsContact CG2-CE2 3.43Å; I216-F304 HydrophobicContact CG2-CZ 3.61Å; V217-F304 PolarHBondContact N-O 2.86Å; F304-L306 HydrophobicContact CE2-CB 4.36Å; F304-P330 HydrophobicContact CD1-CB 4Å; F304-P330 HydrophobicContact CD1-CG 4.42Å; F304-P330 HydrophobicContact CE1-CB 4.38Å; F304-L334 HydrophobicContact CD2-CD2 4.5Å; F304-L334 HydrophobicContact CE2-CD2 3.76Å; F304-L334 HydrophobicContact CZ-CB 4.38Å; F304-L334 HydrophobicContact CZ-CD1 4.48Å; F304-L334 HydrophobicContact CZ-CD2 4.05Å; F304-P378 CarbonylContact C-O 3.51Å; F304-P378 VanDerWaalsContact CA-O 3.24Å; F304-P378 WeakPolarHBondContact CA-O 3.35Å; F304-P378 HydrophobicContact CB-CB 4.4Å; F304-P378 HydrophobicContact CB-CG 4.44Å; F304-F380 HydrophobicContact CB-CE1 4Å; F304-F380 AromaticContact CD2-CE1 3.47Å; F304-F380 HydrophobicContact CD2-CE1 3.47Å; F304-F380 VanDerWaalsContact CD2-CE1 3.47Å; F304-F380 AromaticContact CD2-CZ 3.38Å; F304-F380 HydrophobicContact CD2-CZ 3.38Å; F304-F380 HydrophobicContact CE2-CE1 4.21Å; F304-F380 AromaticContact CE2-CZ 3.68Å; F304-F380 HydrophobicContact CE2-CZ 3.68Å; F304-F380 AromaticContact CG-CE1 3.95Å; F304-F380 HydrophobicContact CG-CE1 3.95Å; F304-F380 HydrophobicContact CG-CZ 4.25Å; F304-L435 HydrophobicContact CE2-CD2 4.22Å; F304-L435 HydrophobicContact CZ-CD2 4.17Å; F304-V438 HydrophobicContact CE1-CG1 4.09Å; F304-V438 HydrophobicContact CZ-CG1 4.43Å
305	V	94.6	Very high	80.2	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.1	175.6	-173	0	0	0	0	110	V217 V219 V302 F372 P378 A379 F380	V217-V305 HydrophobicContact CB-CB 4.33Å; V217-V305 HydrophobicContact CB-CG1 4.05Å; V217-V305 HydrophobicContact CB-CG2 4.02Å; V217-V305 HydrophobicContact CG1-CG1 4.13Å; V217-V305 HydrophobicContact CG2-CG2 4.32Å; V217-V305 CarbonylContact O-C 3.47Å; V217-V305 VanDerWaalsContact O-CA 3.31Å; V217-V305 WeakPolarHBondContact O-CA 3.34Å; V219-V305 HydrophobicContact CG2-CG1 3.56Å; V302-V305 HydrophobicContact CG1-CG2 4.05Å; V305-F372 HydrophobicContact CB-CD1 4.33Å; V305-F372 HydrophobicContact CB-CE1 4.48Å; V305-F372 HydrophobicContact CB-CG 4.44Å; V305-F372 HydrophobicContact CG1-CD1 4.14Å; V305-F372 HydrophobicContact CG1-CD2 4.1Å; V305-F372 HydrophobicContact CG1-CE1 3.89Å; V305-F372 HydrophobicContact CG1-CE2 3.85Å; V305-F372 HydrophobicContact CG1-CG 4.24Å; V305-F372 HydrophobicContact CG1-CZ 3.76Å; V305-F372 HydrophobicContact CG2-CD1 3.75Å; V305-F372 HydrophobicContact CG2-CE1 3.98Å; V305-F372 HydrophobicContact CG2-CG 4.26Å; V305-P378 PolarHBondContact N-O 2.98Å; V305-A379 HydrophobicContact CB-CB 3.78Å; V305-A379 HydrophobicContact CG2-CB 4.38Å; V305-A379 VanDerWaalsContact O-CA 3.31Å; V305-A379 WeakPolarHBondContact O-CA 3.22Å; V305-F380 PolarHBondContact O-N 3.25Å
306	L	96.1	Very high	82.2	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.016	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.8	172.4	165.9	63.5	0	0	0	108.8	V217 V218 V219 F304 L308 F380 L382 V431 L435	V217-L306 PolarHBondContact O-N 3.4Å; V218-L306 CarbonylContact C-O 3.54Å; V218-L306 WeakPolarHBondContact CA-O 3.09Å; V219-L306 PolarHBondContact N-O 3.02Å; F304-L306 HydrophobicContact CE2-CB 4.36Å; L306-L308 HydrophobicContact CD1-CD2 4Å; L306-L308 HydrophobicContact CD2-CD2 4.13Å; L306-L308 HydrophobicContact CG-CD2 4Å; L306-F380 HydrophobicContact CB-CE2 3.81Å; L306-F380 HydrophobicContact CB-CZ 3.94Å; L306-F380 HydrophobicContact CD1-CD2 3.87Å; L306-F380 HydrophobicContact CD1-CE2 3.38Å; L306-F380 HydrophobicContact CD1-CZ 4.34Å; L306-F380 HydrophobicContact CG-CE2 4.12Å; L306-L382 HydrophobicContact CD1-CB 4.03Å; L306-V431 HydrophobicContact CD2-CG1 3.91Å; L306-L435 HydrophobicContact CD2-CD1 3.89Å; L306-L435 HydrophobicContact CD2-CD2 4.01Å; L306-L435 HydrophobicContact CD2-CG 4.2Å
307	C	96.4	Very high	84.1	Confident	1 Å²	1	25 Å²	25	1%	0.007	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.5	173.8	-51.7	0	0	0	0	109.6	V219 E368 F380 T381 L382	V219-C307 CarbonylContact O-C 3.56Å; V219-C307 WeakPolarHBondContact O-CA 3.23Å; C307-E368 HydrophobicContact CB-CB 4.26Å; C307-F380 PolarHBondContact N-O 3.35Å; C307-T381 HydrophobicContact CB-CG2 4.21Å; C307-T381 WeakPolarHBondContact CB-OG1 3.18Å; C307-T381 CarbonylContact O-C 3.52Å; C307-T381 VanDerWaalsContact O-CA 3.32Å; C307-T381 WeakPolarHBondContact O-CA 3.41Å; C307-L382 PolarHBondContact O-N 2.51Å
308	L	95.9	Very high	86	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.2	178.4	-57.7	175.8	0	0	0	109.2	V218 V219 A220 M244 L245 L248 L306 L311 L382 V431	V218-L308 HydrophobicContact CG1-CD1 3.85Å; V218-L308 HydrophobicContact CG1-CG 4.31Å; V219-L308 PolarHBondContact O-N 3.04Å; A220-L308 HydrophobicContact CB-CB 4.34Å; M244-L308 HydrophobicContact CB-CD1 4.34Å; M244-L308 HydrophobicContact CG-CD1 4.13Å; M244-L308 HydrophobicContact SD-CD1 4.04Å; M244-L308 HydrophobicContact SD-CD2 4.03Å; L245-L308 HydrophobicContact CB-CD1 4.24Å; L248-L308 HydrophobicContact CD1-CD1 3.84Å; L306-L308 HydrophobicContact CD1-CD2 4Å; L306-L308 HydrophobicContact CD2-CD2 4.13Å; L306-L308 HydrophobicContact CG-CD2 4Å; L308-L311 HydrophobicContact CB-CD1 4.02Å; L308-L311 HydrophobicContact CD2-CD1 3.82Å; L308-L311 HydrophobicContact CG-CD1 4.48Å; L308-L382 HydrophobicContact CD2-CB 4.46Å; L308-L382 HydrophobicContact CD2-CD2 4.48Å; L308-V431 HydrophobicContact CD2-CG1 4.43Å
309	D	93.6	Very high	87.6	Confident	3 Å²	3	25 Å²	25	2%	0.016	14%	0.137	C	C	.	.			trans	-137.4	126	179.9	-173.4	-21.4	0	0	0	109	H221 N238 W367 T381 L382 S383 R393	H221-D309 IonicContact NE2-OD2 3.33Å; N238-D309 PolarHBondContact OD1-OD1 2.99Å; D309-W367 HydrophobicContact CB-CE3 4.41Å; D309-W367 HydrophobicContact CB-CZ3 4.05Å; D309-W367 WeakPolarHBondContact OD2-CZ3 3.35Å; D309-T381 HydrophobicContact CB-CG2 3.76Å; D309-L382 PolarHBondContact N-O 2.75Å; D309-L382 VanDerWaalsContact O-O 3.13Å; D309-S383 WeakPolarHBondContact O-CA 3.36Å; D309-S383 WeakPolarHBondContact O-CB 3.4Å; D309-R393 IonicContact OD1-NE 3.83Å; D309-R393 IonicContact OD2-CZ 2.86Å; D309-R393 IonicContact OD2-NE 3.17Å; D309-R393 PolarHBondContact OD2-NE 3.34Å; D309-R393 VanDerWaalsContact OD2-NE 3.07Å; D309-R393 IonicContact OD2-NH2 2.58Å; D309-R393 PolarHBondContact OD2-NH2 3.38Å
310	T	92.2	Very high	89.4	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.006	12%	0.116	C	C	.	.			trans	48.5	79.5	169.6	-49.9	0	0	0	0	113.5	D236 H384 L385	D236-T310 WeakPolarHBondContact O-CA 3.39Å; T310-H384 WeakPolarHBondContact CG2-CE1 3.44Å; T310-H384 PolarHBondContact O-N 2.93Å; T310-H384 PolarHBondContact O-ND1 2.82Å; T310-L385 HydrophobicContact CG2-CD1 3.58Å; T310-L385 HydrophobicContact CG2-CG 3.94Å
311	L	91.8	Very high	91	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	8%	0.079	C	C	.	.			trans	-127.4	13.1	-172.8	-70.1	165.3	0	0	0	113.4	S240 M244 L308 L317 L382 N427	S240-L311 PolarHBondContact OG-N 2.83Å; M244-L311 HydrophobicContact CE-CB 3.33Å; M244-L311 HydrophobicContact CE-CD1 3.3Å; M244-L311 HydrophobicContact CE-CG 3.88Å; M244-L311 HydrophobicContact SD-CD1 3.73Å; L308-L311 HydrophobicContact CB-CD1 4.02Å; L308-L311 HydrophobicContact CD2-CD1 3.82Å; L308-L311 HydrophobicContact CG-CD1 4.48Å; L311-L317 HydrophobicContact CD2-CD2 3.68Å; L311-L382 HydrophobicContact CD1-CD2 4.24Å; L311-L382 HydrophobicContact CD2-CD2 4.17Å; L311-L382 HydrophobicContact CD2-CG 3.99Å; L311-N427 PolarHBondContact O-ND2 3.46Å
312	G	86.1	Confident	91.6	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.072	C	C	.	.	S	Bend	trans	-86.4	-13.1	-174.8	0	0	0	0	0	114.6	D236 S240 D420	D236-G312 WeakPolarHBondContact OD1-CA 3.26Å; D236-G312 PolarHBondContact OD1-N 3.21Å; S240-G312 VanDerWaalsContact CB-N 3.31Å; S240-G312 PolarHBondContact OG-N 2.97Å; G312-D420 PolarHBondContact O-N 2.79Å
313	N	83.6	Confident	91.7	Very high	28 Å²	28	17.5 Å²	17.5	15%	0.15	9%	0.093	C	C	.	.	S	Bend	trans	-137.9	173.4	176.6	-150.2	-21	0	0	0	111.9	H384 H418	N313-H384 WeakPolarHBondContact O-CB 3.37Å; N313-H384 PolarHBondContact O-CD2 3.19Å; N313-H384 VanDerWaalsContact O-CD2 3.22Å; N313-H384 PolarHBondContact O-ND1 3.29Å; N313-H418 WeakPolarHBondContact CB-O 3.43Å; N313-H418 PolarHBondContact ND2-NE2 2.82Å; N313-H418 PolarHBondContact ND2-O 3.17Å
314	G	81.4	Confident	91.7	Very high	18 Å²	18	20.6 Å²	20.6	19%	0.186	11%	0.112	C	C	.	.			trans	88.9	147.8	175.6	0	0	0	0	0	114.9	R426	G314-R426 PolarHBondContact O-NH2 3.44Å
315	D	88	Confident	91.5	Very high	68 Å²	68	21.5 Å²	21.5	36%	0.364	12%	0.118	S	C	.	.	S	Bend	trans	-101.8	13	173.2	-59.7	-51	0	0	0	111.9	V349 K350 K423 R426	D315-V349 WeakPolarHBondContact O-CA 3.47Å; D315-K350 PolarHBondContact O-N 3.43Å; D315-K423 IonicContact OD1-NZ 2.92Å; D315-K423 PolarHBondContact OD1-NZ 3.37Å; D315-K423 IonicContact OD2-NZ 3.5Å; D315-K423 PolarHBondContact OD2-NZ 2.89Å; D315-R426 IonicContact OD1-CZ 3.67Å; D315-R426 IonicContact OD1-NH1 3.37Å; D315-R426 PolarHBondContact OD1-NH1 3.33Å; D315-R426 IonicContact OD1-NH2 2.82Å; D315-R426 PolarHBondContact OD1-NH2 3.37Å
316	S	92.3	Very high	91.2	Very high	31 Å²	31	29.4 Å²	29.4	22%	0.217	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.7	176	-58.9	0	0	0	0	109.2	K350 H384	S316-K350 CarbonylContact C-O 3.58Å; S316-K350 VanDerWaalsContact CA-O 3.24Å; S316-K350 WeakPolarHBondContact CA-O 3.3Å; S316-H384 VanDerWaalsContact O-CA 3.3Å; S316-H384 WeakPolarHBondContact O-CA 3.47Å; S316-H384 WeakPolarHBondContact O-CB 3.44Å
317	L	93.6	Very high	90.6	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.8	176	-69.1	177.5	0	0	0	109	L311 V349 K350 F351 S352 H384	L311-L317 HydrophobicContact CD2-CD2 3.68Å; L317-V349 HydrophobicContact CB-CG1 4.33Å; L317-V349 HydrophobicContact CD1-CG1 3.81Å; L317-V349 HydrophobicContact CG-CG1 3.84Å; L317-K350 PolarHBondContact N-O 3.03Å; L317-F351 HydrophobicContact CB-CD2 4.13Å; L317-F351 WeakPolarHBondContact O-CA 3.45Å; L317-S352 PolarHBondContact O-N 2.85Å; L317-H384 HydrophobicContact CD2-CB 4.45Å
318	Y	95.3	Very high	89.9	Confident	49 Å²	49	40.6 Å²	40.6	19%	0.192	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125	-179.4	-59.4	-83.6	0	0	0	110	S352 V354 S383 H384 L385 P386	Y318-S352 VanDerWaalsContact CA-O 3.3Å; Y318-S352 WeakPolarHBondContact CA-O 3.41Å; Y318-S352 WeakPolarHBondContact CD1-OG 3.46Å; Y318-S352 WeakPolarHBondContact CE1-OG 3.43Å; Y318-V354 HydrophobicContact CD1-CG2 3.77Å; Y318-V354 HydrophobicContact CG-CG2 4.41Å; Y318-S383 WeakPolarHBondContact CA-O 3.37Å; Y318-S383 PolarHBondContact N-O 2.95Å; Y318-S383 PolarHBondContact O-N 3.22Å; Y318-S383 VanDerWaalsContact O-O 3.13Å; Y318-H384 VanDerWaalsContact CD2-O 3.3Å; Y318-H384 WeakPolarHBondContact CD2-O 3.13Å; Y318-H384 VanDerWaalsContact CE2-O 3.25Å; Y318-H384 WeakPolarHBondContact CE2-O 3.47Å; Y318-L385 WeakPolarHBondContact CD2-O 3.38Å; Y318-P386 HydrophobicContact CD2-CB 4.43Å; Y318-P386 HydrophobicContact CE1-CB 4.22Å; Y318-P386 HydrophobicContact CE2-CB 4.01Å
319	L	95.4	Very high	89.5	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	105.3	170.5	-164.6	91.3	0	0	0	109	V321 L335 L338 F351 S352 M353 V354 F380 L382	L319-V321 HydrophobicContact CD2-CG1 3.88Å; L319-V321 HydrophobicContact CG-CG1 4.26Å; L319-L335 HydrophobicContact CD2-CB 4.43Å; L319-L335 HydrophobicContact CD2-CD1 3.82Å; L319-L335 HydrophobicContact CD2-CG 4.28Å; L319-L338 HydrophobicContact CD1-CD1 4.01Å; L319-F351 HydrophobicContact CB-CE2 4.02Å; L319-F351 HydrophobicContact CB-CZ 3.75Å; L319-F351 HydrophobicContact CD1-CZ 4.41Å; L319-F351 HydrophobicContact CD2-CZ 4.46Å; L319-F351 HydrophobicContact CG-CZ 4.44Å; L319-S352 PolarHBondContact N-O 3.5Å; L319-M353 WeakPolarHBondContact O-CA 3.39Å; L319-V354 PolarHBondContact O-N 3.01Å; L319-F380 HydrophobicContact CD1-CD2 3.52Å; L319-F380 HydrophobicContact CD1-CE2 4.08Å; L319-F380 HydrophobicContact CD1-CG 4.3Å; L319-F380 HydrophobicContact CG-CB 4.4Å; L319-F380 HydrophobicContact CG-CD2 4.2Å; L319-L382 HydrophobicContact CD1-CD1 3.94Å
320	H	95.3	Very high	89.2	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.019	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.2	178.6	-61.9	-83.2	0	0	0	110.4	V354 W367 H369 F380 T381 S383 L385 P386	H320-V354 WeakPolarHBondContact CA-O 3.24Å; H320-W367 HydrophobicContact CB-CG 4.47Å; H320-W367 AromaticContact CD2-CE2 3.8Å; H320-W367 AromaticContact CD2-CZ2 3.66Å; H320-W367 AromaticContact CE1-CE2 3.99Å; H320-W367 AromaticContact CE1-CZ2 3.62Å; H320-W367 AromaticContact CE1-NE1 3.92Å; H320-W367 AromaticContact CG-CE2 3.72Å; H320-W367 AromaticContact CG-CZ2 3.97Å; H320-W367 AromaticContact CG-NE1 3.46Å; H320-W367 AromaticContact ND1-CE2 3.84Å; H320-W367 AromaticContact ND1-CZ2 3.95Å; H320-W367 AromaticContact ND1-NE1 3.38Å; H320-W367 PolarHBondContact ND1-NE1 3.48Å; H320-W367 AromaticContact NE2-CE2 3.96Å; H320-W367 AromaticContact NE2-CZ2 3.41Å; H320-W367 WeakPolarHBondContact NE2-CZ2 3.4Å; H320-H369 PolarHBondContact O-CE1 3.26Å; H320-F380 VanDerWaalsContact O-CA 3.32Å; H320-F380 WeakPolarHBondContact O-CA 3.39Å; H320-F380 WeakPolarHBondContact O-CB 3.32Å; H320-T381 PolarHBondContact N-O 3.49Å; H320-T381 PolarHBondContact O-N 2.92Å; H320-S383 PolarHBondContact CD2-OG 2.94Å; H320-S383 PolarHBondContact NE2-OG 3.33Å; H320-L385 PolarHBondContact CE1-O 2.95Å; H320-L385 PolarHBondContact NE2-O 3.19Å; H320-P386 PolarHBondContact CE1-O 3.19Å
321	V	94.3	Very high	89	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	139.2	-178.1	-57.4	0	0	0	0	111.8	L319 M353 V354 H355 K356 F380	L319-V321 HydrophobicContact CD2-CG1 3.88Å; L319-V321 HydrophobicContact CG-CG1 4.26Å; V321-M353 HydrophobicContact CG1-CG 4.34Å; V321-M353 HydrophobicContact CG2-CG 3.91Å; V321-M353 HydrophobicContact CG2-SD 3.83Å; V321-V354 PolarHBondContact N-O 2.92Å; V321-H355 HydrophobicContact CG2-CB 4.01Å; V321-H355 WeakPolarHBondContact O-CA 3.31Å; V321-H355 PolarHBondContact O-CD2 2.9Å; V321-K356 PolarHBondContact O-N 3.36Å; V321-K356 VanDerWaalsContact O-N 3.07Å; V321-F380 HydrophobicContact CG1-CB 3.84Å
322	S	90.8	Very high	89	Confident	11 Å²	11	49.1 Å²	49.1	8%	0.077	27%	0.27	C	S	.	.	S	Bend	trans	-81	-30.2	174	57.7	0	0	0	0	113.6	H355 K356 H369	S322-H355 PolarHBondContact O-NE2 2.98Å; S322-K356 VanDerWaalsContact CA-O 3.32Å; S322-K356 WeakPolarHBondContact CA-O 3.45Å; S322-H369 PolarHBondContact N-NE2 3.2Å
323	K	89.1	Confident	89.2	Confident	129 Å²	129	51.5 Å²	51.5	56%	0.561	29%	0.287	S	S	*	.	S	Bend	trans	-137.6	130.3	178	-67.1	177.5	-175.9	167.8	0	106.7
324	P	87.8	Confident	89.5	Confident	77 Å²	77	50.3 Å²	50.3	50%	0.5	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-61.7	133.9	177.2	25.6	-32.6	0	0	0	109.5
325	P	89	Confident	90.1	Very high	19 Å²	19	50.1 Å²	50.1	12%	0.123	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-65.8	137.5	-178.8	26.6	-33.1	0	0	0	110.5	Q331 Y332 L335	P325-Q331 HydrophobicContact CB-CB 4.07Å; P325-Q331 HydrophobicContact CB-CG 3.78Å; P325-Y332 HydrophobicContact CG-CD2 4.41Å; P325-L335 HydrophobicContact CG-CD1 3.89Å
326	K	87.5	Confident	90.2	Very high	166 Å²	166	51.9 Å²	51.9	72%	0.722	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-84.1	145.3	176.9	-66.1	-176.5	179.8	-178.4	0	110.4	G328 T329 Y332	K326-G328 PolarHBondContact O-N 3.22Å; K326-T329 HydrophobicContact CB-CG2 4.12Å; K326-T329 WeakPolarHBondContact O-CB 3.46Å; K326-T329 WeakPolarHBondContact O-CG2 3.46Å; K326-T329 PolarHBondContact O-N 3.43Å; K326-T329 VanDerWaalsContact O-N 3.14Å; K326-T329 PolarHBondContact O-OG1 3.41Å; K326-Y332 VanDerWaalsContact O-CB 3.25Å; K326-Y332 WeakPolarHBondContact O-CB 3.34Å
327	E	83.4	Confident	90.1	Very high	161 Å²	161	50.9 Å²	50.9	75%	0.752	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	136.6	174.2	-62.2	-176.5	174.3	0	0	111.1	T329 Y332	E327-T329 VanDerWaalsContact C-N 3.35Å; E327-Y332 HydrophobicContact CB-CE1 4.41Å; E327-Y332 HydrophobicContact CG-CE1 4.08Å; E327-Y332 HydrophobicContact CG-CE2 4.27Å
328	G	82.3	Confident	90	Very high	78 Å²	78	51 Å²	51	80%	0.804	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	-4.4	-176.4	0	0	0	0	0	115.4	K326	K326-G328 PolarHBondContact O-N 3.22Å
329	T	87.7	Confident	89.8	Confident	48 Å²	48	53.1 Å²	53.1	29%	0.294	28%	0.283	S	S	.	.	S	Bend	trans	-84.7	149.4	171	63.4	0	0	0	0	111.4	K326 E327 Q331 Y332 S333	K326-T329 HydrophobicContact CB-CG2 4.12Å; K326-T329 WeakPolarHBondContact O-CB 3.46Å; K326-T329 WeakPolarHBondContact O-CG2 3.46Å; K326-T329 PolarHBondContact O-N 3.43Å; K326-T329 VanDerWaalsContact O-N 3.14Å; K326-T329 PolarHBondContact O-OG1 3.41Å; E327-T329 VanDerWaalsContact C-N 3.35Å; T329-Q331 PolarHBondContact O-N 2.98Å; T329-Y332 WeakPolarHBondContact O-CB 3.3Å; T329-Y332 PolarHBondContact O-N 3.37Å; T329-Y332 PolarHBondContact OG1-N 3.13Å; T329-S333 PolarHBondContact O-N 2.96Å; T329-S333 VanDerWaalsContact O-N 3.11Å; T329-S333 PolarHBondContact O-OG 3.16Å
330	P	85.9	Confident	89.5	Confident	44 Å²	44	55.1 Å²	55.1	29%	0.286	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-27.3	177.5	26.9	-36.8	0	0	0	112.6	A303 F304 S333 L334	A303-P330 HydrophobicContact CB-CB 4.4Å; A303-P330 HydrophobicContact CB-CG 4.16Å; A303-P330 WeakPolarHBondContact O-CG 3.13Å; F304-P330 HydrophobicContact CD1-CB 4Å; F304-P330 HydrophobicContact CD1-CG 4.42Å; F304-P330 HydrophobicContact CE1-CB 4.38Å; P330-S333 WeakPolarHBondContact O-CB 3.32Å; P330-S333 PolarHBondContact O-N 2.99Å; P330-L334 PolarHBondContact O-N 3.25Å
331	Q	88.8	Confident	89.2	Confident	21 Å²	21	55 Å²	55	10%	0.098	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-42.8	171.9	-170.8	-176.6	9.1	0	0	112.1	P325 T329 L334 L335 F380	P325-Q331 HydrophobicContact CB-CB 4.07Å; P325-Q331 HydrophobicContact CB-CG 3.78Å; T329-Q331 PolarHBondContact O-N 2.98Å; Q331-L334 PolarHBondContact O-N 3.05Å; Q331-L335 PolarHBondContact O-N 3.31Å; Q331-L335 VanDerWaalsContact O-N 3.17Å; Q331-F380 HydrophobicContact CG-CD1 3.69Å; Q331-F380 HydrophobicContact CG-CE1 3.8Å
332	Y	91.1	Very high	89	Confident	73 Å²	73	55.3 Å²	55.3	29%	0.286	30%	0.297	S	S	.	.	H	α-helix	trans	-67.1	-39.1	176	-178.8	-103.7	0	0	0	111.5	P325 K326 E327 T329 L334 L335 K336	P325-Y332 HydrophobicContact CG-CD2 4.41Å; K326-Y332 VanDerWaalsContact O-CB 3.25Å; K326-Y332 WeakPolarHBondContact O-CB 3.34Å; E327-Y332 HydrophobicContact CB-CE1 4.41Å; E327-Y332 HydrophobicContact CG-CE1 4.08Å; E327-Y332 HydrophobicContact CG-CE2 4.27Å; T329-Y332 WeakPolarHBondContact O-CB 3.3Å; T329-Y332 PolarHBondContact O-N 3.37Å; T329-Y332 PolarHBondContact OG1-N 3.13Å; Y332-L334 VanDerWaalsContact C-N 3.32Å; Y332-L334 PolarHBondContact O-N 3.4Å; Y332-L335 PolarHBondContact O-N 3.33Å; Y332-K336 PolarHBondContact O-N 3.06Å
333	S	90.4	Very high	88.9	Confident	50 Å²	50	58.4 Å²	58.4	35%	0.35	32%	0.323	S	S	.	.	H	α-helix	trans	-57.5	-45.8	174.7	-57.2	0	0	0	0	111.3	T329 P330 L335 K336 E337	T329-S333 PolarHBondContact O-N 2.96Å; T329-S333 VanDerWaalsContact O-N 3.11Å; T329-S333 PolarHBondContact O-OG 3.16Å; P330-S333 WeakPolarHBondContact O-CB 3.32Å; P330-S333 PolarHBondContact O-N 2.99Å; S333-L335 PolarHBondContact O-N 3.32Å; S333-K336 PolarHBondContact O-N 2.98Å; S333-E337 WeakPolarHBondContact O-CG 3.44Å; S333-E337 PolarHBondContact O-N 2.71Å
334	L	91.4	Very high	88.8	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-42.5	177	-172.1	75.3	0	0	0	112.8	F304 P330 Q331 Y332 K336 E337 L338 F380 A434 L435 V438	F304-L334 HydrophobicContact CD2-CD2 4.5Å; F304-L334 HydrophobicContact CE2-CD2 3.76Å; F304-L334 HydrophobicContact CZ-CB 4.38Å; F304-L334 HydrophobicContact CZ-CD1 4.48Å; F304-L334 HydrophobicContact CZ-CD2 4.05Å; P330-L334 PolarHBondContact O-N 3.25Å; Q331-L334 PolarHBondContact O-N 3.05Å; Y332-L334 VanDerWaalsContact C-N 3.32Å; Y332-L334 PolarHBondContact O-N 3.4Å; L334-K336 VanDerWaalsContact C-N 3.29Å; L334-K336 PolarHBondContact O-N 2.96Å; L334-E337 PolarHBondContact O-N 3.07Å; L334-L338 HydrophobicContact CD2-CD1 4.28Å; L334-L338 HydrophobicContact CG-CD1 4.05Å; L334-L338 HydrophobicContact CG-CG 4.35Å; L334-L338 WeakPolarHBondContact O-CB 3.44Å; L334-L338 WeakPolarHBondContact O-CG 3.5Å; L334-L338 PolarHBondContact O-N 3.09Å; L334-F380 HydrophobicContact CD2-CE1 4.24Å; L334-F380 HydrophobicContact CD2-CE2 3.4Å; L334-F380 VanDerWaalsContact CD2-CE2 3.4Å; L334-F380 HydrophobicContact CD2-CZ 3.14Å; L334-F380 HydrophobicContact CG-CZ 4.46Å; L334-A434 HydrophobicContact CD1-CB 4.22Å; L334-L435 HydrophobicContact CD1-CD2 3.99Å; L334-L435 HydrophobicContact CD1-CG 4.47Å; L334-L435 HydrophobicContact CD2-CD2 4.49Å; L334-V438 HydrophobicContact CB-CG2 3.98Å; L334-V438 HydrophobicContact CD1-CB 4.38Å; L334-V438 HydrophobicContact CD1-CG2 3.6Å; L334-V438 HydrophobicContact CG-CG2 4.39Å
335	L	92.1	Very high	88.6	Confident	14 Å²	14	51.8 Å²	51.8	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-57	-46.8	177.5	-179.3	152.6	0	0	0	110.8	L319 P325 Q331 Y332 S333 L338 E339 M353	L319-L335 HydrophobicContact CD2-CB 4.43Å; L319-L335 HydrophobicContact CD2-CD1 3.82Å; L319-L335 HydrophobicContact CD2-CG 4.28Å; P325-L335 HydrophobicContact CG-CD1 3.89Å; Q331-L335 PolarHBondContact O-N 3.31Å; Q331-L335 VanDerWaalsContact O-N 3.17Å; Y332-L335 PolarHBondContact O-N 3.33Å; S333-L335 PolarHBondContact O-N 3.32Å; L335-L338 PolarHBondContact O-N 3.23Å; L335-E339 HydrophobicContact CD2-CG 4.46Å; L335-E339 WeakPolarHBondContact CD2-OE1 3.3Å; L335-E339 WeakPolarHBondContact O-CG 3.1Å; L335-E339 PolarHBondContact O-N 3.39Å; L335-M353 HydrophobicContact CD1-CB 4.48Å; L335-M353 HydrophobicContact CD1-CG 4.28Å; L335-M353 HydrophobicContact CD1-SD 3.64Å
336	K	91.1	Very high	88.4	Confident	104 Å²	104	52.1 Å²	52.1	45%	0.452	29%	0.292	S	S	.	.	H	α-helix	trans	-65.2	-39.6	178.1	-172.2	-179.5	178.5	-175	0	112.4	Y332 S333 L334 E339 T340	Y332-K336 PolarHBondContact O-N 3.06Å; S333-K336 PolarHBondContact O-N 2.98Å; L334-K336 VanDerWaalsContact C-N 3.29Å; L334-K336 PolarHBondContact O-N 2.96Å; K336-E339 PolarHBondContact O-N 3.45Å; K336-T340 WeakPolarHBondContact O-CB 3.25Å; K336-T340 PolarHBondContact O-N 3.07Å; K336-T340 PolarHBondContact O-OG1 2.82Å
337	E	90.4	Very high	88.1	Confident	11 Å²	11	49.3 Å²	49.3	5%	0.051	29%	0.291	C	S	.	.	H	α-helix	trans	-66.5	-39.2	176.4	-71.4	-46.4	132.9	0	0	112.2	S333 L334 T340 V341 A434 R437 V438 T443	S333-E337 WeakPolarHBondContact O-CG 3.44Å; S333-E337 PolarHBondContact O-N 2.71Å; L334-E337 PolarHBondContact O-N 3.07Å; E337-T340 PolarHBondContact O-N 3.45Å; E337-V341 WeakPolarHBondContact O-CB 3.37Å; E337-V341 VanDerWaalsContact O-CG2 3.24Å; E337-V341 WeakPolarHBondContact O-CG2 3.46Å; E337-V341 PolarHBondContact O-N 3.41Å; E337-A434 HydrophobicContact CB-CB 4.46Å; E337-R437 HydrophobicContact CB-CB 4.44Å; E337-R437 HydrophobicContact CG-CB 4.02Å; E337-R437 VanDerWaalsContact OE2-CD 3.25Å; E337-R437 WeakPolarHBondContact OE2-CD 3.32Å; E337-V438 HydrophobicContact CB-CG2 4.21Å; E337-V438 HydrophobicContact CG-CG2 3.85Å; E337-T443 WeakPolarHBondContact OE1-CB 3.32Å; E337-T443 WeakPolarHBondContact OE1-CG2 3.24Å; E337-T443 PolarHBondContact OE1-OG1 3.1Å; E337-T443 PolarHBondContact OE2-OG1 3.23Å
338	L	90.9	Very high	88.3	Confident	6 Å²	6	46.9 Å²	46.9	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-47.7	173.9	-77.5	166.8	0	0	0	111.2	L319 L334 L335 T340 V341 V342 F351 V430 A434	L319-L338 HydrophobicContact CD1-CD1 4.01Å; L334-L338 HydrophobicContact CD2-CD1 4.28Å; L334-L338 HydrophobicContact CG-CD1 4.05Å; L334-L338 HydrophobicContact CG-CG 4.35Å; L334-L338 WeakPolarHBondContact O-CB 3.44Å; L334-L338 WeakPolarHBondContact O-CG 3.5Å; L334-L338 PolarHBondContact O-N 3.09Å; L335-L338 PolarHBondContact O-N 3.23Å; L338-T340 VanDerWaalsContact C-N 3.29Å; L338-T340 PolarHBondContact O-N 3.21Å; L338-V341 PolarHBondContact O-N 2.89Å; L338-V342 WeakPolarHBondContact O-CB 3.24Å; L338-V342 VanDerWaalsContact O-CG2 3.23Å; L338-V342 WeakPolarHBondContact O-CG2 3.11Å; L338-V342 PolarHBondContact O-N 3.02Å; L338-F351 HydrophobicContact CB-CE2 4.18Å; L338-F351 HydrophobicContact CB-CZ 4.03Å; L338-F351 HydrophobicContact CD1-CE2 4.24Å; L338-F351 HydrophobicContact CD1-CZ 4.21Å; L338-V430 HydrophobicContact CD2-CG1 4.22Å; L338-A434 HydrophobicContact CD2-CB 3.41Å; L338-A434 VanDerWaalsContact CD2-CB 3.41Å; L338-A434 HydrophobicContact CG-CB 3.73Å
339	E	91.3	Very high	88.6	Confident	92 Å²	92	43.4 Å²	43.4	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-58.4	-42.6	175.5	-73.4	176	171.7	0	0	111.8	L335 K336 A343 F351	L335-E339 HydrophobicContact CD2-CG 4.46Å; L335-E339 WeakPolarHBondContact CD2-OE1 3.3Å; L335-E339 WeakPolarHBondContact O-CG 3.1Å; L335-E339 PolarHBondContact O-N 3.39Å; K336-E339 PolarHBondContact O-N 3.45Å; E339-A343 VanDerWaalsContact O-CB 3.22Å; E339-A343 WeakPolarHBondContact O-CB 3.31Å; E339-A343 PolarHBondContact O-N 3.26Å; E339-F351 HydrophobicContact CG-CD1 3.58Å; E339-F351 HydrophobicContact CG-CE1 3.64Å
340	T	89.4	Confident	88.7	Confident	46 Å²	46	48.6 Å²	48.6	28%	0.282	26%	0.262	S	S	.	.	H	α-helix	trans	-66.8	-47	-179.7	-55.3	0	0	0	0	111.8	K336 E337 L338 A343 S344	K336-T340 WeakPolarHBondContact O-CB 3.25Å; K336-T340 PolarHBondContact O-N 3.07Å; K336-T340 PolarHBondContact O-OG1 2.82Å; E337-T340 PolarHBondContact O-N 3.45Å; L338-T340 VanDerWaalsContact C-N 3.29Å; L338-T340 PolarHBondContact O-N 3.21Å; T340-A343 PolarHBondContact O-N 3.45Å; T340-S344 WeakPolarHBondContact O-CB 3.35Å; T340-S344 PolarHBondContact O-N 3.37Å; T340-S344 PolarHBondContact O-OG 3.16Å; T340-S344 VanDerWaalsContact O-OG 3.07Å
341	V	89.1	Confident	89	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-43.3	179	170.1	0	0	0	0	111	E337 L338 Q345 V430 E433 A434	E337-V341 WeakPolarHBondContact O-CB 3.37Å; E337-V341 VanDerWaalsContact O-CG2 3.24Å; E337-V341 WeakPolarHBondContact O-CG2 3.46Å; E337-V341 PolarHBondContact O-N 3.41Å; L338-V341 PolarHBondContact O-N 2.89Å; V341-Q345 HydrophobicContact CG1-CG 4.48Å; V341-Q345 WeakPolarHBondContact O-CB 3.3Å; V341-Q345 PolarHBondContact O-N 3.06Å; V341-V430 HydrophobicContact CG1-CG1 4.2Å; V341-E433 HydrophobicContact CG1-CB 4.14Å; V341-E433 HydrophobicContact CG2-CB 4.33Å; V341-A434 HydrophobicContact CG2-CB 4.44Å
342	V	90.3	Very high	89.2	Confident	8 Å²	8	49.5 Å²	49.5	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-46.7	177.5	170.7	0	0	0	0	110.3	L338 S344 H346 V349 F351 V430	L338-V342 WeakPolarHBondContact O-CB 3.24Å; L338-V342 VanDerWaalsContact O-CG2 3.23Å; L338-V342 WeakPolarHBondContact O-CG2 3.11Å; L338-V342 PolarHBondContact O-N 3.02Å; V342-S344 PolarHBondContact O-N 3.44Å; V342-H346 CarbonylContact O-C 3.59Å; V342-H346 WeakPolarHBondContact O-CA 3.15Å; V342-H346 PolarHBondContact O-N 2.97Å; V342-H346 VanDerWaalsContact O-N 3.07Å; V342-V349 HydrophobicContact CG1-CB 4.11Å; V342-V349 HydrophobicContact CG1-CG1 4.41Å; V342-V349 WeakPolarHBondContact CG1-O 3.41Å; V342-F351 HydrophobicContact CB-CB 4.48Å; V342-F351 HydrophobicContact CG1-CB 4.16Å; V342-F351 HydrophobicContact CG2-CB 4.33Å; V342-V430 HydrophobicContact CG2-CG1 3.74Å
343	A	88.6	Confident	89.3	Confident	76 Å²	76	50 Å²	50	63%	0.628	27%	0.273	S	S	*	.	H	α-helix	trans	-65.3	-36.8	-179.5	0	0	0	0	0	113.7	E339 T340	E339-A343 VanDerWaalsContact O-CB 3.22Å; E339-A343 WeakPolarHBondContact O-CB 3.31Å; E339-A343 PolarHBondContact O-N 3.26Å; T340-A343 PolarHBondContact O-N 3.45Å
344	S	86.5	Confident	89.5	Confident	43 Å²	43	49.8 Å²	49.8	30%	0.301	27%	0.269	S	S	.	.	H	α-helix	trans	-85.6	-44	-178.3	65.9	0	0	0	0	113.6	T340 V342 G449	T340-S344 WeakPolarHBondContact O-CB 3.35Å; T340-S344 PolarHBondContact O-N 3.37Å; T340-S344 PolarHBondContact O-OG 3.16Å; T340-S344 VanDerWaalsContact O-OG 3.07Å; V342-S344 PolarHBondContact O-N 3.44Å; S344-G449 PolarHBondContact OG-O 3.03Å
345	Q	82.8	Confident	89.6	Confident	25 Å²	25	53.7 Å²	53.7	12%	0.117	29%	0.287	C	S	.	.	H	α-helix	trans	-98	-30.9	-169.3	-55	-174.2	15.4	0	0	113.2	V341	V341-Q345 HydrophobicContact CG1-CG 4.48Å; V341-Q345 WeakPolarHBondContact O-CB 3.3Å; V341-Q345 PolarHBondContact O-N 3.06Å
346	H	84.9	Confident	89.5	Confident	25 Å²	25	55.7 Å²	55.7	12%	0.116	30%	0.295	C	S	.	.			trans	-140.3	68.3	-170.4	-68.2	-71.5	0	0	0	112.2	V342 E348 V349	V342-H346 CarbonylContact O-C 3.59Å; V342-H346 WeakPolarHBondContact O-CA 3.15Å; V342-H346 PolarHBondContact O-N 2.97Å; V342-H346 VanDerWaalsContact O-N 3.07Å; H346-E348 IonicContact ND1-OE1 3.43Å; H346-E348 PolarHBondContact ND1-OE1 2.86Å; H346-E348 PolarHBondContact O-N 3.03Å; H346-V349 HydrophobicContact CB-CG2 4.21Å; H346-V349 PolarHBondContact O-N 3.39Å
347	P	82.6	Confident	89.4	Confident	108 Å²	108	58.5 Å²	58.5	70%	0.701	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.7	-177.8	28	-36	0	0	0	113.6	V349	P347-V349 VanDerWaalsContact C-N 3.3Å
348	E	85.9	Confident	89.3	Confident	109 Å²	109	59.9 Å²	59.9	51%	0.509	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-24.9	172.6	63.6	-137	-172.5	0	0	113.9	H346 R426	H346-E348 IonicContact ND1-OE1 3.43Å; H346-E348 PolarHBondContact ND1-OE1 2.86Å; H346-E348 PolarHBondContact O-N 3.03Å; E348-R426 WeakPolarHBondContact OE1-CD 3.47Å
349	V	88.5	Confident	89.1	Confident	6 Å²	6	63 Å²	63	4%	0.036	33%	0.331	C	S	.	.	S	Bend	trans	-91.3	124.7	-175.7	-179.8	0	0	0	0	110.2	D315 L317 V342 H346 P347 R426	D315-V349 WeakPolarHBondContact O-CA 3.47Å; L317-V349 HydrophobicContact CB-CG1 4.33Å; L317-V349 HydrophobicContact CD1-CG1 3.81Å; L317-V349 HydrophobicContact CG-CG1 3.84Å; V342-V349 HydrophobicContact CG1-CB 4.11Å; V342-V349 HydrophobicContact CG1-CG1 4.41Å; V342-V349 WeakPolarHBondContact CG1-O 3.41Å; H346-V349 HydrophobicContact CB-CG2 4.21Å; H346-V349 PolarHBondContact O-N 3.39Å; P347-V349 VanDerWaalsContact C-N 3.3Å; V349-R426 VanDerWaalsContact CG2-CZ 3.46Å
350	K	91	Very high	88.7	Confident	157 Å²	157	65.4 Å²	65.4	68%	0.683	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	112.1	174.2	-64.2	-179.3	-176	175.5	0	109.7	D315 S316 L317	D315-K350 PolarHBondContact O-N 3.43Å; S316-K350 CarbonylContact C-O 3.58Å; S316-K350 VanDerWaalsContact CA-O 3.24Å; S316-K350 WeakPolarHBondContact CA-O 3.3Å; L317-K350 PolarHBondContact N-O 3.03Å
351	F	92.9	Very high	88.3	Confident	37 Å²	37	67 Å²	67	16%	0.162	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135	174.2	-177.7	-99.7	0	0	0	111	L317 L319 L338 E339 V342 L382	L317-F351 HydrophobicContact CB-CD2 4.13Å; L317-F351 WeakPolarHBondContact O-CA 3.45Å; L319-F351 HydrophobicContact CB-CE2 4.02Å; L319-F351 HydrophobicContact CB-CZ 3.75Å; L319-F351 HydrophobicContact CD1-CZ 4.41Å; L319-F351 HydrophobicContact CD2-CZ 4.46Å; L319-F351 HydrophobicContact CG-CZ 4.44Å; L338-F351 HydrophobicContact CB-CE2 4.18Å; L338-F351 HydrophobicContact CB-CZ 4.03Å; L338-F351 HydrophobicContact CD1-CE2 4.24Å; L338-F351 HydrophobicContact CD1-CZ 4.21Å; E339-F351 HydrophobicContact CG-CD1 3.58Å; E339-F351 HydrophobicContact CG-CE1 3.64Å; V342-F351 HydrophobicContact CB-CB 4.48Å; V342-F351 HydrophobicContact CG1-CB 4.16Å; V342-F351 HydrophobicContact CG2-CB 4.33Å; F351-L382 HydrophobicContact CE2-CD1 4.2Å
352	S	92.6	Very high	87.9	Confident	47 Å²	47	70.6 Å²	70.6	33%	0.329	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	150.4	172.5	61.7	0	0	0	0	112.3	L317 Y318 L319	L317-S352 PolarHBondContact O-N 2.85Å; Y318-S352 VanDerWaalsContact CA-O 3.3Å; Y318-S352 WeakPolarHBondContact CA-O 3.41Å; Y318-S352 WeakPolarHBondContact CD1-OG 3.46Å; Y318-S352 WeakPolarHBondContact CE1-OG 3.43Å; L319-S352 PolarHBondContact N-O 3.5Å
353	M	93.3	Very high	87.2	Confident	83 Å²	83	73.5 Å²	73.5	41%	0.409	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	129.6	175.8	-176.7	-169.4	65.5	0	0	110.2	L319 V321 L335	L319-M353 WeakPolarHBondContact O-CA 3.39Å; V321-M353 HydrophobicContact CG1-CG 4.34Å; V321-M353 HydrophobicContact CG2-CG 3.91Å; V321-M353 HydrophobicContact CG2-SD 3.83Å; L335-M353 HydrophobicContact CD1-CB 4.48Å; L335-M353 HydrophobicContact CD1-CG 4.28Å; L335-M353 HydrophobicContact CD1-SD 3.64Å
354	V	94.2	Very high	87	Confident	46 Å²	46	73.3 Å²	73.3	28%	0.279	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.5	175.9	-179	0	0	0	0	108.7	Y318 L319 H320 V321	Y318-V354 HydrophobicContact CD1-CG2 3.77Å; Y318-V354 HydrophobicContact CG-CG2 4.41Å; L319-V354 PolarHBondContact O-N 3.01Å; H320-V354 WeakPolarHBondContact CA-O 3.24Å; V321-V354 PolarHBondContact N-O 2.92Å
355	H	92.4	Very high	87.1	Confident	84 Å²	84	72.1 Å²	72.1	39%	0.389	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.2	178.3	167.6	-109.5	0	0	0	111	V321 S322	V321-H355 HydrophobicContact CG2-CB 4.01Å; V321-H355 WeakPolarHBondContact O-CA 3.31Å; V321-H355 PolarHBondContact O-CD2 2.9Å; S322-H355 PolarHBondContact O-NE2 2.98Å
356	K	90.8	Very high	87.5	Confident	56 Å²	56	71.1 Å²	71.1	24%	0.243	37%	0.372	C	S	.	.			trans	-129.3	125.4	173.6	-175.3	-163.7	169.2	-155	0	109.1	V321 S322 A366 E370	V321-K356 PolarHBondContact O-N 3.36Å; V321-K356 VanDerWaalsContact O-N 3.07Å; S322-K356 VanDerWaalsContact CA-O 3.32Å; S322-K356 WeakPolarHBondContact CA-O 3.45Å; K356-A366 HydrophobicContact CD-CB 4.28Å; K356-E370 IonicContact NZ-OE1 2.81Å; K356-E370 PolarHBondContact NZ-OE1 2.99Å
357	K	88.7	Confident	87.9	Confident	163 Å²	163	70 Å²	70	71%	0.709	37%	0.367	S	S	*	.			trans	-70.9	140.5	172.9	-66.4	-177	-179	177.7	0	110.2	N359	K357-N359 PolarHBondContact O-N 3.29Å
358	I	87.9	Confident	88.4	Confident	40 Å²	40	65 Å²	65	21%	0.205	33%	0.334	C	S	.	.			trans	-67.4	123.6	176.7	-53.7	174.1	0	0	0	108.5	E370 I374	I358-E370 HydrophobicContact CD1-CB 4.34Å; I358-E370 HydrophobicContact CG1-CB 4.25Å; I358-E370 HydrophobicContact CG1-CG 4.15Å; I358-E370 HydrophobicContact CG2-CB 4.49Å; I358-I374 HydrophobicContact CD1-CG1 4.48Å; I358-I374 HydrophobicContact CG2-CG1 4.35Å
359	N	86.8	Confident	88.8	Confident	71 Å²	71	60 Å²	60	38%	0.38	31%	0.31	S	S	.	.			trans	-97.1	111	171.4	-174.2	12.4	0	0	0	108.7	K357 A361 D362	K357-N359 PolarHBondContact O-N 3.29Å; N359-A361 PolarHBondContact O-N 2.93Å; N359-A361 PolarHBondContact OD1-N 2.81Å; N359-D362 HydrophobicContact CB-CB 4.49Å; N359-D362 WeakPolarHBondContact CB-OD2 3.27Å; N359-D362 PolarHBondContact ND2-OD1 3.43Å; N359-D362 PolarHBondContact ND2-OD2 3.43Å
360	L	83.1	Confident	89.1	Confident	143 Å²	143	59.8 Å²	59.8	75%	0.749	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-13	179.4	-74.6	135.5	0	0	0	113
361	A	81.8	Confident	89.1	Confident	80 Å²	80	53.9 Å²	53.9	66%	0.661	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-12.9	178.6	0	0	0	0	0	113.1	N359	N359-A361 PolarHBondContact O-N 2.93Å; N359-A361 PolarHBondContact OD1-N 2.81Å
362	D	80.9	Confident	89.1	Confident	75 Å²	75	52.2 Å²	52.2	40%	0.401	28%	0.275	S	S	.	.			trans	-79.6	132.2	175.5	-72.3	-22.3	0	0	0	109.6	N359 M364	N359-D362 HydrophobicContact CB-CB 4.49Å; N359-D362 WeakPolarHBondContact CB-OD2 3.27Å; N359-D362 PolarHBondContact ND2-OD1 3.43Å; N359-D362 PolarHBondContact ND2-OD2 3.43Å; D362-M364 PolarHBondContact O-N 2.86Å
363	D	75.6	Confident	88.9	Confident	69 Å²	69	50.3 Å²	50.3	37%	0.369	26%	0.263	S	S	.	.	S	Bend	trans	-64.9	-31.1	179.4	-60.8	-33.7	0	0	0	111.8	Q56 N278	Q56-D363 PolarHBondContact NE2-OD2 3.12Å; N278-D363 PolarHBondContact ND2-O 2.82Å
364	M	84.1	Confident	88.8	Confident	73 Å²	73	49.8 Å²	49.8	36%	0.36	26%	0.261	S	S	.	.	S	Bend	trans	-114.2	126.5	-178.8	-69.5	-66.9	-81.9	0	0	111.8	L53 K276 N278 D362	L53-M364 HydrophobicContact CD1-CE 4.05Å; L53-M364 HydrophobicContact CD1-SD 3.54Å; L53-M364 VanDerWaalsContact CD1-SD 3.54Å; K276-M364 WeakPolarHBondContact O-CE 3.38Å; N278-M364 HydrophobicContact CB-SD 3.85Å; D362-M364 PolarHBondContact O-N 2.86Å
365	L	89.5	Confident	88.5	Confident	18 Å²	18	52.1 Å²	52.1	9%	0.094	27%	0.265	C	S	.	.			trans	-74.4	146.2	172	-63.4	176.5	0	0	0	111.2	N278 Y279 E370 R371 I374	N278-L365 WeakPolarHBondContact OD1-CG 3.35Å; N278-L365 PolarHBondContact OD1-N 3.28Å; Y279-L365 HydrophobicContact CD2-CB 4.2Å; Y279-L365 HydrophobicContact CE2-CB 4.19Å; L365-E370 WeakPolarHBondContact CA-OE2 3.27Å; L365-E370 HydrophobicContact CB-CB 4.45Å; L365-E370 WeakPolarHBondContact CB-OE2 3.5Å; L365-E370 HydrophobicContact CD1-CB 4.42Å; L365-E370 HydrophobicContact CD2-CB 4.18Å; L365-R371 HydrophobicContact CD1-CG 3.55Å; L365-R371 VanDerWaalsContact CD1-CZ 3.43Å; L365-I374 HydrophobicContact CD1-CD1 4.34Å; L365-I374 HydrophobicContact CD2-CD1 4.33Å
366	A	89.7	Confident	88.3	Confident	3 Å²	3	58.7 Å²	58.7	3%	0.025	29%	0.286	C	S	.	.	S	Bend	trans	-77.5	-42.7	-177.6	0	0	0	0	0	113	Y279 K356 E370 H388 R393	Y279-A366 PolarHBondContact OH-O 3.47Å; K356-A366 HydrophobicContact CD-CB 4.28Å; A366-E370 PolarHBondContact N-OE2 3.31Å; A366-H388 HydrophobicContact CB-CB 3.69Å; A366-H388 WeakPolarHBondContact CB-CD2 3.46Å; A366-R393 PolarHBondContact O-NH1 3.46Å; A366-R393 PolarHBondContact O-NH2 3.29Å
367	W	93.5	Very high	88.2	Confident	3 Å²	3	56.9 Å²	56.9	1%	0.011	28%	0.279	C	S	.	.	S	Bend	trans	-138.9	155.6	-174.3	-64.1	114.4	0	0	0	110.9	Y279 D309 H320 H369 E370 T381 S383 L385 H388 R393	Y279-W367 VanDerWaalsContact CZ-C 3.46Å; Y279-W367 VanDerWaalsContact OH-CA 3.3Å; Y279-W367 WeakPolarHBondContact OH-CA 3.46Å; D309-W367 HydrophobicContact CB-CE3 4.41Å; D309-W367 HydrophobicContact CB-CZ3 4.05Å; D309-W367 WeakPolarHBondContact OD2-CZ3 3.35Å; H320-W367 HydrophobicContact CB-CG 4.47Å; H320-W367 AromaticContact CD2-CE2 3.8Å; H320-W367 AromaticContact CD2-CZ2 3.66Å; H320-W367 AromaticContact CE1-CE2 3.99Å; H320-W367 AromaticContact CE1-CZ2 3.62Å; H320-W367 AromaticContact CE1-NE1 3.92Å; H320-W367 AromaticContact CG-CE2 3.72Å; H320-W367 AromaticContact CG-CZ2 3.97Å; H320-W367 AromaticContact CG-NE1 3.46Å; H320-W367 AromaticContact ND1-CE2 3.84Å; H320-W367 AromaticContact ND1-CZ2 3.95Å; H320-W367 AromaticContact ND1-NE1 3.38Å; H320-W367 PolarHBondContact ND1-NE1 3.48Å; H320-W367 AromaticContact NE2-CE2 3.96Å; H320-W367 AromaticContact NE2-CZ2 3.41Å; H320-W367 WeakPolarHBondContact NE2-CZ2 3.4Å; W367-H369 VanDerWaalsContact C-N 3.25Å; W367-H369 WeakPolarHBondContact CB-CE1 3.3Å; W367-H369 VanDerWaalsContact CB-ND1 3.28Å; W367-H369 WeakPolarHBondContact CB-ND1 3.47Å; W367-H369 AromaticContact CD1-CE1 3.67Å; W367-H369 AromaticContact CG-CE1 3.76Å; W367-H369 AromaticContact CG-ND1 3.99Å; W367-H369 PolarHBondContact O-N 2.89Å; W367-E370 WeakPolarHBondContact O-CB 3.33Å; W367-E370 PolarHBondContact O-N 2.85Å; W367-E370 VanDerWaalsContact O-N 3.07Å; W367-T381 HydrophobicContact CD2-CG2 4.27Å; W367-T381 HydrophobicContact CE3-CG2 3.72Å; W367-T381 HydrophobicContact CZ3-CG2 4.2Å; W367-S383 WeakPolarHBondContact CH2-OG 3.33Å; W367-L385 HydrophobicContact CH2-CB 4.35Å; W367-H388 HydrophobicContact CD2-CB 4.26Å; W367-H388 HydrophobicContact CZ2-CB 3.91Å; W367-R393 VanDerWaalsContact CE3-NH2 3.33Å
368	E	93.6	Very high	88.3	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.014	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-35.4	-176.6	-168.1	165.7	-160.9	0	0	112.3	V219 H221 S272 Y279 T282 C307 E370 R371 F372	V219-E368 HydrophobicContact CG1-CG 4.47Å; V219-E368 WeakPolarHBondContact CG1-OE1 3.37Å; V219-E368 WeakPolarHBondContact CG1-OE2 3.3Å; H221-E368 IonicContact CD2-OE2 3.9Å; S272-E368 WeakPolarHBondContact CB-OE1 3.47Å; S272-E368 PolarHBondContact OG-OE1 2.83Å; Y279-E368 HydrophobicContact CD1-CB 3.62Å; Y279-E368 HydrophobicContact CD1-CG 3.55Å; Y279-E368 HydrophobicContact CE1-CB 3.43Å; Y279-E368 VanDerWaalsContact CE1-CB 3.43Å; Y279-E368 HydrophobicContact CE1-CG 3.9Å; Y279-E368 HydrophobicContact CG-CB 4.29Å; Y279-E368 HydrophobicContact CG-CG 4.15Å; Y279-E368 PolarHBondContact OH-N 2.88Å; T282-E368 HydrophobicContact CG2-CG 4.18Å; T282-E368 PolarHBondContact OG1-OE1 2.99Å; C307-E368 HydrophobicContact CB-CB 4.26Å; E368-E370 PolarHBondContact O-N 3.15Å; E368-E370 VanDerWaalsContact O-N 3.12Å; E368-R371 WeakPolarHBondContact O-CB 3.37Å; E368-R371 PolarHBondContact O-N 3.06Å; E368-R371 VanDerWaalsContact O-N 3.1Å; E368-F372 HydrophobicContact CG-CE2 4.14Å; E368-F372 WeakPolarHBondContact O-CD2 3.35Å
369	H	94.3	Very high	88.6	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.009	25%	0.25	C	S	.	.	H	α-helix	trans	-61.1	-22.4	177.9	74.6	-96.1	0	0	0	113.6	H320 S322 W367 R371 F372 G373 A379 T381	H320-H369 PolarHBondContact O-CE1 3.26Å; S322-H369 PolarHBondContact N-NE2 3.2Å; W367-H369 VanDerWaalsContact C-N 3.25Å; W367-H369 WeakPolarHBondContact CB-CE1 3.3Å; W367-H369 VanDerWaalsContact CB-ND1 3.28Å; W367-H369 WeakPolarHBondContact CB-ND1 3.47Å; W367-H369 AromaticContact CD1-CE1 3.67Å; W367-H369 AromaticContact CG-CE1 3.76Å; W367-H369 AromaticContact CG-ND1 3.99Å; W367-H369 PolarHBondContact O-N 2.89Å; H369-R371 VanDerWaalsContact C-N 3.28Å; H369-R371 PolarHBondContact O-N 3.23Å; H369-F372 PolarHBondContact O-N 2.74Å; H369-G373 PolarHBondContact O-N 3.42Å; H369-A379 HydrophobicContact CB-CB 3.78Å; H369-T381 WeakPolarHBondContact ND1-CB 3.09Å; H369-T381 PolarHBondContact ND1-N 2.8Å; H369-T381 PolarHBondContact ND1-OG1 3.07Å
370	E	93.8	Very high	89	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-34	177.6	-62.3	-174.4	160.6	0	0	111	K356 I358 L365 A366 W367 E368 F372 G373 I374	K356-E370 IonicContact NZ-OE1 2.81Å; K356-E370 PolarHBondContact NZ-OE1 2.99Å; I358-E370 HydrophobicContact CD1-CB 4.34Å; I358-E370 HydrophobicContact CG1-CB 4.25Å; I358-E370 HydrophobicContact CG1-CG 4.15Å; I358-E370 HydrophobicContact CG2-CB 4.49Å; L365-E370 WeakPolarHBondContact CA-OE2 3.27Å; L365-E370 HydrophobicContact CB-CB 4.45Å; L365-E370 WeakPolarHBondContact CB-OE2 3.5Å; L365-E370 HydrophobicContact CD1-CB 4.42Å; L365-E370 HydrophobicContact CD2-CB 4.18Å; A366-E370 PolarHBondContact N-OE2 3.31Å; W367-E370 WeakPolarHBondContact O-CB 3.33Å; W367-E370 PolarHBondContact O-N 2.85Å; W367-E370 VanDerWaalsContact O-N 3.07Å; E368-E370 PolarHBondContact O-N 3.15Å; E368-E370 VanDerWaalsContact O-N 3.12Å; E370-F372 PolarHBondContact O-N 3.18Å; E370-G373 PolarHBondContact O-N 3.23Å; E370-I374 WeakPolarHBondContact O-CG1 3.33Å; E370-I374 PolarHBondContact O-N 3.46Å
371	R	92.2	Very high	89.5	Confident	34 Å²	34	39.3 Å²	39.3	13%	0.128	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-45.5	174.2	-75.2	-66	-173.8	-157.1	-0.3	111.9	N278 Y279 L286 L365 E368 H369 I374	N278-R371 PolarHBondContact ND2-NH2 2.79Å; N278-R371 VanDerWaalsContact O-CZ 3.28Å; N278-R371 PolarHBondContact O-NE 3.46Å; N278-R371 PolarHBondContact O-NH2 3.35Å; N278-R371 PolarHBondContact OD1-NH2 2.86Å; N278-R371 VanDerWaalsContact OD1-NH2 3.08Å; Y279-R371 HydrophobicContact CD2-CG 4.32Å; Y279-R371 HydrophobicContact CG-CG 4.36Å; L286-R371 HydrophobicContact CD1-CB 4.21Å; L365-R371 HydrophobicContact CD1-CG 3.55Å; L365-R371 VanDerWaalsContact CD1-CZ 3.43Å; E368-R371 WeakPolarHBondContact O-CB 3.37Å; E368-R371 PolarHBondContact O-N 3.06Å; E368-R371 VanDerWaalsContact O-N 3.1Å; H369-R371 VanDerWaalsContact C-N 3.28Å; H369-R371 PolarHBondContact O-N 3.23Å; R371-I374 PolarHBondContact O-N 3.22Å
372	F	92	Very high	90.2	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-40.4	176.1	-66.7	-84	0	0	0	111.7	V219 T282 W285 L286 V305 E368 H369 E370 I374 R375 R376 L377 A379	V219-F372 HydrophobicContact CG2-CE2 4.23Å; V219-F372 HydrophobicContact CG2-CZ 3.86Å; T282-F372 HydrophobicContact CG2-CD2 4.22Å; T282-F372 HydrophobicContact CG2-CE1 4.27Å; T282-F372 HydrophobicContact CG2-CE2 3.35Å; T282-F372 HydrophobicContact CG2-CZ 3.36Å; W285-F372 HydrophobicContact CE3-CE1 4.41Å; W285-F372 AromaticContact CZ3-CE1 3.76Å; W285-F372 HydrophobicContact CZ3-CE1 3.76Å; W285-F372 HydrophobicContact CZ3-CZ 4.34Å; L286-F372 HydrophobicContact CD1-CD1 4.06Å; L286-F372 HydrophobicContact CD1-CE1 4.29Å; L286-F372 HydrophobicContact CD1-CG 4.37Å; L286-F372 HydrophobicContact CD2-CD1 3.71Å; L286-F372 HydrophobicContact CD2-CE1 3.76Å; L286-F372 HydrophobicContact CG-CD1 4.33Å; L286-F372 HydrophobicContact CG-CE1 4.23Å; V305-F372 HydrophobicContact CB-CD1 4.33Å; V305-F372 HydrophobicContact CB-CE1 4.48Å; V305-F372 HydrophobicContact CB-CG 4.44Å; V305-F372 HydrophobicContact CG1-CD1 4.14Å; V305-F372 HydrophobicContact CG1-CD2 4.1Å; V305-F372 HydrophobicContact CG1-CE1 3.89Å; V305-F372 HydrophobicContact CG1-CE2 3.85Å; V305-F372 HydrophobicContact CG1-CG 4.24Å; V305-F372 HydrophobicContact CG1-CZ 3.76Å; V305-F372 HydrophobicContact CG2-CD1 3.75Å; V305-F372 HydrophobicContact CG2-CE1 3.98Å; V305-F372 HydrophobicContact CG2-CG 4.26Å; E368-F372 HydrophobicContact CG-CE2 4.14Å; E368-F372 WeakPolarHBondContact O-CD2 3.35Å; H369-F372 PolarHBondContact O-N 2.74Å; E370-F372 PolarHBondContact O-N 3.18Å; F372-I374 VanDerWaalsContact C-N 3.31Å; F372-I374 PolarHBondContact O-N 3.2Å; F372-R375 CarbonylContact O-C 3.55Å; F372-R375 PolarHBondContact O-N 3.41Å; F372-R375 VanDerWaalsContact O-N 3.13Å; F372-R376 PolarHBondContact O-N 3.24Å; F372-L377 HydrophobicContact CB-CB 4.19Å; F372-L377 HydrophobicContact CD1-CD1 3.95Å; F372-L377 PolarHBondContact O-N 2.89Å; F372-A379 HydrophobicContact CB-CB 3.42Å; F372-A379 VanDerWaalsContact CB-CB 3.42Å; F372-A379 HydrophobicContact CD2-CB 4.36Å; F372-A379 HydrophobicContact CG-CB 4.06Å
373	G	89.9	Confident	90.9	Very high	7 Å²	7	32 Å²	32	7%	0.072	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-34.4	177.7	0	0	0	0	0	113.9	H369 E370 R376	H369-G373 PolarHBondContact O-N 3.42Å; E370-G373 PolarHBondContact O-N 3.23Å; G373-R376 PolarHBondContact O-N 2.85Å; G373-R376 VanDerWaalsContact O-N 3.16Å
374	I	90.1	Very high	91.7	Very high	72 Å²	72	29.7 Å²	29.7	37%	0.369	13%	0.134	S	C	.	.	H	α-helix	trans	-63.6	-42.3	173.7	-68.2	163.6	0	0	0	110.8	I358 L365 E370 R371 F372 R376	I358-I374 HydrophobicContact CD1-CG1 4.48Å; I358-I374 HydrophobicContact CG2-CG1 4.35Å; L365-I374 HydrophobicContact CD1-CD1 4.34Å; L365-I374 HydrophobicContact CD2-CD1 4.33Å; E370-I374 WeakPolarHBondContact O-CG1 3.33Å; E370-I374 PolarHBondContact O-N 3.46Å; R371-I374 PolarHBondContact O-N 3.22Å; F372-I374 VanDerWaalsContact C-N 3.31Å; F372-I374 PolarHBondContact O-N 3.2Å; I374-R376 PolarHBondContact O-N 3.27Å
375	R	88	Confident	92.1	Very high	95 Å²	95	26.3 Å²	26.3	36%	0.358	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	10.8	175	-67.5	-67.1	-168.7	150.1	5.5	113.6	L286 E287 L290 D291 F372 L377	L286-R375 HydrophobicContact CD1-CG 4.37Å; E287-R375 VanDerWaalsContact CG-NH2 3.35Å; L290-R375 HydrophobicContact CD1-CB 3.84Å; L290-R375 HydrophobicContact CD1-CG 3.84Å; D291-R375 IonicContact OD1-CZ 3.4Å; D291-R375 IonicContact OD1-NH1 3.4Å; D291-R375 PolarHBondContact OD1-NH1 2.9Å; D291-R375 IonicContact OD1-NH2 2.64Å; D291-R375 IonicContact OD2-CZ 3.61Å; D291-R375 IonicContact OD2-NH1 3.62Å; D291-R375 PolarHBondContact OD2-NH1 2.74Å; D291-R375 IonicContact OD2-NH2 3.19Å; D291-R375 PolarHBondContact OD2-NH2 2.81Å; F372-R375 CarbonylContact O-C 3.55Å; F372-R375 PolarHBondContact O-N 3.41Å; F372-R375 VanDerWaalsContact O-N 3.13Å; R375-L377 VanDerWaalsContact C-N 3.26Å; R375-L377 PolarHBondContact O-N 3.17Å
376	R	87.9	Confident	92.1	Very high	222 Å²	222	29 Å²	29	84%	0.838	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	19.3	178.3	-51.8	179.3	177.3	-173.8	0.2	115.2	F372 G373 I374	F372-R376 PolarHBondContact O-N 3.24Å; G373-R376 PolarHBondContact O-N 2.85Å; G373-R376 VanDerWaalsContact O-N 3.16Å; I374-R376 PolarHBondContact O-N 3.27Å
377	L	88.8	Confident	92.2	Very high	18 Å²	18	31.2 Å²	31.2	9%	0.094	15%	0.151	C	C	.	.			trans	-82.9	139	173.1	-66.2	173.4	0	0	0	110.7	L286 L290 V302 F372 R375 A379	L286-L377 HydrophobicContact CD2-CD1 3.69Å; L290-L377 HydrophobicContact CD1-CD1 4.4Å; V302-L377 HydrophobicContact CB-CD2 4.17Å; V302-L377 HydrophobicContact CG1-CD2 4.41Å; F372-L377 HydrophobicContact CB-CB 4.19Å; F372-L377 HydrophobicContact CD1-CD1 3.95Å; F372-L377 PolarHBondContact O-N 2.89Å; R375-L377 VanDerWaalsContact C-N 3.26Å; R375-L377 PolarHBondContact O-N 3.17Å; L377-A379 PolarHBondContact O-N 3.35Å
378	P	91.2	Very high	91.9	Very high	44 Å²	44	33.2 Å²	33.2	29%	0.286	16%	0.16	S	C	.	.			trans	-69.8	113.7	174.7	23.4	-26.8	0	0	0	109.9	A303 F304 V305	A303-P378 VanDerWaalsContact O-CG 3.24Å; A303-P378 WeakPolarHBondContact O-CG 3.41Å; F304-P378 CarbonylContact C-O 3.51Å; F304-P378 VanDerWaalsContact CA-O 3.24Å; F304-P378 WeakPolarHBondContact CA-O 3.35Å; F304-P378 HydrophobicContact CB-CB 4.4Å; F304-P378 HydrophobicContact CB-CG 4.44Å; V305-P378 PolarHBondContact N-O 2.98Å
379	A	93	Very high	91.6	Very high	3 Å²	3	42.7 Å²	42.7	3%	0.025	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	153.2	-174.8	0	0	0	0	0	112.3	V305 H369 F372 L377	V305-A379 HydrophobicContact CB-CB 3.78Å; V305-A379 HydrophobicContact CG2-CB 4.38Å; V305-A379 VanDerWaalsContact O-CA 3.31Å; V305-A379 WeakPolarHBondContact O-CA 3.22Å; H369-A379 HydrophobicContact CB-CB 3.78Å; F372-A379 HydrophobicContact CB-CB 3.42Å; F372-A379 VanDerWaalsContact CB-CB 3.42Å; F372-A379 HydrophobicContact CD2-CB 4.36Å; F372-A379 HydrophobicContact CG-CB 4.06Å; L377-A379 PolarHBondContact O-N 3.35Å
380	F	95.3	Very high	91.3	Very high	1 Å²	1	43.8 Å²	43.8	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	154.5	176.6	49.8	-86.7	0	0	0	110.6	F304 V305 L306 C307 L319 H320 V321 Q331 L334	F304-F380 HydrophobicContact CB-CE1 4Å; F304-F380 AromaticContact CD2-CE1 3.47Å; F304-F380 HydrophobicContact CD2-CE1 3.47Å; F304-F380 VanDerWaalsContact CD2-CE1 3.47Å; F304-F380 AromaticContact CD2-CZ 3.38Å; F304-F380 HydrophobicContact CD2-CZ 3.38Å; F304-F380 HydrophobicContact CE2-CE1 4.21Å; F304-F380 AromaticContact CE2-CZ 3.68Å; F304-F380 HydrophobicContact CE2-CZ 3.68Å; F304-F380 AromaticContact CG-CE1 3.95Å; F304-F380 HydrophobicContact CG-CE1 3.95Å; F304-F380 HydrophobicContact CG-CZ 4.25Å; V305-F380 PolarHBondContact O-N 3.25Å; L306-F380 HydrophobicContact CB-CE2 3.81Å; L306-F380 HydrophobicContact CB-CZ 3.94Å; L306-F380 HydrophobicContact CD1-CD2 3.87Å; L306-F380 HydrophobicContact CD1-CE2 3.38Å; L306-F380 HydrophobicContact CD1-CZ 4.34Å; L306-F380 HydrophobicContact CG-CE2 4.12Å; C307-F380 PolarHBondContact N-O 3.35Å; L319-F380 HydrophobicContact CD1-CD2 3.52Å; L319-F380 HydrophobicContact CD1-CE2 4.08Å; L319-F380 HydrophobicContact CD1-CG 4.3Å; L319-F380 HydrophobicContact CG-CB 4.4Å; L319-F380 HydrophobicContact CG-CD2 4.2Å; H320-F380 VanDerWaalsContact O-CA 3.32Å; H320-F380 WeakPolarHBondContact O-CA 3.39Å; H320-F380 WeakPolarHBondContact O-CB 3.32Å; V321-F380 HydrophobicContact CG1-CB 3.84Å; Q331-F380 HydrophobicContact CG-CD1 3.69Å; Q331-F380 HydrophobicContact CG-CE1 3.8Å; L334-F380 HydrophobicContact CD2-CE1 4.24Å; L334-F380 HydrophobicContact CD2-CE2 3.4Å; L334-F380 VanDerWaalsContact CD2-CE2 3.4Å; L334-F380 HydrophobicContact CD2-CZ 3.14Å; L334-F380 HydrophobicContact CG-CZ 4.46Å
381	T	95.6	Very high	90.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.7	177	-59.9	0	0	0	0	109.9	C307 D309 H320 W367 H369	C307-T381 HydrophobicContact CB-CG2 4.21Å; C307-T381 WeakPolarHBondContact CB-OG1 3.18Å; C307-T381 CarbonylContact O-C 3.52Å; C307-T381 VanDerWaalsContact O-CA 3.32Å; C307-T381 WeakPolarHBondContact O-CA 3.41Å; D309-T381 HydrophobicContact CB-CG2 3.76Å; H320-T381 PolarHBondContact N-O 3.49Å; H320-T381 PolarHBondContact O-N 2.92Å; W367-T381 HydrophobicContact CD2-CG2 4.27Å; W367-T381 HydrophobicContact CE3-CG2 3.72Å; W367-T381 HydrophobicContact CZ3-CG2 4.2Å; H369-T381 WeakPolarHBondContact ND1-CB 3.09Å; H369-T381 PolarHBondContact ND1-N 2.8Å; H369-T381 PolarHBondContact ND1-OG1 3.07Å
382	L	95.4	Very high	90.4	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.1	170.6	-169.7	74.7	0	0	0	108.9	L306 C307 L308 D309 L311 L319 F351 V431	L306-L382 HydrophobicContact CD1-CB 4.03Å; C307-L382 PolarHBondContact O-N 2.51Å; L308-L382 HydrophobicContact CD2-CB 4.46Å; L308-L382 HydrophobicContact CD2-CD2 4.48Å; D309-L382 PolarHBondContact N-O 2.75Å; D309-L382 VanDerWaalsContact O-O 3.13Å; L311-L382 HydrophobicContact CD1-CD2 4.24Å; L311-L382 HydrophobicContact CD2-CD2 4.17Å; L311-L382 HydrophobicContact CD2-CG 3.99Å; L319-L382 HydrophobicContact CD1-CD1 3.94Å; F351-L382 HydrophobicContact CE2-CD1 4.2Å; L382-V431 HydrophobicContact CD2-CG2 3.29Å
383	S	94.9	Very high	90.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	158.1	175.3	69.5	0	0	0	0	110.8	D309 Y318 H320 W367 L385	D309-S383 WeakPolarHBondContact O-CA 3.36Å; D309-S383 WeakPolarHBondContact O-CB 3.4Å; Y318-S383 WeakPolarHBondContact CA-O 3.37Å; Y318-S383 PolarHBondContact N-O 2.95Å; Y318-S383 PolarHBondContact O-N 3.22Å; Y318-S383 VanDerWaalsContact O-O 3.13Å; H320-S383 PolarHBondContact CD2-OG 2.94Å; H320-S383 PolarHBondContact NE2-OG 3.33Å; W367-S383 WeakPolarHBondContact CH2-OG 3.33Å; S383-L385 PolarHBondContact OG-O 2.86Å
384	H	93.3	Very high	89.9	Confident	19 Å²	19	48.1 Å²	48.1	9%	0.088	23%	0.229	C	C	.	.	S	Bend	trans	-82.9	-5.3	170.2	86.5	-87.2	0	0	0	112.7	D236 T310 N313 S316 L317 Y318	D236-H384 IonicContact OD2-CE1 4Å; D236-H384 PolarHBondContact OD2-CE1 2.89Å; D236-H384 IonicContact OD2-ND1 2.99Å; D236-H384 IonicContact OD2-NE2 3.74Å; T310-H384 WeakPolarHBondContact CG2-CE1 3.44Å; T310-H384 PolarHBondContact O-N 2.93Å; T310-H384 PolarHBondContact O-ND1 2.82Å; N313-H384 WeakPolarHBondContact O-CB 3.37Å; N313-H384 PolarHBondContact O-CD2 3.19Å; N313-H384 VanDerWaalsContact O-CD2 3.22Å; N313-H384 PolarHBondContact O-ND1 3.29Å; S316-H384 VanDerWaalsContact O-CA 3.3Å; S316-H384 WeakPolarHBondContact O-CA 3.47Å; S316-H384 WeakPolarHBondContact O-CB 3.44Å; L317-H384 HydrophobicContact CD2-CB 4.45Å; Y318-H384 VanDerWaalsContact CD2-O 3.3Å; Y318-H384 WeakPolarHBondContact CD2-O 3.13Å; Y318-H384 VanDerWaalsContact CE2-O 3.25Å; Y318-H384 WeakPolarHBondContact CE2-O 3.47Å
385	L	92.1	Very high	89.9	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.016	21%	0.212	C	C	.	.			trans	-87.3	133.2	-178.4	-63.2	170.8	0	0	0	110.7	T310 Y318 H320 W367 S383 S387 S390 Q392 R393	T310-L385 HydrophobicContact CG2-CD1 3.58Å; T310-L385 HydrophobicContact CG2-CG 3.94Å; Y318-L385 WeakPolarHBondContact CD2-O 3.38Å; H320-L385 PolarHBondContact CE1-O 2.95Å; H320-L385 PolarHBondContact NE2-O 3.19Å; W367-L385 HydrophobicContact CH2-CB 4.35Å; S383-L385 PolarHBondContact OG-O 2.86Å; L385-S387 VanDerWaalsContact C-N 3.31Å; L385-S387 PolarHBondContact O-N 3.05Å; L385-S390 VanDerWaalsContact CD1-OG 3.24Å; L385-S390 WeakPolarHBondContact CD1-OG 3.36Å; L385-Q392 HydrophobicContact CD2-CB 4.49Å; L385-R393 HydrophobicContact CD1-CB 4.1Å; L385-R393 HydrophobicContact CD1-CG 4.45Å
386	P	90.6	Very high	89.9	Confident	74 Å²	74	40.5 Å²	40.5	48%	0.481	20%	0.196	S	C	.	.	S	Bend	trans	-73.9	-23.1	178.9	28.8	-34.9	0	0	0	112.9	Y318 H320	Y318-P386 HydrophobicContact CD2-CB 4.43Å; Y318-P386 HydrophobicContact CE1-CB 4.22Å; Y318-P386 HydrophobicContact CE2-CB 4.01Å; H320-P386 PolarHBondContact CE1-O 3.19Å
387	S	90.9	Very high	89.8	Confident	49 Å²	49	30.3 Å²	30.3	34%	0.343	16%	0.158	S	C	.	.			trans	-144.4	144.8	-176.9	-178.2	0	0	0	0	111.3	L385 R389 S390	L385-S387 VanDerWaalsContact C-N 3.31Å; L385-S387 PolarHBondContact O-N 3.05Å; S387-R389 PolarHBondContact O-N 3.49Å; S387-R389 PolarHBondContact OG-N 3.05Å; S387-S390 WeakPolarHBondContact O-CB 3.38Å; S387-S390 PolarHBondContact O-N 3.32Å; S387-S390 PolarHBondContact O-OG 3.35Å; S387-S390 VanDerWaalsContact O-OG 3.09Å
388	H	87.2	Confident	89.7	Confident	46 Å²	46	29.5 Å²	29.5	21%	0.213	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20	174.9	65.6	-73.3	0	0	0	114.5	A366 W367 S390	A366-H388 HydrophobicContact CB-CB 3.69Å; A366-H388 WeakPolarHBondContact CB-CD2 3.46Å; W367-H388 HydrophobicContact CD2-CB 4.26Å; W367-H388 HydrophobicContact CZ2-CB 3.91Å; H388-S390 VanDerWaalsContact C-N 3.3Å
389	R	86.4	Confident	89.2	Confident	202 Å²	202	29.7 Å²	29.7	76%	0.762	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	4.6	178	-61.8	-172.5	178.6	-175	-4.2	113.1	S387 A391	S387-R389 PolarHBondContact O-N 3.49Å; S387-R389 PolarHBondContact OG-N 3.05Å; R389-A391 PolarHBondContact O-N 3.31Å
390	S	87.9	Confident	88.5	Confident	25 Å²	25	31.6 Å²	31.6	18%	0.175	16%	0.161	C	C	.	.			trans	-60.5	132.8	177.7	58	0	0	0	0	110.2	L385 S387 H388 Q392 R393	L385-S390 VanDerWaalsContact CD1-OG 3.24Å; L385-S390 WeakPolarHBondContact CD1-OG 3.36Å; S387-S390 WeakPolarHBondContact O-CB 3.38Å; S387-S390 PolarHBondContact O-N 3.32Å; S387-S390 PolarHBondContact O-OG 3.35Å; S387-S390 VanDerWaalsContact O-OG 3.09Å; H388-S390 VanDerWaalsContact C-N 3.3Å; S390-Q392 PolarHBondContact O-N 3.35Å; S390-R393 VanDerWaalsContact O-CB 3.32Å; S390-R393 WeakPolarHBondContact O-CB 3.48Å; S390-R393 PolarHBondContact O-N 3.32Å; S390-R393 VanDerWaalsContact O-N 3.13Å
391	A	83.5	Confident	87	Confident	21 Å²	21	32.2 Å²	32.2	17%	0.174	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-63	-29.9	-173.9	0	0	0	0	0	113.2	M125 E126 R389 R393 S394	M125-A391 HydrophobicContact CB-CB 3.67Å; M125-A391 WeakPolarHBondContact O-CB 3.19Å; E126-A391 HydrophobicContact CG-CB 4.21Å; R389-A391 PolarHBondContact O-N 3.31Å; A391-R393 PolarHBondContact O-N 2.89Å; A391-S394 PolarHBondContact O-N 3.29Å
392	Q	83.3	Confident	85	Confident	68 Å²	68	38.3 Å²	38.3	32%	0.318	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-59	-20.6	176.8	-63.7	176.3	-16.3	0	0	113.7	M125 L385 S390 S394 P417	M125-Q392 HydrophobicContact CE-CG 4.45Å; M125-Q392 HydrophobicContact SD-CG 4.24Å; L385-Q392 HydrophobicContact CD2-CB 4.49Å; S390-Q392 PolarHBondContact O-N 3.35Å; Q392-S394 VanDerWaalsContact C-N 3.35Å; Q392-P417 HydrophobicContact CB-CB 4.24Å; Q392-P417 HydrophobicContact CB-CG 4.46Å; Q392-P417 HydrophobicContact CG-CB 4.05Å; Q392-P417 HydrophobicContact CG-CG 4.25Å
393	R	86.8	Confident	82.3	Confident	21 Å²	21	41.4 Å²	41.4	8%	0.079	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-80.6	-14	-175.8	-170.6	166.6	-177.3	-126.1	7.3	113.7	S237 K276 Y279 D309 A366 W367 L385 S390 A391	S237-R393 PolarHBondContact OG-O 3.01Å; K276-R393 WeakPolarHBondContact CE-O 3.44Å; K276-R393 PolarHBondContact NZ-O 2.9Å; Y279-R393 PolarHBondContact OH-NH2 3.02Å; D309-R393 IonicContact OD1-NE 3.83Å; D309-R393 IonicContact OD2-CZ 2.86Å; D309-R393 IonicContact OD2-NE 3.17Å; D309-R393 PolarHBondContact OD2-NE 3.34Å; D309-R393 VanDerWaalsContact OD2-NE 3.07Å; D309-R393 IonicContact OD2-NH2 2.58Å; D309-R393 PolarHBondContact OD2-NH2 3.38Å; A366-R393 PolarHBondContact O-NH1 3.46Å; A366-R393 PolarHBondContact O-NH2 3.29Å; W367-R393 VanDerWaalsContact CE3-NH2 3.33Å; L385-R393 HydrophobicContact CD1-CB 4.1Å; L385-R393 HydrophobicContact CD1-CG 4.45Å; S390-R393 VanDerWaalsContact O-CB 3.32Å; S390-R393 WeakPolarHBondContact O-CB 3.48Å; S390-R393 PolarHBondContact O-N 3.32Å; S390-R393 VanDerWaalsContact O-N 3.13Å; A391-R393 PolarHBondContact O-N 2.89Å
394	S	86.1	Confident	79.6	Confident	24 Å²	24	45.3 Å²	45.3	17%	0.168	25%	0.249	C	C	.	.	S	Bend	trans	-145.1	41.4	-169.1	55.6	0	0	0	0	112.4	F225 A391 Q392	F225-S394 CarbonylContact O-C 3.49Å; F225-S394 VanDerWaalsContact O-C 3.28Å; F225-S394 WeakPolarHBondContact O-CA 3.43Å; A391-S394 PolarHBondContact O-N 3.29Å; Q392-S394 VanDerWaalsContact C-N 3.35Å
395	S	88.9	Confident	77	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.021	28%	0.282	C	S	.	.			trans	-121.5	145	-172.7	-178.2	0	0	0	0	113.2	M125 E128 F225 M397	M125-S395 WeakPolarHBondContact CG-OG 3.09Å; E128-S395 WeakPolarHBondContact OE2-CA 3.35Å; E128-S395 WeakPolarHBondContact OE2-CB 3.47Å; E128-S395 PolarHBondContact OE2-OG 2.85Å; F225-S395 PolarHBondContact O-N 2.94Å; S395-M397 PolarHBondContact O-N 2.83Å; S395-M397 WeakPolarHBondContact OG-CB 3.44Å; S395-M397 WeakPolarHBondContact OG-CG 3.25Å; S395-M397 PolarHBondContact OG-N 2.92Å
396	I	89.8	Confident	74.5	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.1	167.1	70.5	178.7	0	0	0	112.7	L109 F124 E128 V227 A228 L231 D398	L109-I396 HydrophobicContact CD1-CD1 3.89Å; L109-I396 HydrophobicContact CD2-CD1 4.3Å; F124-I396 HydrophobicContact CE1-CD1 3.98Å; F124-I396 HydrophobicContact CE1-CG1 4.07Å; F124-I396 HydrophobicContact CZ-CD1 4.35Å; E128-I396 WeakPolarHBondContact OE1-CG1 3.38Å; E128-I396 PolarHBondContact OE1-N 3.15Å; V227-I396 HydrophobicContact CG1-CD1 3.92Å; V227-I396 HydrophobicContact CG1-CG1 4.45Å; V227-I396 HydrophobicContact CG1-CG2 3.9Å; A228-I396 HydrophobicContact CB-CG2 4.45Å; L231-I396 HydrophobicContact CB-CB 4.24Å; L231-I396 HydrophobicContact CB-CG2 4.18Å; L231-I396 HydrophobicContact CD1-CD1 4.49Å; I396-D398 PolarHBondContact O-N 3.07Å
397	M	85.1	Confident	71.9	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.039	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.4	-180	-53	-51.2	-143.7	0	0	113	L86 M113 V121 F124 M125 S395 V399	L86-M397 HydrophobicContact CD1-CE 4.27Å; L86-M397 HydrophobicContact CD2-CE 3.4Å; L86-M397 HydrophobicContact CG-CE 4.39Å; M113-M397 HydrophobicContact CE-CE 4.23Å; M113-M397 HydrophobicContact CE-SD 3.66Å; M113-M397 HydrophobicContact CG-CE 4.16Å; M113-M397 HydrophobicContact CG-SD 3.42Å; M113-M397 WeakPolarHBondContact CG-SD 3.41Å; M113-M397 HydrophobicContact SD-CE 3.46Å; M113-M397 WeakPolarHBondContact SD-CE 3.44Å; M113-M397 HydrophobicContact SD-SD 3.34Å; V121-M397 HydrophobicContact CG1-CB 4.02Å; V121-M397 HydrophobicContact CG1-CG 4.11Å; F124-M397 HydrophobicContact CB-CE 4.26Å; F124-M397 HydrophobicContact CD1-CE 3.29Å; F124-M397 HydrophobicContact CD1-CG 3.96Å; F124-M397 HydrophobicContact CD1-SD 4.09Å; F124-M397 HydrophobicContact CE1-CE 3.82Å; F124-M397 HydrophobicContact CE1-CG 4.45Å; F124-M397 HydrophobicContact CE1-SD 4.29Å; F124-M397 HydrophobicContact CG-CE 3.95Å; M125-M397 HydrophobicContact CG-CB 4.19Å; M125-M397 HydrophobicContact CG-CG 4.11Å; M125-M397 HydrophobicContact SD-CB 4.45Å; S395-M397 PolarHBondContact O-N 2.83Å; S395-M397 WeakPolarHBondContact OG-CB 3.44Å; S395-M397 WeakPolarHBondContact OG-CG 3.25Å; S395-M397 PolarHBondContact OG-N 2.92Å; M397-V399 VanDerWaalsContact C-N 3.26Å; M397-V399 PolarHBondContact O-N 2.96Å
398	D	85.9	Confident	69.2	Low	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.363	C	S	.	.			trans	-78.1	77.2	175.4	-179	23.8	0	0	0	111.1	G234 A235 D236 S237 I396 P417	G234-D398 VanDerWaalsContact C-OD2 3.31Å; G234-D398 VanDerWaalsContact CA-OD2 3.22Å; G234-D398 WeakPolarHBondContact CA-OD2 3.24Å; G234-D398 PolarHBondContact N-O 3.16Å; A235-D398 PolarHBondContact N-O 2.69Å; A235-D398 PolarHBondContact N-OD1 3.13Å; A235-D398 PolarHBondContact N-OD2 3.04Å; D236-D398 PolarHBondContact N-OD1 2.95Å; D236-D398 PolarHBondContact N-OD2 2.82Å; S237-D398 WeakPolarHBondContact CA-OD2 3.39Å; S237-D398 WeakPolarHBondContact CB-OD2 3.32Å; S237-D398 PolarHBondContact N-OD2 3.22Å; I396-D398 PolarHBondContact O-N 3.07Å; D398-P417 HydrophobicContact CB-CG 4.04Å
399	V	81.4	Confident	66.5	Low	49 Å²	49	69.6 Å²	69.6	30%	0.297	38%	0.382	S	S	.	.			trans	-111.8	150.9	178.8	-170.9	0	0	0	0	108.6	Y233 M397 S401	Y233-V399 HydrophobicContact CD2-CG2 4.39Å; M397-V399 VanDerWaalsContact C-N 3.26Å; M397-V399 PolarHBondContact O-N 2.96Å; V399-S401 PolarHBondContact O-N 2.95Å
400	R	78	Confident	64	Low	43 Å²	43	65.6 Å²	65.6	16%	0.162	39%	0.393	C	S	.	.			trans	-63	109.2	170.9	-175	162.5	-175.9	153.3	-17.1	109.2	A235 V402 S466 V469 D470 T473	A235-R400 HydrophobicContact CB-CB 4.31Å; R400-V402 PolarHBondContact O-N 3.19Å; R400-S466 PolarHBondContact NH1-O 3.26Å; R400-S466 PolarHBondContact NH2-O 3.13Å; R400-V469 VanDerWaalsContact NH1-C 3.29Å; R400-D470 WeakPolarHBondContact CD-OD1 3.48Å; R400-D470 IonicContact CZ-OD1 2.91Å; R400-D470 IonicContact CZ-OD2 3.19Å; R400-D470 VanDerWaalsContact CZ-OD2 3.28Å; R400-D470 IonicContact NE-OD1 2.63Å; R400-D470 PolarHBondContact NE-OD1 3Å; R400-D470 IonicContact NH1-OD1 3.67Å; R400-D470 PolarHBondContact NH1-OD1 2.79Å; R400-D470 VanDerWaalsContact NH1-OD1 3.12Å; R400-D470 IonicContact NH1-OD2 2.92Å; R400-D470 PolarHBondContact NH1-OD2 3.46Å; R400-D470 IonicContact NH2-OD1 3.29Å; R400-D470 PolarHBondContact NH2-OD1 3.39Å; R400-D470 VanDerWaalsContact NH2-OD1 3.07Å; R400-D470 IonicContact NH2-OD2 3.07Å; R400-D470 PolarHBondContact NH2-OD2 2.65Å; R400-T473 HydrophobicContact CB-CG2 4.08Å
401	S	63.8	Low	61.7	Low	14 Å²	14	67.2 Å²	67.2	10%	0.098	41%	0.413	C	S	.	.			trans	-65	111.5	167.7	68.3	0	0	0	0	107.6	V399 S403 P414 H418	V399-S401 PolarHBondContact O-N 2.95Å; S401-S403 PolarHBondContact O-N 2.96Å; S401-P414 VanDerWaalsContact CB-CB 3.43Å; S401-P414 VanDerWaalsContact CB-CG 3.49Å; S401-P414 WeakPolarHBondContact OG-CG 3.33Å; S401-H418 WeakPolarHBondContact OG-CB 3.4Å
402	V	52.8	Low	59.8	Low	128 Å²	128	75 Å²	75	78%	0.776	45%	0.446	S	S	*	.			trans	-67.3	90.9	164.4	-178.3	0	0	0	0	105.6	R400 P404	R400-V402 PolarHBondContact O-N 3.19Å; V402-P404 WeakPolarHBondContact O-CD 3.38Å
403	S	39.9	Very low	58.3	Low	68 Å²	68	76.3 Å²	76.3	48%	0.476	46%	0.46	S	S	.	.			trans	-57.2	126.7	165.2	-168.7	0	0	0	0	105.8	S401 S405	S401-S403 PolarHBondContact O-N 2.96Å; S403-S405 PolarHBondContact O-N 2.96Å; S403-S405 PolarHBondContact O-OG 3.31Å
404	P	37.3	Very low	56.7	Low	81 Å²	81	76.8 Å²	76.8	53%	0.526	47%	0.466	S	S	.	.			trans	-71.9	49	177.2	29.8	-33	0	0	0	110.3	V402 S406	V402-P404 WeakPolarHBondContact O-CD 3.38Å; P404-S406 PolarHBondContact O-N 3.48Å
405	S	38.6	Very low	54.9	Low	111 Å²	111	76.3 Å²	76.3	78%	0.776	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	4.3	178.2	54.7	0	0	0	0	113.1	S403	S403-S405 PolarHBondContact O-N 2.96Å; S403-S405 PolarHBondContact O-OG 3.31Å
406	S	40.7	Very low	53.3	Low	112 Å²	112	77.2 Å²	77.2	78%	0.783	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-6.8	172.3	67.3	0	0	0	0	115.2	P404	P404-S406 PolarHBondContact O-N 3.48Å
407	R	35.2	Very low	51.8	Low	212 Å²	212	77.2 Å²	77.2	80%	0.8	47%	0.474	S	S	*	.	S	Bend	trans	-145.3	104	171.9	-68.1	-172.1	-168.3	175.9	5.1	111.1
408	H	33.9	Very low	51.3	Low	206 Å²	206	79 Å²	79	95%	0.954	48%	0.482	S	S	*	.			trans	20.6	104.4	154.4	-94	43.9	0	0	0	116.9
409	G	30.6	Very low	51.1	Low	60 Å²	60	79.6 Å²	79.6	62%	0.619	49%	0.485	S	S	*	.			trans	156.5	129.4	158.4	0	0	0	0	0	113.4	G411	G409-G411 VanDerWaalsContact C-N 3.25Å; G409-G411 PolarHBondContact O-N 3.32Å
410	A	34.5	Very low	51.3	Low	119 Å²	119	79.6 Å²	79.6	98%	0.983	48%	0.484	S	S	*	.			trans	-65	86.3	165.1	0	0	0	0	0	109.1
411	G	40.5	Very low	51.8	Low	58 Å²	58	79 Å²	79	60%	0.598	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-88.4	149.5	166.5	0	0	0	0	0	110.3	G409	G409-G411 VanDerWaalsContact C-N 3.25Å; G409-G411 PolarHBondContact O-N 3.32Å
412	E	43.3	Very low	53	Low	185 Å²	185	81.3 Å²	81.3	86%	0.864	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-53.5	148.5	171.4	-70.6	178.4	158.4	0	0	111.3
413	P	51.1	Low	54.8	Low	96 Å²	96	77.4 Å²	77.4	62%	0.623	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-57.2	136.5	176.7	23.7	-32.3	0	0	0	109.9	A415	P413-A415 PolarHBondContact O-N 2.63Å
414	P	53.2	Low	57.3	Low	31 Å²	31	74.1 Å²	74.1	20%	0.201	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-57.2	135	-176.5	22.4	-32	0	0	0	110.6	S401 G416	S401-P414 VanDerWaalsContact CB-CB 3.43Å; S401-P414 VanDerWaalsContact CB-CG 3.49Å; S401-P414 WeakPolarHBondContact OG-CG 3.33Å; P414-G416 PolarHBondContact O-N 2.8Å
415	A	49	Very low	59.9	Low	13 Å²	13	70.9 Å²	70.9	11%	0.107	43%	0.43	C	S	.	.	S	Bend	trans	-75.3	121.4	176.4	0	0	0	0	0	110.5	S114 M116 Q118 P413	S114-A415 WeakPolarHBondContact O-CB 3.34Å; S114-A415 PolarHBondContact O-N 3Å; M116-A415 WeakPolarHBondContact O-CB 3.17Å; Q118-A415 HydrophobicContact CG-CB 3.71Å; P413-A415 PolarHBondContact O-N 2.63Å
416	G	54.8	Low	62.4	Low	22 Å²	22	67 Å²	67	23%	0.227	40%	0.398	C	S	.	.	S	Bend	trans	120.7	169.2	175.3	0	0	0	0	0	115.1	P414 H418	P414-G416 PolarHBondContact O-N 2.8Å; G416-H418 PolarHBondContact O-N 3.49Å; G416-H418 PolarHBondContact O-ND1 3.18Å
417	P	58.7	Low	65	Low	6 Å²	6	61.7 Å²	61.7	4%	0.039	36%	0.361	C	S	.	.			trans	-62.1	124.4	171.8	23.1	-26.8	0	0	0	109.2	M125 Q392 D398	M125-P417 HydrophobicContact SD-CG 3.81Å; Q392-P417 HydrophobicContact CB-CB 4.24Å; Q392-P417 HydrophobicContact CB-CG 4.46Å; Q392-P417 HydrophobicContact CG-CB 4.05Å; Q392-P417 HydrophobicContact CG-CG 4.25Å; D398-P417 HydrophobicContact CB-CG 4.04Å
418	H	73.8	Confident	67.7	Low	45 Å²	45	51.6 Å²	51.6	21%	0.208	32%	0.323	C	S	.	.			trans	-138.3	156.2	-178.3	57.3	-85.7	0	0	0	109.9	N313 S401 G416	N313-H418 WeakPolarHBondContact CB-O 3.43Å; N313-H418 PolarHBondContact ND2-NE2 2.82Å; N313-H418 PolarHBondContact ND2-O 3.17Å; S401-H418 WeakPolarHBondContact OG-CB 3.4Å; G416-H418 PolarHBondContact O-N 3.49Å; G416-H418 PolarHBondContact O-ND1 3.18Å
419	V	81.5	Confident	70.6	Confident	12 Å²	12	44.1 Å²	44.1	7%	0.073	29%	0.288	C	S	.	.			trans	-90.7	118.9	174.7	-179.7	0	0	0	0	109.2	A235 D236 L424 V469	A235-V419 HydrophobicContact CB-CG2 3.95Å; A235-V419 WeakPolarHBondContact O-CG2 3.41Å; D236-V419 HydrophobicContact CB-CG2 3.79Å; V419-L424 HydrophobicContact CG1-CD2 4.01Å; V419-V469 HydrophobicContact CB-CG1 4.35Å; V419-V469 HydrophobicContact CG1-CG1 4.29Å; V419-V469 HydrophobicContact CG2-CG1 4.29Å
420	D	86.5	Confident	73.5	Confident	50 Å²	50	41.3 Å²	41.3	27%	0.267	26%	0.258	S	S	.	.			trans	-92.1	110.3	166.1	-176	-13.7	0	0	0	108.4	G312 S422 K423 L424	G312-D420 PolarHBondContact O-N 2.79Å; D420-S422 VanDerWaalsContact CG-OG 3.26Å; D420-S422 PolarHBondContact O-N 3.31Å; D420-S422 WeakPolarHBondContact OD1-CB 3.16Å; D420-S422 PolarHBondContact OD1-N 3.14Å; D420-S422 PolarHBondContact OD1-OG 3.28Å; D420-S422 PolarHBondContact OD2-OG 2.91Å; D420-K423 HydrophobicContact CB-CB 4.12Å; D420-K423 HydrophobicContact CB-CD 4.17Å; D420-K423 HydrophobicContact CB-CG 4.06Å; D420-K423 PolarHBondContact O-N 2.93Å; D420-L424 WeakPolarHBondContact O-CB 3.49Å; D420-L424 PolarHBondContact O-N 2.92Å
421	V	87.9	Confident	76.3	Confident	31 Å²	31	35.8 Å²	35.8	19%	0.188	21%	0.213	C	C	.	.	H	α-helix	trans	-60.1	-32.8	-176.9	-177.9	0	0	0	0	111.5	L424 S425 E462 L465	V421-L424 PolarHBondContact O-N 3.11Å; V421-S425 VanDerWaalsContact O-CB 3.27Å; V421-S425 WeakPolarHBondContact O-CB 3.4Å; V421-S425 PolarHBondContact O-N 3.45Å; V421-E462 HydrophobicContact CG1-CB 4.3Å; V421-L465 HydrophobicContact CG1-CB 4.4Å
422	S	89.4	Confident	78.9	Confident	62 Å²	62	33 Å²	33	43%	0.434	18%	0.184	S	C	.	.	H	α-helix	trans	-68.2	-42.6	179	70.3	0	0	0	0	111.5	D420 S425 R426	D420-S422 VanDerWaalsContact CG-OG 3.26Å; D420-S422 PolarHBondContact O-N 3.31Å; D420-S422 WeakPolarHBondContact OD1-CB 3.16Å; D420-S422 PolarHBondContact OD1-N 3.14Å; D420-S422 PolarHBondContact OD1-OG 3.28Å; D420-S422 PolarHBondContact OD2-OG 2.91Å; S422-S425 WeakPolarHBondContact O-CB 3.3Å; S422-S425 PolarHBondContact O-N 2.95Å; S422-R426 PolarHBondContact O-N 2.88Å
423	K	90.4	Very high	81.2	Confident	45 Å²	45	24.2 Å²	24.2	20%	0.196	14%	0.143	C	C	.	.	H	α-helix	trans	-68.9	-39.9	175.3	-65.1	-172.6	-174.2	-161.7	0	111.6	D315 D420 S425 R426 N427	D315-K423 IonicContact OD1-NZ 2.92Å; D315-K423 PolarHBondContact OD1-NZ 3.37Å; D315-K423 IonicContact OD2-NZ 3.5Å; D315-K423 PolarHBondContact OD2-NZ 2.89Å; D420-K423 HydrophobicContact CB-CB 4.12Å; D420-K423 HydrophobicContact CB-CD 4.17Å; D420-K423 HydrophobicContact CB-CG 4.06Å; D420-K423 PolarHBondContact O-N 2.93Å; K423-S425 VanDerWaalsContact C-N 3.34Å; K423-S425 PolarHBondContact O-N 3.48Å; K423-R426 WeakPolarHBondContact O-CB 3.38Å; K423-R426 PolarHBondContact O-N 3.03Å; K423-N427 WeakPolarHBondContact O-CB 3.35Å; K423-N427 PolarHBondContact O-N 3.03Å; K423-N427 PolarHBondContact O-ND2 3.42Å; K423-N427 PolarHBondContact O-OD1 3.32Å
424	L	91.6	Very high	83.2	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61	-43.6	174.3	179.2	60.1	0	0	0	111.6	S243 M244 V419 D420 V421 N427 A428 L465 V469	S243-L424 WeakPolarHBondContact OG-CD2 3.45Å; M244-L424 HydrophobicContact CE-CD1 3.92Å; V419-L424 HydrophobicContact CG1-CD2 4.01Å; D420-L424 WeakPolarHBondContact O-CB 3.49Å; D420-L424 PolarHBondContact O-N 2.92Å; V421-L424 PolarHBondContact O-N 3.11Å; L424-N427 PolarHBondContact O-N 3.01Å; L424-A428 VanDerWaalsContact O-CB 3.29Å; L424-A428 WeakPolarHBondContact O-CB 3.25Å; L424-A428 PolarHBondContact O-N 3.36Å; L424-L465 HydrophobicContact CD2-CB 4.37Å; L424-L465 HydrophobicContact CD2-CD2 4.36Å; L424-L465 HydrophobicContact CG-CD1 4.33Å; L424-V469 HydrophobicContact CD2-CG2 3.94Å
425	S	92.9	Very high	85	Confident	13 Å²	13	18.3 Å²	18.3	9%	0.091	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-46.7	175.7	178.3	0	0	0	0	112	V421 S422 K423 N427 A428 K429 E462	V421-S425 VanDerWaalsContact O-CB 3.27Å; V421-S425 WeakPolarHBondContact O-CB 3.4Å; V421-S425 PolarHBondContact O-N 3.45Å; S422-S425 WeakPolarHBondContact O-CB 3.3Å; S422-S425 PolarHBondContact O-N 2.95Å; K423-S425 VanDerWaalsContact C-N 3.34Å; K423-S425 PolarHBondContact O-N 3.48Å; S425-N427 PolarHBondContact O-N 3.16Å; S425-A428 PolarHBondContact O-N 2.83Å; S425-K429 WeakPolarHBondContact O-CB 3.23Å; S425-K429 PolarHBondContact O-N 2.98Å; S425-E462 WeakPolarHBondContact OG-CG 3.4Å; S425-E462 PolarHBondContact OG-OE1 3.47Å
426	R	91.8	Very high	87	Confident	29 Å²	29	17.7 Å²	17.7	11%	0.109	10%	0.099	C	C	.	.	H	α-helix	trans	-56.2	-51.3	172.5	179.5	-168.6	67	-167.6	-3.1	111.4	G314 D315 E348 V349 S422 K423 A428 K429 V430	G314-R426 PolarHBondContact O-NH2 3.44Å; D315-R426 IonicContact OD1-CZ 3.67Å; D315-R426 IonicContact OD1-NH1 3.37Å; D315-R426 PolarHBondContact OD1-NH1 3.33Å; D315-R426 IonicContact OD1-NH2 2.82Å; D315-R426 PolarHBondContact OD1-NH2 3.37Å; E348-R426 WeakPolarHBondContact OE1-CD 3.47Å; V349-R426 VanDerWaalsContact CG2-CZ 3.46Å; S422-R426 PolarHBondContact O-N 2.88Å; K423-R426 WeakPolarHBondContact O-CB 3.38Å; K423-R426 PolarHBondContact O-N 3.03Å; R426-A428 VanDerWaalsContact C-N 3.35Å; R426-A428 PolarHBondContact O-N 3.37Å; R426-K429 WeakPolarHBondContact O-CB 3.5Å; R426-K429 PolarHBondContact O-N 3.5Å; R426-V430 WeakPolarHBondContact O-CG2 3.4Å; R426-V430 PolarHBondContact O-N 3.31Å
427	N	93.4	Very high	88.7	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-42	-178.4	-66.5	-12.5	0	0	0	111.1	M244 L311 K423 L424 S425 K429 V430 V431	M244-N427 HydrophobicContact CE-CB 4.3Å; L311-N427 PolarHBondContact O-ND2 3.46Å; K423-N427 WeakPolarHBondContact O-CB 3.35Å; K423-N427 PolarHBondContact O-N 3.03Å; K423-N427 PolarHBondContact O-ND2 3.42Å; K423-N427 PolarHBondContact O-OD1 3.32Å; L424-N427 PolarHBondContact O-N 3.01Å; S425-N427 PolarHBondContact O-N 3.16Å; N427-K429 VanDerWaalsContact C-N 3.34Å; N427-K429 PolarHBondContact O-N 3.37Å; N427-V430 PolarHBondContact O-N 2.83Å; N427-V431 WeakPolarHBondContact O-CG2 3.45Å; N427-V431 PolarHBondContact O-N 3.38Å
428	A	93.8	Very high	90.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.6	-41.3	174.6	0	0	0	0	0	111.8	M244 L424 S425 R426 V431 A432 V460	M244-A428 HydrophobicContact CG-CB 3.89Å; L424-A428 VanDerWaalsContact O-CB 3.29Å; L424-A428 WeakPolarHBondContact O-CB 3.25Å; L424-A428 PolarHBondContact O-N 3.36Å; S425-A428 PolarHBondContact O-N 2.83Å; R426-A428 VanDerWaalsContact C-N 3.35Å; R426-A428 PolarHBondContact O-N 3.37Å; A428-V431 PolarHBondContact O-N 3.12Å; A428-A432 VanDerWaalsContact O-CB 3.26Å; A428-A432 WeakPolarHBondContact O-CB 3.3Å; A428-A432 PolarHBondContact O-N 3.04Å; A428-V460 HydrophobicContact CB-CG1 4.27Å
429	K	93.1	Very high	91	Very high	49 Å²	49	15.5 Å²	15.5	21%	0.213	8%	0.083	C	C	.	.	H	α-helix	trans	-62.8	-46	176	-171.8	177.8	179	-178.3	0	111.5	S425 R426 N427 V431 A432 E433 V460	S425-K429 WeakPolarHBondContact O-CB 3.23Å; S425-K429 PolarHBondContact O-N 2.98Å; R426-K429 WeakPolarHBondContact O-CB 3.5Å; R426-K429 PolarHBondContact O-N 3.5Å; N427-K429 VanDerWaalsContact C-N 3.34Å; N427-K429 PolarHBondContact O-N 3.37Å; K429-V431 VanDerWaalsContact C-N 3.35Å; K429-V431 PolarHBondContact O-N 3.46Å; K429-A432 PolarHBondContact O-N 2.88Å; K429-E433 HydrophobicContact CG-CG 4.33Å; K429-E433 WeakPolarHBondContact O-CB 3.44Å; K429-E433 VanDerWaalsContact O-CG 3.29Å; K429-E433 WeakPolarHBondContact O-CG 3.47Å; K429-E433 PolarHBondContact O-N 3.48Å; K429-V460 HydrophobicContact CB-CG2 4.07Å
430	V	92.5	Very high	91.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.5	-47.6	177	170	0	0	0	0	111.1	L338 V341 V342 R426 N427 A434	L338-V430 HydrophobicContact CD2-CG1 4.22Å; V341-V430 HydrophobicContact CG1-CG1 4.2Å; V342-V430 HydrophobicContact CG2-CG1 3.74Å; R426-V430 WeakPolarHBondContact O-CG2 3.4Å; R426-V430 PolarHBondContact O-N 3.31Å; N427-V430 PolarHBondContact O-N 2.83Å; V430-A434 WeakPolarHBondContact O-CB 3.47Å; V430-A434 PolarHBondContact O-N 2.85Å
431	V	93.9	Very high	91.2	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.024	9%	0.09	C	C	.	.	H	α-helix	trans	-66.7	-42.9	179.7	175.9	0	0	0	0	111.5	M244 L248 L306 L308 L382 N427 A428 K429 A434 L435	M244-V431 HydrophobicContact SD-CB 4.3Å; M244-V431 HydrophobicContact SD-CG2 4.1Å; L248-V431 HydrophobicContact CD1-CG1 3.95Å; L248-V431 HydrophobicContact CD2-CG1 4.47Å; L306-V431 HydrophobicContact CD2-CG1 3.91Å; L308-V431 HydrophobicContact CD2-CG1 4.43Å; L382-V431 HydrophobicContact CD2-CG2 3.29Å; N427-V431 WeakPolarHBondContact O-CG2 3.45Å; N427-V431 PolarHBondContact O-N 3.38Å; A428-V431 PolarHBondContact O-N 3.12Å; K429-V431 VanDerWaalsContact C-N 3.35Å; K429-V431 PolarHBondContact O-N 3.46Å; V431-A434 PolarHBondContact O-N 2.81Å; V431-L435 HydrophobicContact CG1-CD1 3.92Å; V431-L435 HydrophobicContact CG1-CG 4.37Å; V431-L435 WeakPolarHBondContact O-CB 3.33Å; V431-L435 WeakPolarHBondContact O-CG 3.31Å; V431-L435 PolarHBondContact O-N 2.77Å
432	A	94.1	Very high	90.7	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.2	-49.7	178.1	0	0	0	0	0	111.4	L248 L251 A428 K429 L435 A436 F454	L248-A432 HydrophobicContact CD2-CB 3.62Å; L251-A432 HydrophobicContact CD1-CB 3.98Å; A428-A432 VanDerWaalsContact O-CB 3.26Å; A428-A432 WeakPolarHBondContact O-CB 3.3Å; A428-A432 PolarHBondContact O-N 3.04Å; K429-A432 PolarHBondContact O-N 2.88Å; A432-L435 PolarHBondContact O-N 3.36Å; A432-A436 WeakPolarHBondContact O-CB 3.47Å; A432-A436 PolarHBondContact O-N 2.94Å; A432-F454 HydrophobicContact CB-CD2 3.85Å; A432-F454 HydrophobicContact CB-CE2 3.71Å; A432-F454 HydrophobicContact CB-CZ 4.34Å; A432-F454 WeakPolarHBondContact O-CE2 3.15Å
433	E	92.1	Very high	89.8	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.1	-45.5	179.3	-71	-68.3	168.4	0	0	111.7	V341 K429 L435 A436 R437 I453 F454	V341-E433 HydrophobicContact CG1-CB 4.14Å; V341-E433 HydrophobicContact CG2-CB 4.33Å; K429-E433 HydrophobicContact CG-CG 4.33Å; K429-E433 WeakPolarHBondContact O-CB 3.44Å; K429-E433 VanDerWaalsContact O-CG 3.29Å; K429-E433 WeakPolarHBondContact O-CG 3.47Å; K429-E433 PolarHBondContact O-N 3.48Å; E433-L435 PolarHBondContact O-N 3.32Å; E433-A436 PolarHBondContact O-N 2.83Å; E433-R437 VanDerWaalsContact O-CG 3.29Å; E433-R437 WeakPolarHBondContact O-CG 3.41Å; E433-R437 PolarHBondContact O-N 3.25Å; E433-I453 VanDerWaalsContact CD-N 3.35Å; E433-I453 PolarHBondContact OE1-N 2.73Å; E433-I453 WeakPolarHBondContact OE2-CB 3.35Å; E433-I453 WeakPolarHBondContact OE2-CG1 2.88Å; E433-I453 PolarHBondContact OE2-N 3.17Å; E433-F454 HydrophobicContact CG-CD2 4.21Å; E433-F454 WeakPolarHBondContact OE1-CD2 3.31Å; E433-F454 PolarHBondContact OE1-N 3.43Å
434	A	92.1	Very high	88.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.8	-44.2	177.9	0	0	0	0	0	112.2	L334 E337 L338 V341 V430 V431 R437 V438	L334-A434 HydrophobicContact CD1-CB 4.22Å; E337-A434 HydrophobicContact CB-CB 4.46Å; L338-A434 HydrophobicContact CD2-CB 3.41Å; L338-A434 VanDerWaalsContact CD2-CB 3.41Å; L338-A434 HydrophobicContact CG-CB 3.73Å; V341-A434 HydrophobicContact CG2-CB 4.44Å; V430-A434 WeakPolarHBondContact O-CB 3.47Å; V430-A434 PolarHBondContact O-N 2.85Å; V431-A434 PolarHBondContact O-N 2.81Å; A434-R437 PolarHBondContact O-N 3.24Å; A434-V438 WeakPolarHBondContact O-CG2 3.28Å; A434-V438 PolarHBondContact O-N 2.88Å; A434-V438 VanDerWaalsContact O-N 3.15Å
435	L	92.5	Very high	87.8	Confident	2 Å²	2	30 Å²	30	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-45.2	175.3	-77.2	173.9	0	0	0	111.7	V218 L248 F252 F304 L306 L334 V431 A432 E433 R437 V438 I439	V218-L435 HydrophobicContact CG2-CD1 4.45Å; L248-L435 HydrophobicContact CD1-CD1 4.35Å; F252-L435 HydrophobicContact CE2-CB 4.2Å; F252-L435 HydrophobicContact CE2-CD1 4.06Å; F252-L435 HydrophobicContact CZ-CB 3.7Å; F252-L435 HydrophobicContact CZ-CD1 4.4Å; F304-L435 HydrophobicContact CE2-CD2 4.22Å; F304-L435 HydrophobicContact CZ-CD2 4.17Å; L306-L435 HydrophobicContact CD2-CD1 3.89Å; L306-L435 HydrophobicContact CD2-CD2 4.01Å; L306-L435 HydrophobicContact CD2-CG 4.2Å; L334-L435 HydrophobicContact CD1-CD2 3.99Å; L334-L435 HydrophobicContact CD1-CG 4.47Å; L334-L435 HydrophobicContact CD2-CD2 4.49Å; V431-L435 HydrophobicContact CG1-CD1 3.92Å; V431-L435 HydrophobicContact CG1-CG 4.37Å; V431-L435 WeakPolarHBondContact O-CB 3.33Å; V431-L435 WeakPolarHBondContact O-CG 3.31Å; V431-L435 PolarHBondContact O-N 2.77Å; A432-L435 PolarHBondContact O-N 3.36Å; E433-L435 PolarHBondContact O-N 3.32Å; L435-R437 VanDerWaalsContact C-N 3.32Å; L435-R437 PolarHBondContact O-N 2.95Å; L435-V438 PolarHBondContact O-N 2.74Å; L435-I439 HydrophobicContact CB-CD1 4.44Å; L435-I439 WeakPolarHBondContact O-CB 3.46Å; L435-I439 WeakPolarHBondContact O-CD1 3.37Å; L435-I439 WeakPolarHBondContact O-CG1 3.36Å; L435-I439 PolarHBondContact O-N 2.78Å
436	A	91.2	Very high	86.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64.2	-36.9	179.7	0	0	0	0	0	112.1	F252 A432 E433 I439 Y440 I453 F454	F252-A436 HydrophobicContact CE1-CB 4.33Å; F252-A436 HydrophobicContact CZ-CB 4.43Å; A432-A436 WeakPolarHBondContact O-CB 3.47Å; A432-A436 PolarHBondContact O-N 2.94Å; E433-A436 PolarHBondContact O-N 2.83Å; A436-I439 PolarHBondContact O-N 2.9Å; A436-Y440 VanDerWaalsContact O-CD2 3.25Å; A436-Y440 WeakPolarHBondContact O-CD2 3.36Å; A436-Y440 PolarHBondContact O-N 3.06Å; A436-I453 HydrophobicContact CB-CD1 3.47Å; A436-I453 VanDerWaalsContact CB-CD1 3.47Å; A436-F454 HydrophobicContact CB-CE2 3.7Å; A436-F454 HydrophobicContact CB-CZ 4.06Å
437	R	89.8	Confident	85.6	Confident	10 Å²	10	33 Å²	33	4%	0.038	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-42.2	173.5	-74.9	176	-178.2	-152.9	-1.9	112.7	E337 E433 A434 L435 N441 L442 G449 L451 I453	E337-R437 HydrophobicContact CB-CB 4.44Å; E337-R437 HydrophobicContact CG-CB 4.02Å; E337-R437 VanDerWaalsContact OE2-CD 3.25Å; E337-R437 WeakPolarHBondContact OE2-CD 3.32Å; E433-R437 VanDerWaalsContact O-CG 3.29Å; E433-R437 WeakPolarHBondContact O-CG 3.41Å; E433-R437 PolarHBondContact O-N 3.25Å; A434-R437 PolarHBondContact O-N 3.24Å; L435-R437 VanDerWaalsContact C-N 3.32Å; L435-R437 PolarHBondContact O-N 2.95Å; R437-N441 VanDerWaalsContact O-CA 3.27Å; R437-N441 WeakPolarHBondContact O-CA 3.42Å; R437-N441 PolarHBondContact O-N 3.28Å; R437-L442 HydrophobicContact CG-CD1 4.08Å; R437-L442 PolarHBondContact O-N 3.27Å; R437-L442 VanDerWaalsContact O-N 3.13Å; R437-G449 PolarHBondContact NH1-O 2.8Å; R437-G449 PolarHBondContact NH2-O 2.83Å; R437-L451 PolarHBondContact NH2-O 2.86Å; R437-I453 HydrophobicContact CG-CD1 4.45Å
438	V	90.1	Very high	84.5	Confident	12 Å²	12	36.6 Å²	36.6	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-66.5	-46.4	175.5	174.1	0	0	0	0	111.3	F304 L334 E337 A434 L435 Y440 N441	F304-V438 HydrophobicContact CE1-CG1 4.09Å; F304-V438 HydrophobicContact CZ-CG1 4.43Å; L334-V438 HydrophobicContact CB-CG2 3.98Å; L334-V438 HydrophobicContact CD1-CB 4.38Å; L334-V438 HydrophobicContact CD1-CG2 3.6Å; L334-V438 HydrophobicContact CG-CG2 4.39Å; E337-V438 HydrophobicContact CB-CG2 4.21Å; E337-V438 HydrophobicContact CG-CG2 3.85Å; A434-V438 WeakPolarHBondContact O-CG2 3.28Å; A434-V438 PolarHBondContact O-N 2.88Å; A434-V438 VanDerWaalsContact O-N 3.15Å; L435-V438 PolarHBondContact O-N 2.74Å; V438-Y440 PolarHBondContact O-N 2.8Å; V438-N441 PolarHBondContact O-N 3.43Å
439	I	89.8	Confident	83.2	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-40.7	-176.7	-70.3	162.3	0	0	0	112	I216 F252 A263 Y265 L267 L435 A436	I216-I439 HydrophobicContact CD1-CD1 4.49Å; I216-I439 HydrophobicContact CD1-CG1 3.8Å; F252-I439 HydrophobicContact CD1-CD1 4.22Å; F252-I439 HydrophobicContact CE1-CD1 3.52Å; F252-I439 HydrophobicContact CZ-CD1 3.94Å; A263-I439 HydrophobicContact CB-CG2 3.31Å; Y265-I439 HydrophobicContact CD2-CB 4.44Å; Y265-I439 HydrophobicContact CD2-CG2 4.29Å; Y265-I439 WeakPolarHBondContact CD2-O 3.36Å; L267-I439 HydrophobicContact CD1-CD1 4.16Å; L267-I439 HydrophobicContact CD2-CD1 3.86Å; L267-I439 HydrophobicContact CG-CD1 4.49Å; L435-I439 HydrophobicContact CB-CD1 4.44Å; L435-I439 WeakPolarHBondContact O-CB 3.46Å; L435-I439 WeakPolarHBondContact O-CD1 3.37Å; L435-I439 WeakPolarHBondContact O-CG1 3.36Å; L435-I439 PolarHBondContact O-N 2.78Å; A436-I439 PolarHBondContact O-N 2.9Å
440	Y	87.1	Confident	82.1	Confident	42 Å²	42	40.9 Å²	40.9	17%	0.165	24%	0.238	C	C	.	.	H	α-helix	trans	-94.3	-3.6	179.1	-67.6	-66.4	0	0	0	114.6	L255 T261 A263 A436 V438 L442 K445	L255-Y440 HydrophobicContact CD1-CE2 4.06Å; L255-Y440 WeakPolarHBondContact CD1-OH 3.5Å; L255-Y440 HydrophobicContact CD2-CE2 3.73Å; L255-Y440 WeakPolarHBondContact CD2-OH 3.46Å; L255-Y440 HydrophobicContact CG-CE2 4.24Å; L255-Y440 WeakPolarHBondContact CG-OH 3.47Å; T261-Y440 WeakPolarHBondContact O-CE1 3.11Å; T261-Y440 PolarHBondContact O-OH 2.78Å; A263-Y440 HydrophobicContact CB-CE1 4.08Å; A436-Y440 VanDerWaalsContact O-CD2 3.25Å; A436-Y440 WeakPolarHBondContact O-CD2 3.36Å; A436-Y440 PolarHBondContact O-N 3.06Å; V438-Y440 PolarHBondContact O-N 2.8Å; Y440-L442 VanDerWaalsContact C-N 3.34Å; Y440-L442 PolarHBondContact O-N 3.15Å; Y440-K445 PolarHBondContact O-NZ 3.37Å
441	N	85	Confident	81.5	Confident	60 Å²	60	44.9 Å²	44.9	32%	0.321	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	54	-176.8	-167.9	11.3	0	0	0	111.8	R437 V438 T443 E444 K445	R437-N441 VanDerWaalsContact O-CA 3.27Å; R437-N441 WeakPolarHBondContact O-CA 3.42Å; R437-N441 PolarHBondContact O-N 3.28Å; V438-N441 PolarHBondContact O-N 3.43Å; N441-T443 VanDerWaalsContact C-N 3.31Å; N441-T443 PolarHBondContact O-N 3.37Å; N441-E444 PolarHBondContact ND2-OE2 3.13Å; N441-E444 VanDerWaalsContact OD1-CB 3.28Å; N441-E444 WeakPolarHBondContact OD1-CB 3.48Å; N441-E444 VanDerWaalsContact OD1-CD 3.29Å; N441-E444 WeakPolarHBondContact OD1-CG 3.33Å; N441-K445 WeakPolarHBondContact O-CG 3.44Å; N441-K445 PolarHBondContact O-N 2.83Å
442	L	77.9	Confident	81	Confident	32 Å²	32	48.2 Å²	48.2	17%	0.168	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-29.7	-171.9	-66.4	-178.9	0	0	0	112.7	R437 Y440 K445 G446 A447 L451 I453	R437-L442 HydrophobicContact CG-CD1 4.08Å; R437-L442 PolarHBondContact O-N 3.27Å; R437-L442 VanDerWaalsContact O-N 3.13Å; Y440-L442 VanDerWaalsContact C-N 3.34Å; Y440-L442 PolarHBondContact O-N 3.15Å; L442-K445 CarbonylContact O-C 3.48Å; L442-K445 PolarHBondContact O-N 3.46Å; L442-G446 PolarHBondContact O-N 3.47Å; L442-A447 HydrophobicContact CB-CB 3.83Å; L442-A447 VanDerWaalsContact O-CB 3.27Å; L442-A447 WeakPolarHBondContact O-CB 3.45Å; L442-A447 PolarHBondContact O-N 3.14Å; L442-L451 HydrophobicContact CD1-CD2 4.46Å; L442-I453 HydrophobicContact CD1-CD1 3.44Å; L442-I453 VanDerWaalsContact CD1-CD1 3.44Å; L442-I453 HydrophobicContact CD1-CG1 4.09Å
443	T	70.2	Confident	80.5	Confident	63 Å²	63	50.3 Å²	50.3	39%	0.387	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-41	-176.3	-32.5	0	0	0	0	111.3	E337 N441 K445 G446	E337-T443 WeakPolarHBondContact OE1-CB 3.32Å; E337-T443 WeakPolarHBondContact OE1-CG2 3.24Å; E337-T443 PolarHBondContact OE1-OG1 3.1Å; E337-T443 PolarHBondContact OE2-OG1 3.23Å; N441-T443 VanDerWaalsContact C-N 3.31Å; N441-T443 PolarHBondContact O-N 3.37Å; T443-K445 PolarHBondContact O-N 3.19Å; T443-G446 PolarHBondContact O-N 3.34Å
444	E	69.3	Low	80.1	Confident	156 Å²	156	50.4 Å²	50.4	73%	0.729	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.6	171.7	-68.8	-176.6	-172.4	0	0	112.3	N441 G446	N441-E444 PolarHBondContact ND2-OE2 3.13Å; N441-E444 VanDerWaalsContact OD1-CB 3.28Å; N441-E444 WeakPolarHBondContact OD1-CB 3.48Å; N441-E444 VanDerWaalsContact OD1-CD 3.29Å; N441-E444 WeakPolarHBondContact OD1-CG 3.33Å; E444-G446 PolarHBondContact O-N 3.31Å
445	K	70.3	Confident	79.5	Confident	151 Å²	151	53.6 Å²	53.6	66%	0.657	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	3.3	174.7	-68.9	172.4	-178.3	164.7	0	113.7	Y440 N441 L442 T443	Y440-K445 PolarHBondContact O-NZ 3.37Å; N441-K445 WeakPolarHBondContact O-CG 3.44Å; N441-K445 PolarHBondContact O-N 2.83Å; L442-K445 CarbonylContact O-C 3.48Å; L442-K445 PolarHBondContact O-N 3.46Å; T443-K445 PolarHBondContact O-N 3.19Å
446	G	67.3	Low	79	Confident	67 Å²	67	60.9 Å²	60.9	69%	0.691	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	24.2	177	0	0	0	0	0	114.5	L442 T443 E444	L442-G446 PolarHBondContact O-N 3.47Å; T443-G446 PolarHBondContact O-N 3.34Å; E444-G446 PolarHBondContact O-N 3.31Å
447	A	72.3	Confident	78.3	Confident	38 Å²	38	68.8 Å²	68.8	31%	0.314	38%	0.377	S	S	.	.			trans	-65.5	139.2	173.7	0	0	0	0	0	111	L442 L451	L442-A447 HydrophobicContact CB-CB 3.83Å; L442-A447 VanDerWaalsContact O-CB 3.27Å; L442-A447 WeakPolarHBondContact O-CB 3.45Å; L442-A447 PolarHBondContact O-N 3.14Å; A447-L451 HydrophobicContact CB-CD2 4.12Å
448	S	69.7	Low	77.9	Confident	78 Å²	78	70.3 Å²	70.3	55%	0.545	38%	0.384	S	S	.	.			trans	-62.7	144.2	176.3	-174.7	0	0	0	0	111.1	D450 L451	S448-D450 PolarHBondContact O-N 3.18Å; S448-L451 WeakPolarHBondContact O-CB 3.27Å; S448-L451 PolarHBondContact O-N 3.41Å
449	G	66.8	Low	77.9	Confident	25 Å²	25	74.9 Å²	74.9	26%	0.258	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.3	175.2	0	0	0	0	0	114.1	S344 R437	S344-G449 PolarHBondContact OG-O 3.03Å; R437-G449 PolarHBondContact NH1-O 2.8Å; R437-G449 PolarHBondContact NH2-O 2.83Å
450	D	71.3	Confident	77.9	Confident	113 Å²	113	75.3 Å²	75.3	60%	0.604	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-5.8	179.3	-57	-26.9	0	0	0	113.5	S448 Q452	S448-D450 PolarHBondContact O-N 3.18Å; D450-Q452 PolarHBondContact O-N 3.43Å; D450-Q452 VanDerWaalsContact O-N 3.13Å
451	L	79.7	Confident	78.1	Confident	85 Å²	85	77.4 Å²	77.4	45%	0.445	42%	0.419	S	S	.	.			trans	-65.1	118.3	178.9	-175.5	68.6	0	0	0	109.6	R437 L442 A447 S448	R437-L451 PolarHBondContact NH2-O 2.86Å; L442-L451 HydrophobicContact CD1-CD2 4.46Å; A447-L451 HydrophobicContact CB-CD2 4.12Å; S448-L451 WeakPolarHBondContact O-CB 3.27Å; S448-L451 PolarHBondContact O-N 3.41Å
452	Q	82	Confident	78.4	Confident	73 Å²	73	79.5 Å²	79.5	34%	0.341	43%	0.427	S	S	.	.			trans	-100.6	122.8	170.4	-64.8	-177	13.6	0	0	108.4	D450 T455	D450-Q452 PolarHBondContact O-N 3.43Å; D450-Q452 VanDerWaalsContact O-N 3.13Å; Q452-T455 HydrophobicContact CB-CG2 3.68Å
453	I	83.4	Confident	79	Confident	44 Å²	44	86 Å²	86	23%	0.226	46%	0.456	C	S	.	.	S	Bend	trans	-85.9	-37.7	-178.5	-58.4	162.8	0	0	0	109.9	E433 A436 R437 L442 T455	E433-I453 VanDerWaalsContact CD-N 3.35Å; E433-I453 PolarHBondContact OE1-N 2.73Å; E433-I453 WeakPolarHBondContact OE2-CB 3.35Å; E433-I453 WeakPolarHBondContact OE2-CG1 2.88Å; E433-I453 PolarHBondContact OE2-N 3.17Å; A436-I453 HydrophobicContact CB-CD1 3.47Å; A436-I453 VanDerWaalsContact CB-CD1 3.47Å; R437-I453 HydrophobicContact CG-CD1 4.45Å; L442-I453 HydrophobicContact CD1-CD1 3.44Å; L442-I453 VanDerWaalsContact CD1-CD1 3.44Å; L442-I453 HydrophobicContact CD1-CG1 4.09Å; I453-T455 PolarHBondContact O-N 2.63Å
454	F	83.6	Confident	80	Confident	3 Å²	3	84.7 Å²	84.7	1%	0.013	45%	0.446	C	S	.	.	S	Bend	trans	-94.7	73.9	-176.2	-63.2	-73.3	0	0	0	110.6	L251 F252 A432 E433 A436 M458	L251-F454 HydrophobicContact CB-CD1 4.28Å; L251-F454 HydrophobicContact CB-CE1 3.83Å; L251-F454 HydrophobicContact CB-CZ 4.48Å; L251-F454 HydrophobicContact CD1-CD1 4.15Å; L251-F454 HydrophobicContact CD1-CE1 4.32Å; L251-F454 HydrophobicContact CD1-CG 4.48Å; L251-F454 HydrophobicContact CD2-CD1 4.09Å; L251-F454 HydrophobicContact CD2-CE1 4.47Å; L251-F454 HydrophobicContact CG-CD1 4.42Å; L251-F454 HydrophobicContact CG-CE1 4.44Å; F252-F454 HydrophobicContact CE1-CZ 4.34Å; F252-F454 HydrophobicContact CZ-CZ 4.33Å; A432-F454 HydrophobicContact CB-CD2 3.85Å; A432-F454 HydrophobicContact CB-CE2 3.71Å; A432-F454 HydrophobicContact CB-CZ 4.34Å; A432-F454 WeakPolarHBondContact O-CE2 3.15Å; E433-F454 HydrophobicContact CG-CD2 4.21Å; E433-F454 WeakPolarHBondContact OE1-CD2 3.31Å; E433-F454 PolarHBondContact OE1-N 3.43Å; A436-F454 HydrophobicContact CB-CE2 3.7Å; A436-F454 HydrophobicContact CB-CZ 4.06Å; F454-M458 WeakPolarHBondContact CB-O 3.34Å; F454-M458 HydrophobicContact CD1-CB 4.26Å; F454-M458 HydrophobicContact CD1-CE 4.28Å; F454-M458 WeakPolarHBondContact CD1-O 3.45Å; F454-M458 HydrophobicContact CE1-CE 4.14Å
455	T	81.1	Confident	81	Confident	66 Å²	66	77.3 Å²	77.3	41%	0.405	41%	0.411	S	S	.	.			trans	-112.5	160.4	176.2	57	0	0	0	0	111.6	Q452 I453 Q457 M458	Q452-T455 HydrophobicContact CB-CG2 3.68Å; I453-T455 PolarHBondContact O-N 2.63Å; T455-Q457 PolarHBondContact O-N 3.29Å; T455-M458 PolarHBondContact O-N 3.07Å
456	E	81.6	Confident	82	Confident	156 Å²	156	71.6 Å²	71.6	73%	0.729	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	50.9	-108.1	174.6	-57.1	178.8	179.5	0	0	113.7	M458 Q459	E456-M458 PolarHBondContact O-N 3.26Å; E456-Q459 WeakPolarHBondContact O-CB 3.33Å; E456-Q459 VanDerWaalsContact O-CD 3.32Å; E456-Q459 WeakPolarHBondContact O-CG 2.78Å; E456-Q459 PolarHBondContact O-N 2.93Å
457	Q	75.8	Confident	83.2	Confident	166 Å²	166	71 Å²	71	78%	0.776	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-73.1	-15.9	-176	-58.7	-174.7	-5	0	0	113.8	K254 T455	K254-Q457 PolarHBondContact NZ-O 3.43Å; K254-Q457 VanDerWaalsContact NZ-O 3.16Å; T455-Q457 PolarHBondContact O-N 3.29Å
458	M	82.4	Confident	84.1	Confident	41 Å²	41	69.6 Å²	69.6	20%	0.202	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-104.5	9.9	179	-69.3	-67	-67.6	0	0	112.2	L251 K254 L255 F454 T455 E456	L251-M458 WeakPolarHBondContact CD2-O 3.37Å; L251-M458 WeakPolarHBondContact O-CE 3.33Å; K254-M458 HydrophobicContact CB-CE 3.67Å; K254-M458 HydrophobicContact CB-SD 3.56Å; K254-M458 VanDerWaalsContact CB-SD 3.56Å; K254-M458 HydrophobicContact CD-CE 4.34Å; K254-M458 HydrophobicContact CD-SD 3.41Å; K254-M458 WeakPolarHBondContact CD-SD 3.4Å; K254-M458 HydrophobicContact CG-SD 4.16Å; L255-M458 HydrophobicContact CB-CE 4.34Å; F454-M458 WeakPolarHBondContact CB-O 3.34Å; F454-M458 HydrophobicContact CD1-CB 4.26Å; F454-M458 HydrophobicContact CD1-CE 4.28Å; F454-M458 WeakPolarHBondContact CD1-O 3.45Å; F454-M458 HydrophobicContact CE1-CE 4.14Å; T455-M458 PolarHBondContact O-N 3.07Å; E456-M458 PolarHBondContact O-N 3.26Å
459	Q	89.9	Confident	85.1	Confident	108 Å²	108	65.9 Å²	65.9	51%	0.505	34%	0.341	S	S	.	.	S	Bend	trans	-67.4	156.4	177.8	74.5	-170.5	-2	0	0	112.5	R250 E456	R250-Q459 PolarHBondContact NH2-O 3.37Å; E456-Q459 WeakPolarHBondContact O-CB 3.33Å; E456-Q459 VanDerWaalsContact O-CD 3.32Å; E456-Q459 WeakPolarHBondContact O-CG 2.78Å; E456-Q459 PolarHBondContact O-N 2.93Å
460	V	90.3	Very high	86.2	Confident	15 Å²	15	68.1 Å²	68.1	9%	0.091	35%	0.347	C	S	.	.			trans	-61.9	131.8	166.4	176.4	0	0	0	0	108.6	E247 L251 A428 K429 L465	E247-V460 HydrophobicContact CG-CG1 4.1Å; E247-V460 WeakPolarHBondContact OE1-CA 3.18Å; L251-V460 HydrophobicContact CD1-CG2 3.91Å; A428-V460 HydrophobicContact CB-CG1 4.27Å; K429-V460 HydrophobicContact CB-CG2 4.07Å; V460-L465 HydrophobicContact CG1-CD1 3.6Å
461	Q	90.9	Very high	87.2	Confident	86 Å²	86	66 Å²	66	40%	0.402	33%	0.33	S	S	.	.			trans	-99.8	108.6	-178.3	-74.6	179.5	-11.5	0	0	110.2	E247 E463 H464 L465	E247-Q461 PolarHBondContact OE1-N 2.84Å; Q461-E463 VanDerWaalsContact C-N 3.3Å; Q461-E463 PolarHBondContact O-N 2.83Å; Q461-H464 HydrophobicContact CB-CB 3.78Å; Q461-H464 WeakPolarHBondContact O-CB 3.39Å; Q461-H464 PolarHBondContact O-N 3.12Å; Q461-H464 VanDerWaalsContact O-N 3.1Å; Q461-L465 PolarHBondContact O-N 3.46Å; Q461-L465 VanDerWaalsContact O-N 3.09Å
462	E	90.3	Very high	87.8	Confident	103 Å²	103	62 Å²	62	48%	0.481	31%	0.309	S	S	.	.	H	α-helix	trans	-61.6	-38.8	178.1	-64.6	-171.5	173.4	0	0	112.5	V421 S425 H464 L465 S466	V421-E462 HydrophobicContact CG1-CB 4.3Å; S425-E462 WeakPolarHBondContact OG-CG 3.4Å; S425-E462 PolarHBondContact OG-OE1 3.47Å; E462-H464 VanDerWaalsContact C-N 3.25Å; E462-H464 PolarHBondContact O-N 3.31Å; E462-L465 PolarHBondContact O-N 3.33Å; E462-S466 WeakPolarHBondContact O-CB 3.31Å; E462-S466 PolarHBondContact O-N 2.91Å; E462-S466 PolarHBondContact O-OG 3.27Å
463	E	90.4	Very high	88.1	Confident	168 Å²	168	59.4 Å²	59.4	79%	0.785	30%	0.299	S	S	*	.	H	α-helix	trans	-62.9	-32.6	175.6	-63.2	179.3	-179.8	0	0	112.4	Q461 S466 A467	Q461-E463 VanDerWaalsContact C-N 3.3Å; Q461-E463 PolarHBondContact O-N 2.83Å; E463-S466 WeakPolarHBondContact CA-OG 3.42Å; E463-S466 PolarHBondContact O-OG 3.44Å; E463-A467 VanDerWaalsContact O-CB 3.31Å; E463-A467 WeakPolarHBondContact O-CB 3.5Å; E463-A467 PolarHBondContact O-N 2.88Å; E463-A467 VanDerWaalsContact O-N 3.16Å
464	H	91	Very high	88.4	Confident	37 Å²	37	61 Å²	61	17%	0.171	32%	0.318	C	S	.	.	H	α-helix	trans	-72.3	-47.8	176.2	-169.9	62.2	0	0	0	110.7	E247 Q461 E462 S466 A467 V468 H495	E247-H464 IonicContact OE2-CD2 2.78Å; E247-H464 PolarHBondContact OE2-CD2 2.89Å; E247-H464 IonicContact OE2-CG 2.61Å; Q461-H464 HydrophobicContact CB-CB 3.78Å; Q461-H464 WeakPolarHBondContact O-CB 3.39Å; Q461-H464 PolarHBondContact O-N 3.12Å; Q461-H464 VanDerWaalsContact O-N 3.1Å; E462-H464 VanDerWaalsContact C-N 3.25Å; E462-H464 PolarHBondContact O-N 3.31Å; H464-S466 VanDerWaalsContact C-N 3.33Å; H464-S466 PolarHBondContact O-N 3.22Å; H464-A467 PolarHBondContact O-N 3.37Å; H464-V468 VanDerWaalsContact O-CG2 3.3Å; H464-V468 WeakPolarHBondContact O-CG2 3.47Å; H464-V468 PolarHBondContact O-N 2.88Å; H464-H495 AromaticContact CE1-NE2 3.19Å; H464-H495 PolarHBondContact CE1-NE2 3.28Å; H464-H495 AromaticContact NE2-CE1 3.55Å; H464-H495 AromaticContact NE2-NE2 2.99Å; H464-H495 PolarHBondContact NE2-NE2 2.95Å
465	L	91.4	Very high	88.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-44.5	176.9	-71.9	171.9	0	0	0	111.5	E247 V421 L424 V460 Q461 E462 V468 V469	E247-L465 HydrophobicContact CB-CD2 3.74Å; E247-L465 HydrophobicContact CG-CD2 4.07Å; E247-L465 HydrophobicContact CG-CG 4.35Å; V421-L465 HydrophobicContact CG1-CB 4.4Å; L424-L465 HydrophobicContact CD2-CB 4.37Å; L424-L465 HydrophobicContact CD2-CD2 4.36Å; L424-L465 HydrophobicContact CG-CD1 4.33Å; V460-L465 HydrophobicContact CG1-CD1 3.6Å; Q461-L465 PolarHBondContact O-N 3.46Å; Q461-L465 VanDerWaalsContact O-N 3.09Å; E462-L465 PolarHBondContact O-N 3.33Å; L465-V468 PolarHBondContact O-N 3Å; L465-V469 WeakPolarHBondContact O-CB 3.39Å; L465-V469 VanDerWaalsContact O-CG2 3.3Å; L465-V469 WeakPolarHBondContact O-CG2 3.36Å; L465-V469 PolarHBondContact O-N 3.25Å
466	S	90.9	Very high	89.2	Confident	31 Å²	31	61.3 Å²	61.3	22%	0.217	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-49.2	177.6	66.8	0	0	0	0	111.2	R400 E462 E463 H464 V468 V469 D470	R400-S466 PolarHBondContact NH1-O 3.26Å; R400-S466 PolarHBondContact NH2-O 3.13Å; E462-S466 WeakPolarHBondContact O-CB 3.31Å; E462-S466 PolarHBondContact O-N 2.91Å; E462-S466 PolarHBondContact O-OG 3.27Å; E463-S466 WeakPolarHBondContact CA-OG 3.42Å; E463-S466 PolarHBondContact O-OG 3.44Å; H464-S466 VanDerWaalsContact C-N 3.33Å; H464-S466 PolarHBondContact O-N 3.22Å; S466-V468 PolarHBondContact O-N 2.89Å; S466-V469 PolarHBondContact O-N 3.25Å; S466-D470 WeakPolarHBondContact O-CB 3.27Å; S466-D470 VanDerWaalsContact O-CG 3.3Å; S466-D470 PolarHBondContact O-N 3.2Å
467	A	91.8	Very high	89.7	Confident	55 Å²	55	53.9 Å²	53.9	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-61.5	-40.7	179.4	0	0	0	0	0	112.9	E463 H464 D470 W471	E463-A467 VanDerWaalsContact O-CB 3.31Å; E463-A467 WeakPolarHBondContact O-CB 3.5Å; E463-A467 PolarHBondContact O-N 2.88Å; E463-A467 VanDerWaalsContact O-N 3.16Å; H464-A467 PolarHBondContact O-N 3.37Å; A467-D470 PolarHBondContact O-N 2.87Å; A467-W471 WeakPolarHBondContact O-CB 3.34Å; A467-W471 PolarHBondContact O-N 2.97Å
468	V	92.1	Very high	90.4	Very high	9 Å²	9	46 Å²	46	6%	0.055	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-45.7	177.2	171.9	0	0	0	0	110.7	L246 H464 L465 S466 D470 W471 L472	L246-V468 HydrophobicContact CD1-CG1 3.86Å; H464-V468 VanDerWaalsContact O-CG2 3.3Å; H464-V468 WeakPolarHBondContact O-CG2 3.47Å; H464-V468 PolarHBondContact O-N 2.88Å; L465-V468 PolarHBondContact O-N 3Å; S466-V468 PolarHBondContact O-N 2.89Å; V468-D470 VanDerWaalsContact C-N 3.32Å; V468-D470 PolarHBondContact O-N 2.76Å; V468-W471 PolarHBondContact O-N 3.44Å; V468-L472 HydrophobicContact CG1-CD1 3.9Å; V468-L472 HydrophobicContact CG1-CG 4.36Å; V468-L472 WeakPolarHBondContact O-CB 3.48Å; V468-L472 VanDerWaalsContact O-CG 3.3Å; V468-L472 WeakPolarHBondContact O-CG 3.32Å; V468-L472 PolarHBondContact O-N 3.06Å
469	V	90.9	Very high	90.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.2	-39.6	177.1	175	0	0	0	0	110.3	S243 R400 V419 L424 L465 S466 W471 L472 T473	S243-V469 WeakPolarHBondContact OG-CG2 3.18Å; R400-V469 VanDerWaalsContact NH1-C 3.29Å; V419-V469 HydrophobicContact CB-CG1 4.35Å; V419-V469 HydrophobicContact CG1-CG1 4.29Å; V419-V469 HydrophobicContact CG2-CG1 4.29Å; L424-V469 HydrophobicContact CD2-CG2 3.94Å; L465-V469 WeakPolarHBondContact O-CB 3.39Å; L465-V469 VanDerWaalsContact O-CG2 3.3Å; L465-V469 WeakPolarHBondContact O-CG2 3.36Å; L465-V469 PolarHBondContact O-N 3.25Å; S466-V469 PolarHBondContact O-N 3.25Å; V469-W471 VanDerWaalsContact C-N 3.33Å; V469-W471 PolarHBondContact O-N 3.45Å; V469-L472 PolarHBondContact O-N 2.81Å; V469-T473 HydrophobicContact CG1-CG2 4.25Å; V469-T473 WeakPolarHBondContact O-CB 3.28Å; V469-T473 VanDerWaalsContact O-CG2 3.3Å; V469-T473 WeakPolarHBondContact O-CG2 3.43Å; V469-T473 PolarHBondContact O-N 3.14Å; V469-T473 PolarHBondContact O-OG1 2.97Å
470	D	90.3	Very high	90.8	Very high	72 Å²	72	39.6 Å²	39.6	39%	0.385	22%	0.216	S	C	.	.	H	α-helix	trans	-59.9	-47.2	178.8	-81	-47.8	0	0	0	110.1	R400 S466 A467 V468 T473 A474	R400-D470 WeakPolarHBondContact CD-OD1 3.48Å; R400-D470 IonicContact CZ-OD1 2.91Å; R400-D470 IonicContact CZ-OD2 3.19Å; R400-D470 VanDerWaalsContact CZ-OD2 3.28Å; R400-D470 IonicContact NE-OD1 2.63Å; R400-D470 PolarHBondContact NE-OD1 3Å; R400-D470 IonicContact NH1-OD1 3.67Å; R400-D470 PolarHBondContact NH1-OD1 2.79Å; R400-D470 VanDerWaalsContact NH1-OD1 3.12Å; R400-D470 IonicContact NH1-OD2 2.92Å; R400-D470 PolarHBondContact NH1-OD2 3.46Å; R400-D470 IonicContact NH2-OD1 3.29Å; R400-D470 PolarHBondContact NH2-OD1 3.39Å; R400-D470 VanDerWaalsContact NH2-OD1 3.07Å; R400-D470 IonicContact NH2-OD2 3.07Å; R400-D470 PolarHBondContact NH2-OD2 2.65Å; S466-D470 WeakPolarHBondContact O-CB 3.27Å; S466-D470 VanDerWaalsContact O-CG 3.3Å; S466-D470 PolarHBondContact O-N 3.2Å; A467-D470 PolarHBondContact O-N 2.87Å; V468-D470 VanDerWaalsContact C-N 3.32Å; V468-D470 PolarHBondContact O-N 2.76Å; D470-T473 PolarHBondContact O-N 3.3Å; D470-T473 PolarHBondContact O-OG1 2.65Å; D470-A474 PolarHBondContact O-N 3.13Å
471	W	92.1	Very high	90.8	Very high	67 Å²	67	40.9 Å²	40.9	25%	0.254	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-43.9	176	168.3	67.5	0	0	0	113	A467 V468 V469 T473 A474 V488 T491 L492	A467-W471 WeakPolarHBondContact O-CB 3.34Å; A467-W471 PolarHBondContact O-N 2.97Å; V468-W471 PolarHBondContact O-N 3.44Å; V469-W471 VanDerWaalsContact C-N 3.33Å; V469-W471 PolarHBondContact O-N 3.45Å; W471-T473 PolarHBondContact O-N 3.19Å; W471-A474 WeakPolarHBondContact O-CB 3.4Å; W471-A474 PolarHBondContact O-N 2.93Å; W471-V488 HydrophobicContact CH2-CG1 4.39Å; W471-V488 HydrophobicContact CZ2-CG1 4.46Å; W471-T491 HydrophobicContact CD2-CG2 4.49Å; W471-T491 HydrophobicContact CH2-CG2 3.88Å; W471-T491 HydrophobicContact CZ2-CG2 3.41Å; W471-T491 VanDerWaalsContact CZ2-CG2 3.41Å; W471-L492 HydrophobicContact CH2-CD2 3.65Å; W471-L492 HydrophobicContact CH2-CG 3.81Å; W471-L492 HydrophobicContact CZ3-CD2 3.68Å; W471-L492 HydrophobicContact CZ3-CG 4.36Å
472	L	91.3	Very high	90.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-28.9	177.6	-73.5	173.4	0	0	0	112.6	G239 V242 V468 V469 R477	G239-L472 WeakPolarHBondContact O-CD1 3.47Å; V242-L472 HydrophobicContact CB-CD1 4.05Å; V242-L472 HydrophobicContact CG1-CD1 4.02Å; V468-L472 HydrophobicContact CG1-CD1 3.9Å; V468-L472 HydrophobicContact CG1-CG 4.36Å; V468-L472 WeakPolarHBondContact O-CB 3.48Å; V468-L472 VanDerWaalsContact O-CG 3.3Å; V468-L472 WeakPolarHBondContact O-CG 3.32Å; V468-L472 PolarHBondContact O-N 3.06Å; V469-L472 PolarHBondContact O-N 2.81Å; L472-R477 PolarHBondContact O-NE 3.18Å; L472-R477 VanDerWaalsContact O-NE 3.14Å
473	T	89.5	Confident	90.5	Very high	19 Å²	19	35.4 Å²	35.4	12%	0.117	20%	0.199	C	C	.	.	H	α-helix	trans	-90.6	-6.6	178.1	58.2	0	0	0	0	113.8	Y233 A235 R400 V469 D470 W471 Q475	Y233-T473 WeakPolarHBondContact CD1-O 3.13Å; A235-T473 HydrophobicContact CB-CG2 3.48Å; A235-T473 VanDerWaalsContact CB-CG2 3.48Å; R400-T473 HydrophobicContact CB-CG2 4.08Å; V469-T473 HydrophobicContact CG1-CG2 4.25Å; V469-T473 WeakPolarHBondContact O-CB 3.28Å; V469-T473 VanDerWaalsContact O-CG2 3.3Å; V469-T473 WeakPolarHBondContact O-CG2 3.43Å; V469-T473 PolarHBondContact O-N 3.14Å; V469-T473 PolarHBondContact O-OG1 2.97Å; D470-T473 PolarHBondContact O-N 3.3Å; D470-T473 PolarHBondContact O-OG1 2.65Å; W471-T473 PolarHBondContact O-N 3.19Å; T473-Q475 VanDerWaalsContact C-N 3.27Å; T473-Q475 PolarHBondContact O-N 3Å
474	A	89.1	Confident	90.1	Very high	77 Å²	77	29.8 Å²	29.8	64%	0.636	17%	0.172	S	C	*	.	S	Bend	trans	-73.4	-19.7	179.1	0	0	0	0	0	113.3	D470 W471	D470-A474 PolarHBondContact O-N 3.13Å; W471-A474 WeakPolarHBondContact O-CB 3.4Å; W471-A474 PolarHBondContact O-N 2.93Å
475	Q	90	Very high	89.7	Confident	52 Å²	52	34.4 Å²	34.4	24%	0.243	20%	0.198	C	C	.	.	S	Bend	trans	-141.4	144.7	179.8	61.5	-170.5	-36.1	0	0	111.1	T473 S487 V488	T473-Q475 VanDerWaalsContact C-N 3.27Å; T473-Q475 PolarHBondContact O-N 3Å; Q475-S487 PolarHBondContact OE1-OG 3.02Å; Q475-V488 HydrophobicContact CG-CG2 3.86Å
476	P	91.4	Very high	89.6	Confident	24 Å²	24	35.4 Å²	35.4	16%	0.156	21%	0.205	C	C	.	.			trans	-69.1	138.8	175.2	29.7	-35.3	0	0	0	110.7	W230 S232 L481	W230-P476 HydrophobicContact CE3-CG 4.23Å; W230-P476 WeakPolarHBondContact O-CB 3.38Å; W230-P476 WeakPolarHBondContact O-CG 3.28Å; S232-P476 WeakPolarHBondContact O-CA 3.47Å; P476-L481 HydrophobicContact CB-CD1 4.02Å; P476-L481 HydrophobicContact CG-CD1 3.89Å
477	R	91.7	Very high	89.6	Confident	1 Å²	1	37.1 Å²	37.1	0%	0.004	22%	0.217	C	C	.	.			trans	-120.4	31.6	-174.1	-60.4	174.3	-71.1	136.8	1.3	112.6	Y222 D223 T224 Y233 G234 L472 V482 V488	Y222-R477 PolarHBondContact O-NH1 3.48Å; D223-R477 WeakPolarHBondContact CA-O 3.4Å; T224-R477 HydrophobicContact CG2-CB 3.87Å; T224-R477 PolarHBondContact N-O 3.35Å; T224-R477 VanDerWaalsContact N-O 3.13Å; T224-R477 WeakPolarHBondContact OG1-CA 3.02Å; T224-R477 PolarHBondContact OG1-N 2.89Å; T224-R477 PolarHBondContact OG1-O 2.85Å; Y233-R477 PolarHBondContact O-NH2 3.24Å; G234-R477 PolarHBondContact O-NH2 2.99Å; L472-R477 PolarHBondContact O-NE 3.18Å; L472-R477 VanDerWaalsContact O-NE 3.14Å; R477-V482 HydrophobicContact CB-CG2 4.31Å; R477-V488 HydrophobicContact CG-CG1 4.37Å; R477-V488 HydrophobicContact CG-CG2 4.22Å
478	A	91.4	Very high	89.6	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-62.9	140.5	173.8	0	0	0	0	0	109.6	T224 P229 Q480 L481 V482	T224-A478 PolarHBondContact OG1-N 2.92Å; P229-A478 HydrophobicContact CB-CB 3.68Å; A478-Q480 PolarHBondContact O-N 3.21Å; A478-L481 HydrophobicContact CB-CD1 4.32Å; A478-L481 HydrophobicContact CB-CG 4.31Å; A478-L481 PolarHBondContact O-N 3.46Å; A478-V482 PolarHBondContact O-N 3.45Å
479	A	89.7	Confident	89.6	Confident	2 Å²	2	34.2 Å²	34.2	2%	0.017	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.8	-175.5	0	0	0	0	0	113.7	W196 F277 L481 F519	W196-A479 VanDerWaalsContact CE2-O 3.23Å; W196-A479 WeakPolarHBondContact CZ2-O 3.48Å; W196-A479 PolarHBondContact NE1-O 3.39Å; F277-A479 HydrophobicContact CD2-CB 3.52Å; F277-A479 HydrophobicContact CE2-CB 3.53Å; A479-L481 VanDerWaalsContact C-N 3.31Å; A479-F519 HydrophobicContact CB-CE2 4.46Å; A479-F519 HydrophobicContact CB-CZ 4.23Å
480	Q	90.2	Very high	89.7	Confident	11 Å²	11	36.3 Å²	36.3	5%	0.051	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-18	174	-65.2	167.1	-0	0	0	113.7	W196 F277 A478 F519 L523	W196-Q480 VanDerWaalsContact CH2-O 3.26Å; W196-Q480 WeakPolarHBondContact CH2-O 3.35Å; W196-Q480 VanDerWaalsContact CZ2-C 3.46Å; W196-Q480 WeakPolarHBondContact CZ2-O 3.43Å; F277-Q480 HydrophobicContact CZ-CG 4.41Å; A478-Q480 PolarHBondContact O-N 3.21Å; Q480-F519 HydrophobicContact CG-CB 4.14Å; Q480-F519 HydrophobicContact CG-CD1 3.56Å; Q480-F519 HydrophobicContact CG-CD2 4.25Å; Q480-F519 HydrophobicContact CG-CE1 3.96Å; Q480-F519 HydrophobicContact CG-CG 3.73Å; Q480-F519 HydrophobicContact CG-CZ 4.46Å; Q480-L523 HydrophobicContact CB-CD1 3.85Å
481	L	90.1	Very high	89.9	Confident	43 Å²	43	35.6 Å²	35.6	23%	0.225	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-26	-178	-56.7	-179.9	0	0	0	111.9	P229 W230 P476 A478 A479 D483 L523	P229-L481 HydrophobicContact CB-CD1 4.24Å; P229-L481 HydrophobicContact CB-CG 4.36Å; W230-L481 HydrophobicContact CD2-CD1 4.04Å; W230-L481 HydrophobicContact CD2-CD2 4.22Å; W230-L481 HydrophobicContact CE3-CD1 4.44Å; W230-L481 HydrophobicContact CG-CD1 4.13Å; W230-L481 HydrophobicContact CG-CD2 4.46Å; W230-L481 HydrophobicContact CZ2-CD2 3.91Å; P476-L481 HydrophobicContact CB-CD1 4.02Å; P476-L481 HydrophobicContact CG-CD1 3.89Å; A478-L481 HydrophobicContact CB-CD1 4.32Å; A478-L481 HydrophobicContact CB-CG 4.31Å; A478-L481 PolarHBondContact O-N 3.46Å; A479-L481 VanDerWaalsContact C-N 3.31Å; L481-D483 PolarHBondContact O-N 2.82Å; L481-L523 HydrophobicContact CD2-CD1 4.02Å
482	V	89.6	Confident	90	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.036	20%	0.195	C	C	.	.			trans	-85.9	92.9	-177.9	-174.2	0	0	0	0	110.4	W196 Y222 R477 A478 S486 V489	W196-V482 VanDerWaalsContact CZ2-C 3.44Å; W196-V482 VanDerWaalsContact CZ2-O 3.27Å; W196-V482 WeakPolarHBondContact CZ2-O 3.48Å; Y222-V482 HydrophobicContact CE2-CB 4.45Å; Y222-V482 HydrophobicContact CE2-CG1 3.89Å; Y222-V482 HydrophobicContact CE2-CG2 4.37Å; R477-V482 HydrophobicContact CB-CG2 4.31Å; A478-V482 PolarHBondContact O-N 3.45Å; V482-S486 VanDerWaalsContact CG1-OG 3.27Å; V482-S486 WeakPolarHBondContact CG1-OG 3.21Å; V482-V489 HydrophobicContact CG1-CG2 3.72Å
483	D	85	Confident	90.2	Very high	67 Å²	67	34.6 Å²	34.6	36%	0.358	21%	0.205	S	C	.	.			trans	-79.8	171.7	171.1	-160.9	3.7	0	0	0	111.6	W196 L481 D485 S486	W196-D483 HydrophobicContact CH2-CB 3.76Å; W196-D483 HydrophobicContact CZ2-CB 4.36Å; W196-D483 HydrophobicContact CZ3-CB 4.12Å; L481-D483 PolarHBondContact O-N 2.82Å; D483-D485 VanDerWaalsContact C-N 3.25Å; D483-D485 PolarHBondContact O-N 3Å; D483-S486 WeakPolarHBondContact O-CB 3.43Å; D483-S486 PolarHBondContact O-N 2.91Å; D483-S486 VanDerWaalsContact O-N 3.08Å; D483-S486 PolarHBondContact O-OG 2.85Å
484	K	82.9	Confident	90.4	Very high	51 Å²	51	41.5 Å²	41.5	22%	0.222	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-35.8	179.9	-69.6	177.6	-106.4	-168.8	0	114.1	A197 Y507	A197-K484 HydrophobicContact CB-CD 3.53Å; A197-K484 HydrophobicContact CB-CG 3.81Å; K484-Y507 HydrophobicContact CB-CE1 4.02Å; K484-Y507 HydrophobicContact CD-CD1 3.89Å; K484-Y507 HydrophobicContact CD-CE1 4Å; K484-Y507 HydrophobicContact CG-CD1 3.8Å; K484-Y507 HydrophobicContact CG-CE1 3.75Å
485	D	82.8	Confident	90.6	Very high	134 Å²	134	39.3 Å²	39.3	72%	0.717	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	16.8	-178.1	-60.6	-38.4	0	0	0	112.4	D483	D483-D485 VanDerWaalsContact C-N 3.25Å; D483-D485 PolarHBondContact O-N 3Å
486	S	87.9	Confident	90.8	Very high	20 Å²	20	36.9 Å²	36.9	14%	0.14	20%	0.195	C	C	.	.			trans	-60.4	145.6	178.3	60.6	0	0	0	0	112.1	V482 D483 V488 V489 S490	V482-S486 VanDerWaalsContact CG1-OG 3.27Å; V482-S486 WeakPolarHBondContact CG1-OG 3.21Å; D483-S486 WeakPolarHBondContact O-CB 3.43Å; D483-S486 PolarHBondContact O-N 2.91Å; D483-S486 VanDerWaalsContact O-N 3.08Å; D483-S486 PolarHBondContact O-OG 2.85Å; S486-V488 PolarHBondContact O-N 3.37Å; S486-V489 PolarHBondContact O-N 3.48Å; S486-V489 VanDerWaalsContact OG-CG2 3.22Å; S486-V489 WeakPolarHBondContact OG-CG2 3.16Å; S486-S490 PolarHBondContact O-N 3.43Å; S486-S490 PolarHBondContact O-OG 3.5Å
487	S	91.3	Very high	90.9	Very high	67 Å²	67	38.7 Å²	38.7	47%	0.469	21%	0.208	S	C	.	.	H	α-helix	trans	-61.4	-34.8	175.8	62.2	0	0	0	0	111.7	Q475 T491	Q475-S487 PolarHBondContact OE1-OG 3.02Å; S487-T491 VanDerWaalsContact O-CB 3.28Å; S487-T491 WeakPolarHBondContact O-CB 3.41Å; S487-T491 PolarHBondContact O-N 3.03Å; S487-T491 PolarHBondContact O-OG1 2.65Å
488	V	91.7	Very high	91	Very high	4 Å²	4	47 Å²	47	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-57.1	-56.6	177.3	-178.2	0	0	0	0	110.4	W471 Q475 R477 S486 S490 T491 L492	W471-V488 HydrophobicContact CH2-CG1 4.39Å; W471-V488 HydrophobicContact CZ2-CG1 4.46Å; Q475-V488 HydrophobicContact CG-CG2 3.86Å; R477-V488 HydrophobicContact CG-CG1 4.37Å; R477-V488 HydrophobicContact CG-CG2 4.22Å; S486-V488 PolarHBondContact O-N 3.37Å; V488-S490 PolarHBondContact O-N 2.84Å; V488-T491 PolarHBondContact O-N 2.92Å; V488-L492 HydrophobicContact CG1-CD1 4.2Å; V488-L492 HydrophobicContact CG1-CG 4.44Å; V488-L492 WeakPolarHBondContact O-CG 3.38Å; V488-L492 PolarHBondContact O-N 2.78Å
489	V	92.7	Very high	91.1	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-43.3	-175.6	173.7	0	0	0	0	110.7	T199 L201 V482 S486 T491 L492 E493	T199-V489 HydrophobicContact CG2-CG1 3.72Å; L201-V489 HydrophobicContact CD1-CG1 4.38Å; L201-V489 HydrophobicContact CD2-CG1 4.14Å; L201-V489 HydrophobicContact CG-CG1 4.46Å; V482-V489 HydrophobicContact CG1-CG2 3.72Å; S486-V489 PolarHBondContact O-N 3.48Å; S486-V489 VanDerWaalsContact OG-CG2 3.22Å; S486-V489 WeakPolarHBondContact OG-CG2 3.16Å; V489-T491 VanDerWaalsContact C-N 3.32Å; V489-T491 PolarHBondContact O-N 3.4Å; V489-L492 PolarHBondContact O-N 3.31Å; V489-E493 WeakPolarHBondContact O-CB 3.38Å; V489-E493 PolarHBondContact O-N 3.28Å
490	S	93.4	Very high	91.2	Very high	44 Å²	44	49.4 Å²	49.4	31%	0.308	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-36.6	178.2	-58.4	0	0	0	0	112.4	S486 V488 Y494 R505	S486-S490 PolarHBondContact O-N 3.43Å; S486-S490 PolarHBondContact O-OG 3.5Å; V488-S490 PolarHBondContact O-N 2.84Å; S490-Y494 WeakPolarHBondContact O-CB 3.31Å; S490-Y494 PolarHBondContact O-N 2.94Å; S490-R505 PolarHBondContact OG-NH2 2.84Å
491	T	94.4	Very high	91.1	Very high	57 Å²	57	55.2 Å²	55.2	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-73.4	-38.8	176.7	-53.7	0	0	0	0	111.7	W471 S487 V488 V489 E493 Y494 H495	W471-T491 HydrophobicContact CD2-CG2 4.49Å; W471-T491 HydrophobicContact CH2-CG2 3.88Å; W471-T491 HydrophobicContact CZ2-CG2 3.41Å; W471-T491 VanDerWaalsContact CZ2-CG2 3.41Å; S487-T491 VanDerWaalsContact O-CB 3.28Å; S487-T491 WeakPolarHBondContact O-CB 3.41Å; S487-T491 PolarHBondContact O-N 3.03Å; S487-T491 PolarHBondContact O-OG1 2.65Å; V488-T491 PolarHBondContact O-N 2.92Å; V489-T491 VanDerWaalsContact C-N 3.32Å; V489-T491 PolarHBondContact O-N 3.4Å; T491-E493 VanDerWaalsContact C-N 3.35Å; T491-Y494 PolarHBondContact O-N 3.06Å; T491-H495 WeakPolarHBondContact O-CB 3.42Å; T491-H495 PolarHBondContact O-N 3.04Å
492	L	94.1	Very high	90.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-46.5	172.4	-74	178.3	0	0	0	110.8	L201 Y222 V242 L246 V271 W471 V488 V489 Y494 H495 L496	L201-L492 HydrophobicContact CD1-CB 3.48Å; L201-L492 VanDerWaalsContact CD1-CB 3.48Å; L201-L492 HydrophobicContact CD1-CD1 4.36Å; Y222-L492 HydrophobicContact CD1-CD1 3.92Å; Y222-L492 HydrophobicContact CG-CD1 4.02Å; V242-L492 HydrophobicContact CG1-CD2 3.97Å; L246-L492 HydrophobicContact CD1-CD2 4.04Å; V271-L492 HydrophobicContact CG1-CD1 4.38Å; W471-L492 HydrophobicContact CH2-CD2 3.65Å; W471-L492 HydrophobicContact CH2-CG 3.81Å; W471-L492 HydrophobicContact CZ3-CD2 3.68Å; W471-L492 HydrophobicContact CZ3-CG 4.36Å; V488-L492 HydrophobicContact CG1-CD1 4.2Å; V488-L492 HydrophobicContact CG1-CG 4.44Å; V488-L492 WeakPolarHBondContact O-CG 3.38Å; V488-L492 PolarHBondContact O-N 2.78Å; V489-L492 PolarHBondContact O-N 3.31Å; L492-Y494 PolarHBondContact O-N 3.01Å; L492-H495 PolarHBondContact O-N 2.89Å; L492-L496 WeakPolarHBondContact O-CB 3.48Å; L492-L496 VanDerWaalsContact O-CG 3.28Å; L492-L496 WeakPolarHBondContact O-CG 3.29Å; L492-L496 PolarHBondContact O-N 3.43Å
493	E	94.3	Very high	90.8	Very high	47 Å²	47	60 Å²	60	22%	0.22	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-45.9	176.6	-177.3	-173.6	-133.5	0	0	111.3	L201 V489 T491 H495 L496 S497 V503 R505	L201-E493 HydrophobicContact CD1-CB 4.24Å; L201-E493 HydrophobicContact CD2-CB 4.17Å; V489-E493 WeakPolarHBondContact O-CB 3.38Å; V489-E493 PolarHBondContact O-N 3.28Å; T491-E493 VanDerWaalsContact C-N 3.35Å; E493-H495 VanDerWaalsContact C-N 3.34Å; E493-H495 PolarHBondContact O-N 2.81Å; E493-L496 PolarHBondContact O-N 3.13Å; E493-S497 VanDerWaalsContact O-CB 3.24Å; E493-S497 WeakPolarHBondContact O-CB 3.24Å; E493-S497 PolarHBondContact O-N 3.44Å; E493-S497 PolarHBondContact O-OG 3.48Å; E493-V503 HydrophobicContact CG-CG1 3.83Å; E493-R505 WeakPolarHBondContact OE1-CG 3.25Å; E493-R505 IonicContact OE1-CZ 3.07Å; E493-R505 IonicContact OE1-NE 2.63Å; E493-R505 PolarHBondContact OE1-NE 2.92Å; E493-R505 IonicContact OE1-NH2 3.69Å; E493-R505 IonicContact OE2-CZ 3.23Å; E493-R505 IonicContact OE2-NE 2.87Å; E493-R505 PolarHBondContact OE2-NE 3.39Å; E493-R505 IonicContact OE2-NH2 3.56Å; E493-R505 PolarHBondContact OE2-NH2 2.88Å
494	Y	94.4	Very high	91.1	Very high	163 Å²	163	62.6 Å²	62.6	64%	0.639	31%	0.309	S	S	*	.	H	α-helix	trans	-58.6	-45.9	176.5	177.3	-102.8	0	0	0	111.8	S490 T491 L492 S497 R498	S490-Y494 WeakPolarHBondContact O-CB 3.31Å; S490-Y494 PolarHBondContact O-N 2.94Å; T491-Y494 PolarHBondContact O-N 3.06Å; L492-Y494 PolarHBondContact O-N 3.01Å; Y494-S497 PolarHBondContact O-N 3.45Å; Y494-S497 PolarHBondContact O-OG 2.99Å; Y494-R498 PolarHBondContact O-N 2.86Å
495	H	93.5	Very high	91.4	Very high	32 Å²	32	63.6 Å²	63.6	15%	0.148	31%	0.311	C	S	.	.	H	α-helix	trans	-63.1	-47.2	177.9	-170.9	-65.7	0	0	0	111.8	H464 T491 L492 E493 S497 R498 Y499	H464-H495 AromaticContact CE1-NE2 3.19Å; H464-H495 PolarHBondContact CE1-NE2 3.28Å; H464-H495 AromaticContact NE2-CE1 3.55Å; H464-H495 AromaticContact NE2-NE2 2.99Å; H464-H495 PolarHBondContact NE2-NE2 2.95Å; T491-H495 WeakPolarHBondContact O-CB 3.42Å; T491-H495 PolarHBondContact O-N 3.04Å; L492-H495 PolarHBondContact O-N 2.89Å; E493-H495 VanDerWaalsContact C-N 3.34Å; E493-H495 PolarHBondContact O-N 2.81Å; H495-S497 PolarHBondContact O-N 2.86Å; H495-R498 WeakPolarHBondContact O-CB 3.39Å; H495-R498 PolarHBondContact O-N 3.39Å; H495-Y499 AromaticContact CE1-CD2 3.91Å; H495-Y499 AromaticContact CE1-CE2 3.61Å; H495-Y499 AromaticContact ND1-CD2 3.91Å; H495-Y499 AromaticContact ND1-CE2 3.94Å; H495-Y499 WeakPolarHBondContact O-CD2 3.45Å
496	L	94.2	Very high	91.7	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-43.8	176	-70.9	169.3	0	0	0	111.4	L201 L245 L246 V271 L492 E493 R498 Y499 L500 V503	L201-L496 HydrophobicContact CB-CD1 3.99Å; L201-L496 HydrophobicContact CD1-CD1 4.11Å; L245-L496 HydrophobicContact CD2-CD2 4.24Å; L246-L496 HydrophobicContact CD2-CD2 3.59Å; L246-L496 HydrophobicContact CD2-CG 3.92Å; V271-L496 HydrophobicContact CG2-CD1 3.9Å; L492-L496 WeakPolarHBondContact O-CB 3.48Å; L492-L496 VanDerWaalsContact O-CG 3.28Å; L492-L496 WeakPolarHBondContact O-CG 3.29Å; L492-L496 PolarHBondContact O-N 3.43Å; E493-L496 PolarHBondContact O-N 3.13Å; L496-R498 PolarHBondContact O-N 3.27Å; L496-Y499 PolarHBondContact O-N 3.09Å; L496-L500 HydrophobicContact CB-CD1 4.28Å; L496-L500 HydrophobicContact CD2-CD1 3.61Å; L496-L500 WeakPolarHBondContact O-CB 3.33Å; L496-L500 PolarHBondContact O-N 3.14Å; L496-V503 HydrophobicContact CB-CG1 4.36Å; L496-V503 HydrophobicContact CB-CG2 4.1Å
497	S	94.5	Very high	91.8	Very high	62 Å²	62	62.1 Å²	62.1	43%	0.434	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-22.4	-178.1	74.5	0	0	0	0	113.5	E493 Y494 H495 Y499	E493-S497 VanDerWaalsContact O-CB 3.24Å; E493-S497 WeakPolarHBondContact O-CB 3.24Å; E493-S497 PolarHBondContact O-N 3.44Å; E493-S497 PolarHBondContact O-OG 3.48Å; Y494-S497 PolarHBondContact O-N 3.45Å; Y494-S497 PolarHBondContact O-OG 2.99Å; H495-S497 PolarHBondContact O-N 2.86Å; S497-Y499 VanDerWaalsContact C-N 3.32Å
498	R	93.9	Very high	91.5	Very high	177 Å²	177	59.3 Å²	59.3	67%	0.668	27%	0.274	S	S	*	.	H	α-helix	trans	-70.5	-30	175	-173.7	176.1	-179.3	175.1	0.7	112.4	Y494 H495 L496	Y494-R498 PolarHBondContact O-N 2.86Å; H495-R498 WeakPolarHBondContact O-CB 3.39Å; H495-R498 PolarHBondContact O-N 3.39Å; L496-R498 PolarHBondContact O-N 3.27Å
499	Y	92.3	Very high	91.1	Very high	43 Å²	43	65.1 Å²	65.1	17%	0.169	30%	0.299	C	S	.	.	H	α-helix	trans	-114	-28.5	-172.8	-62.6	-63.7	0	0	0	113.5	R250 S253 H495 L496 S497	R250-Y499 HydrophobicContact CB-CD1 4.29Å; R250-Y499 HydrophobicContact CB-CD2 4.36Å; R250-Y499 HydrophobicContact CB-CE1 4.24Å; R250-Y499 HydrophobicContact CB-CE2 4.29Å; R250-Y499 HydrophobicContact CB-CG 4.36Å; R250-Y499 HydrophobicContact CG-CD1 4.08Å; R250-Y499 HydrophobicContact CG-CE1 3.62Å; R250-Y499 HydrophobicContact CG-CE2 4.28Å; S253-Y499 WeakPolarHBondContact CB-O 3.21Å; S253-Y499 PolarHBondContact OG-O 3.47Å; H495-Y499 AromaticContact CE1-CD2 3.91Å; H495-Y499 AromaticContact CE1-CE2 3.61Å; H495-Y499 AromaticContact ND1-CD2 3.91Å; H495-Y499 AromaticContact ND1-CE2 3.94Å; H495-Y499 WeakPolarHBondContact O-CD2 3.45Å; L496-Y499 PolarHBondContact O-N 3.09Å; S497-Y499 VanDerWaalsContact C-N 3.32Å
500	L	92.6	Very high	90.5	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.052	31%	0.307	C	S	.	.	S	Bend	trans	-110.1	159.7	-175.5	-53.7	-179.5	0	0	0	111	L205 A249 F269 L496 V503	L205-L500 HydrophobicContact CD1-CD2 3.88Å; L205-L500 HydrophobicContact CD2-CD2 3.81Å; L205-L500 HydrophobicContact CG-CD2 3.61Å; A249-L500 HydrophobicContact CB-CD1 4.3Å; A249-L500 HydrophobicContact CB-CD2 3.99Å; A249-L500 HydrophobicContact CB-CG 4.26Å; F269-L500 HydrophobicContact CB-CD1 3.71Å; F269-L500 HydrophobicContact CD2-CD1 3.78Å; F269-L500 HydrophobicContact CD2-CD2 3.52Å; F269-L500 HydrophobicContact CD2-CG 4.34Å; F269-L500 HydrophobicContact CE2-CD2 3.75Å; F269-L500 HydrophobicContact CG-CD1 3.96Å; F269-L500 HydrophobicContact CG-CD2 4.39Å; L496-L500 HydrophobicContact CB-CD1 4.28Å; L496-L500 HydrophobicContact CD2-CD1 3.61Å; L496-L500 WeakPolarHBondContact O-CB 3.33Å; L496-L500 PolarHBondContact O-N 3.14Å; L500-V503 HydrophobicContact CB-CG2 4.31Å
501	K	86.5	Confident	89.7	Confident	133 Å²	133	68.7 Å²	68.7	58%	0.578	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	154.9	172.9	-61.5	178.6	-176.4	173.6	0	109.7	R204 V503	R204-K501 PolarHBondContact N-O 3.32Å; R204-K501 PolarHBondContact O-N 3.3Å; K501-V503 PolarHBondContact O-N 2.9Å
502	D	84.4	Confident	89	Confident	119 Å²	119	73 Å²	73	64%	0.636	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.8	51.8	173.2	-55.3	-40.4	0	0	0	114.1	K504	D502-K504 PolarHBondContact O-N 2.96Å
503	V	90.6	Very high	88.2	Confident	31 Å²	31	83.5 Å²	83.5	19%	0.188	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	122.5	176.4	-174.7	0	0	0	0	109.9	E202 E493 L496 L500 K501	E202-V503 CarbonylContact O-C 3.28Å; E202-V503 WeakPolarHBondContact O-CA 3.47Å; E493-V503 HydrophobicContact CG-CG1 3.83Å; L496-V503 HydrophobicContact CB-CG1 4.36Å; L496-V503 HydrophobicContact CB-CG2 4.1Å; L500-V503 HydrophobicContact CB-CG2 4.31Å; K501-V503 PolarHBondContact O-N 2.9Å
504	K	89.7	Confident	87.4	Confident	121 Å²	121	87.6 Å²	87.6	53%	0.526	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.8	-177.5	-67.9	177.3	-175.1	175.9	0	110.9	L201 E202 D502	L201-K504 WeakPolarHBondContact CA-O 3.19Å; E202-K504 PolarHBondContact N-O 3.37Å; E202-K504 PolarHBondContact O-N 3.47Å; D502-K504 PolarHBondContact O-N 2.96Å
505	R	91.3	Very high	86.6	Confident	72 Å²	72	82.4 Å²	82.4	27%	0.272	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.8	172	-58.1	-177.7	179.7	-163.4	-9.6	109.7	T199 S200 L201 S490 E493 Y507	T199-R505 HydrophobicContact CG2-CB 4.33Å; S200-R505 CarbonylContact O-C 2.96Å; S200-R505 WeakPolarHBondContact O-CA 3.45Å; L201-R505 HydrophobicContact CD2-CB 4.44Å; L201-R505 HydrophobicContact CD2-CG 3.74Å; S490-R505 PolarHBondContact OG-NH2 2.84Å; E493-R505 WeakPolarHBondContact OE1-CG 3.25Å; E493-R505 IonicContact OE1-CZ 3.07Å; E493-R505 IonicContact OE1-NE 2.63Å; E493-R505 PolarHBondContact OE1-NE 2.92Å; E493-R505 IonicContact OE1-NH2 3.69Å; E493-R505 IonicContact OE2-CZ 3.23Å; E493-R505 IonicContact OE2-NE 2.87Å; E493-R505 PolarHBondContact OE2-NE 3.39Å; E493-R505 IonicContact OE2-NH2 3.56Å; E493-R505 PolarHBondContact OE2-NH2 2.88Å; R505-Y507 HydrophobicContact CB-CE2 3.99Å; R505-Y507 VanDerWaalsContact CD-OH 3.26Å; R505-Y507 WeakPolarHBondContact CD-OH 3.45Å
506	H	88.6	Confident	86.2	Confident	30 Å²	30	84.1 Å²	84.1	14%	0.139	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.8	172.8	-66	-79.4	0	0	0	109	T199 S200 E202 W285	T199-H506 CarbonylContact C-O 3.48Å; T199-H506 WeakPolarHBondContact CA-O 3.33Å; S200-H506 PolarHBondContact N-O 3.26Å; S200-H506 PolarHBondContact O-N 3.46Å; E202-H506 IonicContact OE2-CD2 3.7Å; E202-H506 IonicContact OE2-CE1 3.67Å; E202-H506 IonicContact OE2-NE2 2.82Å; E202-H506 PolarHBondContact OE2-NE2 3.43Å; W285-H506 AromaticContact CD1-CD2 3.62Å; W285-H506 AromaticContact CD1-CE1 3.93Å; W285-H506 AromaticContact CD1-NE2 3.51Å; W285-H506 AromaticContact NE1-NE2 3.77Å
507	Y	88.6	Confident	85.9	Confident	93 Å²	93	84.5 Å²	84.5	37%	0.365	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128	-177.6	-62.2	-76.4	0	0	0	110.7	T199 K484 R505	T199-Y507 HydrophobicContact CG2-CD1 4Å; T199-Y507 HydrophobicContact CG2-CE1 3.68Å; T199-Y507 WeakPolarHBondContact OG1-CD1 3.31Å; T199-Y507 WeakPolarHBondContact OG1-CE1 3.44Å; K484-Y507 HydrophobicContact CB-CE1 4.02Å; K484-Y507 HydrophobicContact CD-CD1 3.89Å; K484-Y507 HydrophobicContact CD-CE1 4Å; K484-Y507 HydrophobicContact CG-CD1 3.8Å; K484-Y507 HydrophobicContact CG-CE1 3.75Å; R505-Y507 HydrophobicContact CB-CE2 3.99Å; R505-Y507 VanDerWaalsContact CD-OH 3.26Å; R505-Y507 WeakPolarHBondContact CD-OH 3.45Å
508	V	85	Confident	85.7	Confident	8 Å²	8	82.7 Å²	82.7	5%	0.048	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.8	173.4	-167.1	0	0	0	0	108.6	A197 I198 R284 F517	A197-V508 CarbonylContact C-O 3.6Å; A197-V508 WeakPolarHBondContact CA-O 3.45Å; A197-V508 WeakPolarHBondContact CB-O 3.28Å; I198-V508 HydrophobicContact CB-CB 4.28Å; I198-V508 PolarHBondContact N-O 2.89Å; I198-V508 PolarHBondContact O-N 2.85Å; R284-V508 HydrophobicContact CB-CB 4.17Å; R284-V508 HydrophobicContact CB-CG1 3.9Å; R284-V508 HydrophobicContact CB-CG2 3.36Å; R284-V508 HydrophobicContact CG-CB 4.3Å; R284-V508 HydrophobicContact CG-CG1 4.17Å; R284-V508 HydrophobicContact CG-CG2 3.71Å; V508-F517 HydrophobicContact CG1-CE1 4.48Å
509	K	84.4	Confident	85.6	Confident	126 Å²	126	74.4 Å²	74.4	55%	0.548	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.3	170.2	-66.6	-180	-177.7	179.2	0	108.3	A197	A197-K509 HydrophobicContact CB-CG 3.67Å
510	A	79	Confident	85.5	Confident	20 Å²	20	73.9 Å²	73.9	17%	0.165	34%	0.344	C	S	.	.			trans	-63.6	141.4	168.7	0	0	0	0	0	109.6	P515 F517	A510-P515 HydrophobicContact CB-CB 4.14Å; A510-F517 HydrophobicContact CB-CD1 4.35Å; A510-F517 HydrophobicContact CB-CE1 4.05Å; A510-F517 HydrophobicContact CB-CE2 4.22Å; A510-F517 HydrophobicContact CB-CZ 3.98Å; A510-F517 WeakPolarHBondContact CB-O 3.28Å
511	D	78.3	Confident	85.2	Confident	98 Å²	98	75.9 Å²	75.9	52%	0.524	35%	0.354	S	S	.	.			trans	-67.1	143.3	171.7	-169.3	3	0	0	0	109.6	R513 P515	D511-R513 VanDerWaalsContact C-N 3.32Å; D511-P515 VanDerWaalsContact O-CA 3.31Å; D511-P515 WeakPolarHBondContact O-CA 3.31Å; D511-P515 WeakPolarHBondContact O-CB 3.34Å
512	K	78.6	Confident	85.3	Confident	149 Å²	149	72.2 Å²	72.2	65%	0.648	34%	0.339	S	S	*	.	S	Bend	trans	-74.8	-23.5	-177.6	-59.9	-166.3	-178.9	-145.5	0	112.7	D195	D195-K512 WeakPolarHBondContact OD1-CE 3.47Å; D195-K512 IonicContact OD1-NZ 3.46Å; D195-K512 PolarHBondContact OD1-NZ 2.87Å; D195-K512 IonicContact OD2-NZ 3.61Å; D195-K512 PolarHBondContact OD2-NZ 2.84Å; D195-K512 VanDerWaalsContact OD2-NZ 3.13Å
513	R	78.2	Confident	85.5	Confident	219 Å²	219	67 Å²	67	83%	0.826	31%	0.311	S	S	*	.	S	Bend	trans	-85.7	-50.8	-178.7	-69	-179	176.6	174.1	0.2	111.4	D511	D511-R513 VanDerWaalsContact C-N 3.32Å
514	D	77.4	Confident	85.5	Confident	134 Å²	134	70 Å²	70	72%	0.717	32%	0.322	S	S	*	.	S	Bend	trans	-128.3	83.9	178.7	-69.2	-41.4	0	0	0	109.8	E516	D514-E516 PolarHBondContact O-N 3.34Å
515	P	78	Confident	85.6	Confident	53 Å²	53	64.7 Å²	64.7	34%	0.344	30%	0.299	S	S	.	.			trans	-71.6	118.3	-177.9	27.9	-33.3	0	0	0	110.6	A510 D511 F517 V518	A510-P515 HydrophobicContact CB-CB 4.14Å; D511-P515 VanDerWaalsContact O-CA 3.31Å; D511-P515 WeakPolarHBondContact O-CA 3.31Å; D511-P515 WeakPolarHBondContact O-CB 3.34Å; P515-F517 PolarHBondContact O-N 3.25Å; P515-V518 HydrophobicContact CB-CG2 3.65Å; P515-V518 HydrophobicContact CG-CG2 3.63Å
516	E	83.5	Confident	85.5	Confident	69 Å²	69	63.4 Å²	63.4	32%	0.322	30%	0.299	S	S	.	.	S	Bend	trans	-67.9	-26.1	175.5	-59.8	-168.7	177.7	0	0	113	Q54 Q280 K283 D514	Q54-E516 PolarHBondContact N-O 2.86Å; Q280-E516 PolarHBondContact NE2-OE2 2.82Å; Q280-E516 PolarHBondContact OE1-OE2 3.21Å; Q280-E516 VanDerWaalsContact OE1-OE2 3.13Å; K283-E516 IonicContact NZ-OE1 3.28Å; K283-E516 PolarHBondContact NZ-OE1 3.29Å; K283-E516 IonicContact NZ-OE2 3.8Å; K283-E516 PolarHBondContact NZ-OE2 2.77Å; D514-E516 PolarHBondContact O-N 3.34Å
517	F	88.6	Confident	85.7	Confident	7 Å²	7	62 Å²	62	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	142.2	173.1	64	-88.4	0	0	0	109.9	D52 L53 I198 Q280 V508 A510 P515 F519	D52-F517 CarbonylContact O-C 3.59Å; D52-F517 VanDerWaalsContact O-CA 3.29Å; D52-F517 WeakPolarHBondContact O-CA 3.3Å; L53-F517 HydrophobicContact CD2-CB 3.88Å; I198-F517 HydrophobicContact CD1-CD2 4.39Å; I198-F517 HydrophobicContact CD1-CE1 4Å; I198-F517 HydrophobicContact CD1-CE2 3.82Å; I198-F517 HydrophobicContact CD1-CZ 3.59Å; I198-F517 HydrophobicContact CG1-CE2 4.26Å; I198-F517 HydrophobicContact CG1-CZ 4.1Å; Q280-F517 HydrophobicContact CB-CE1 4.49Å; Q280-F517 HydrophobicContact CG-CD1 4.06Å; Q280-F517 HydrophobicContact CG-CE1 4.41Å; V508-F517 HydrophobicContact CG1-CE1 4.48Å; A510-F517 HydrophobicContact CB-CD1 4.35Å; A510-F517 HydrophobicContact CB-CE1 4.05Å; A510-F517 HydrophobicContact CB-CE2 4.22Å; A510-F517 HydrophobicContact CB-CZ 3.98Å; A510-F517 WeakPolarHBondContact CB-O 3.28Å; P515-F517 PolarHBondContact O-N 3.25Å; F517-F519 HydrophobicContact CD2-CD2 4.11Å; F517-F519 HydrophobicContact CD2-CE1 4.27Å; F517-F519 AromaticContact CD2-CE2 3.64Å; F517-F519 HydrophobicContact CD2-CE2 3.64Å; F517-F519 AromaticContact CD2-CZ 3.73Å; F517-F519 HydrophobicContact CD2-CZ 3.73Å; F517-F519 HydrophobicContact CE2-CD2 4.28Å; F517-F519 AromaticContact CE2-CE2 3.79Å; F517-F519 HydrophobicContact CE2-CE2 3.79Å; F517-F519 HydrophobicContact CE2-CZ 4.28Å; F517-F519 HydrophobicContact CG-CZ 4.48Å
518	V	90.1	Very high	85.8	Confident	25 Å²	25	58.4 Å²	58.4	15%	0.152	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.9	173.4	-177.6	0	0	0	0	108.7	Y51 D52 A192 P515 Y520	Y51-V518 VanDerWaalsContact CA-O 3.28Å; Y51-V518 WeakPolarHBondContact CA-O 3.47Å; Y51-V518 WeakPolarHBondContact CB-O 3.41Å; D52-V518 HydrophobicContact CB-CB 4.19Å; D52-V518 PolarHBondContact N-O 3.47Å; D52-V518 PolarHBondContact O-N 3.1Å; A192-V518 HydrophobicContact CB-CG1 3.73Å; P515-V518 HydrophobicContact CB-CG2 3.65Å; P515-V518 HydrophobicContact CG-CG2 3.63Å; V518-Y520 HydrophobicContact CB-CE2 4.5Å; V518-Y520 HydrophobicContact CG1-CE2 4.02Å
519	F	91	Very high	86	Confident	3 Å²	3	58 Å²	58	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	157.8	174.5	-60.6	-38.9	0	0	0	111.1	A192 I193 W196 I198 F277 A479 Q480 F517	A192-F519 WeakPolarHBondContact CA-O 3.38Å; I193-F519 PolarHBondContact N-O 2.96Å; W196-F519 HydrophobicContact CB-CD2 4.27Å; W196-F519 AromaticContact CD1-CD2 3.31Å; W196-F519 AromaticContact CD1-CE2 3.4Å; W196-F519 VanDerWaalsContact CD1-CE2 3.4Å; W196-F519 HydrophobicContact CD2-CD2 4.36Å; W196-F519 AromaticContact CG-CD2 3.73Å; W196-F519 HydrophobicContact CG-CD2 3.73Å; W196-F519 HydrophobicContact CG-CE2 4.26Å; W196-F519 AromaticContact NE1-CD2 3.66Å; W196-F519 AromaticContact NE1-CE2 3.63Å; I198-F519 HydrophobicContact CD1-CE2 4.42Å; F277-F519 AromaticContact CD1-CE1 3.86Å; F277-F519 HydrophobicContact CD1-CE1 3.86Å; F277-F519 HydrophobicContact CD1-CZ 4.3Å; F277-F519 HydrophobicContact CD2-CE1 4.15Å; F277-F519 AromaticContact CD2-CZ 3.9Å; F277-F519 HydrophobicContact CD2-CZ 3.9Å; F277-F519 AromaticContact CE1-CE1 3.72Å; F277-F519 HydrophobicContact CE1-CE1 3.72Å; F277-F519 HydrophobicContact CE1-CZ 4.43Å; F277-F519 HydrophobicContact CE2-CE1 4.02Å; F277-F519 HydrophobicContact CE2-CZ 4.04Å; F277-F519 HydrophobicContact CG-CE1 4.06Å; F277-F519 HydrophobicContact CG-CZ 4.03Å; F277-F519 AromaticContact CZ-CE1 3.81Å; F277-F519 HydrophobicContact CZ-CE1 3.81Å; F277-F519 HydrophobicContact CZ-CZ 4.31Å; A479-F519 HydrophobicContact CB-CE2 4.46Å; A479-F519 HydrophobicContact CB-CZ 4.23Å; Q480-F519 HydrophobicContact CG-CB 4.14Å; Q480-F519 HydrophobicContact CG-CD1 3.56Å; Q480-F519 HydrophobicContact CG-CD2 4.25Å; Q480-F519 HydrophobicContact CG-CE1 3.96Å; Q480-F519 HydrophobicContact CG-CG 3.73Å; Q480-F519 HydrophobicContact CG-CZ 4.46Å; F517-F519 HydrophobicContact CD2-CD2 4.11Å; F517-F519 HydrophobicContact CD2-CE1 4.27Å; F517-F519 AromaticContact CD2-CE2 3.64Å; F517-F519 HydrophobicContact CD2-CE2 3.64Å; F517-F519 AromaticContact CD2-CZ 3.73Å; F517-F519 HydrophobicContact CD2-CZ 3.73Å; F517-F519 HydrophobicContact CE2-CD2 4.28Å; F517-F519 AromaticContact CE2-CE2 3.79Å; F517-F519 HydrophobicContact CE2-CE2 3.79Å; F517-F519 HydrophobicContact CE2-CZ 4.28Å; F517-F519 HydrophobicContact CG-CZ 4.48Å
520	Y	90.8	Very high	86	Confident	31 Å²	31	55.1 Å²	55.1	12%	0.122	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.5	-176.4	-68.9	-98.4	0	0	0	110.7	Q50 D52 R61 S190 K191 A192 V518	Q50-Y520 HydrophobicContact CB-CD2 4.17Å; Q50-Y520 HydrophobicContact CB-CG 4.24Å; Q50-Y520 VanDerWaalsContact CD-CG 3.43Å; Q50-Y520 HydrophobicContact CG-CD1 4.3Å; Q50-Y520 HydrophobicContact CG-CD2 3.58Å; Q50-Y520 HydrophobicContact CG-CE2 3.98Å; Q50-Y520 HydrophobicContact CG-CG 3.76Å; Q50-Y520 VanDerWaalsContact NE2-CD1 3.31Å; Q50-Y520 WeakPolarHBondContact O-CD2 3.35Å; D52-Y520 PolarHBondContact OD2-OH 3.42Å; R61-Y520 VanDerWaalsContact NH1-CZ 3.26Å; R61-Y520 PolarHBondContact NH1-OH 2.8Å; S190-Y520 WeakPolarHBondContact OG-CB 3.26Å; K191-Y520 WeakPolarHBondContact O-CA 3.48Å; A192-Y520 HydrophobicContact CB-CD1 4.21Å; A192-Y520 HydrophobicContact CB-CE1 3.85Å; V518-Y520 HydrophobicContact CB-CE2 4.5Å; V518-Y520 HydrophobicContact CG1-CE2 4.02Å
521	D	87.6	Confident	86.2	Confident	52 Å²	52	60.9 Å²	60.9	28%	0.278	28%	0.281	S	S	.	.	S	Bend	trans	-84.4	-170.3	176.7	74.7	-13.5	0	0	0	112.4	S190 K191 I193 L523	S190-D521 PolarHBondContact OG-O 3.37Å; K191-D521 PolarHBondContact N-OD1 3.5Å; K191-D521 PolarHBondContact O-N 2.85Å; I193-D521 HydrophobicContact CD1-CB 4.2Å; I193-D521 HydrophobicContact CG1-CB 4.39Å; D521-L523 PolarHBondContact O-N 2.92Å
522	Q	86.7	Confident	86.1	Confident	56 Å²	56	58.6 Å²	58.6	26%	0.262	27%	0.271	S	S	.	.			trans	61.6	41.1	176.9	-57.1	-62.1	-45.4	0	0	114.9	A63	A63-Q522 HydrophobicContact CB-CB 4.46Å
523	L	89.3	Confident	85.9	Confident	9 Å²	9	56.1 Å²	56.1	5%	0.047	26%	0.26	C	S	.	.			trans	-81.3	-21.9	177.7	-62	170.8	0	0	0	113.8	R47 P229 Q480 L481 D521	R47-L523 PolarHBondContact N-O 2.83Å; P229-L523 HydrophobicContact CB-CD1 4.27Å; P229-L523 HydrophobicContact CG-CD1 3.94Å; P229-L523 HydrophobicContact CG-CD2 3.98Å; P229-L523 HydrophobicContact CG-CG 4.4Å; Q480-L523 HydrophobicContact CB-CD1 3.85Å; L481-L523 HydrophobicContact CD2-CD1 4.02Å; D521-L523 PolarHBondContact O-N 2.92Å
524	K	91.6	Very high	85.5	Confident	94 Å²	94	47 Å²	47	41%	0.409	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	128	175	179.4	177.8	-176.9	172.9	0	108.7	Y46 W230	Y46-K524 HydrophobicContact CD1-CB 4.43Å; Y46-K524 HydrophobicContact CD1-CG 4.2Å; Y46-K524 HydrophobicContact CE1-CD 4.03Å; Y46-K524 HydrophobicContact CE1-CG 4.12Å; W230-K524 HydrophobicContact CD2-CB 4.18Å; W230-K524 HydrophobicContact CD2-CD 4.21Å; W230-K524 HydrophobicContact CE3-CD 4.29Å; W230-K524 HydrophobicContact CG-CB 4.22Å; W230-K524 HydrophobicContact CH2-CD 4.48Å; W230-K524 HydrophobicContact CZ2-CB 4.29Å; W230-K524 HydrophobicContact CZ2-CD 4.4Å; W230-K524 HydrophobicContact CZ3-CD 4.42Å
525	Q	90.6	Very high	85.2	Confident	10 Å²	10	44.5 Å²	44.5	5%	0.047	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	159.3	-178.7	-63.6	179.3	-28.3	0	0	110.1	V45 A63 Y141	V45-Q525 HydrophobicContact CG2-CB 4.04Å; V45-Q525 WeakPolarHBondContact CG2-O 3.29Å; V45-Q525 PolarHBondContact N-O 3.19Å; V45-Q525 PolarHBondContact O-N 2.78Å; A63-Q525 PolarHBondContact O-NE2 3.1Å; A63-Q525 VanDerWaalsContact O-NE2 3.17Å; A63-Q525 PolarHBondContact O-OE1 2.71Å; Y141-Q525 PolarHBondContact OH-OE1 3.25Å; Y141-Q525 VanDerWaalsContact OH-OE1 3.06Å
526	T	90.6	Very high	84.9	Confident	45 Å²	45	44.7 Å²	44.7	28%	0.276	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.7	165.9	61.1	0	0	0	0	109.4	E42 T44 S186	E42-T526 WeakPolarHBondContact OE1-CB 3.1Å; E42-T526 PolarHBondContact OE1-OG1 3.07Å; T44-T526 HydrophobicContact CG2-CG2 4.49Å; S186-T526 PolarHBondContact N-O 2.9Å; S186-T526 PolarHBondContact OG-OG1 2.58Å
527	M	90.8	Very high	84.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.2	176.1	-173.2	175.3	-70.4	0	0	108.9	F43 V45 L65 V106 Y141 M183 V184 T185	F43-M527 WeakPolarHBondContact CD1-O 3.4Å; F43-M527 HydrophobicContact CE1-CB 4.15Å; F43-M527 HydrophobicContact CE1-CG 4.12Å; F43-M527 HydrophobicContact CE1-SD 4.33Å; F43-M527 HydrophobicContact CE2-CB 4.14Å; F43-M527 HydrophobicContact CE2-CG 4.49Å; F43-M527 HydrophobicContact CE2-SD 4.13Å; F43-M527 HydrophobicContact CZ-CB 3.91Å; F43-M527 HydrophobicContact CZ-CG 3.85Å; F43-M527 HydrophobicContact CZ-SD 3.54Å; F43-M527 VanDerWaalsContact CZ-SD 3.54Å; F43-M527 PolarHBondContact N-O 3.35Å; F43-M527 PolarHBondContact O-N 3.4Å; V45-M527 HydrophobicContact CG1-CB 3.72Å; V45-M527 HydrophobicContact CG1-CE 4.06Å; V45-M527 HydrophobicContact CG1-SD 4.22Å; V45-M527 HydrophobicContact CG2-CB 3.95Å; V45-M527 HydrophobicContact CG2-CE 4.23Å; L65-M527 HydrophobicContact CD2-CE 3.54Å; L65-M527 HydrophobicContact CD2-SD 4.18Å; V106-M527 HydrophobicContact CG2-CE 3.99Å; V106-M527 HydrophobicContact CG2-SD 4.13Å; Y141-M527 HydrophobicContact CD2-CE 3.77Å; Y141-M527 HydrophobicContact CE2-CE 4.07Å; Y141-M527 HydrophobicContact CG-CE 4.16Å; M183-M527 HydrophobicContact CB-CG 4.33Å; M183-M527 HydrophobicContact CB-SD 3.88Å; M183-M527 HydrophobicContact CG-SD 4.15Å; M183-M527 HydrophobicContact SD-CG 4.4Å; M183-M527 HydrophobicContact SD-SD 4.13Å; V184-M527 WeakPolarHBondContact O-CA 3.5Å; T185-M527 HydrophobicContact CG2-CE 3.8Å
528	N	90.9	Very high	84.1	Confident	19 Å²	19	48.7 Å²	48.7	10%	0.102	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.6	178.5	-63.1	-17.4	0	0	0	109.1	A39 E42 V184 Y530	A39-N528 HydrophobicContact CB-CB 4.47Å; E42-N528 WeakPolarHBondContact CG-OD1 3.22Å; V184-N528 PolarHBondContact N-O 2.95Å; V184-N528 PolarHBondContact O-N 3.43Å; N528-Y530 HydrophobicContact CB-CD2 4.3Å; N528-Y530 HydrophobicContact CB-CE2 3.55Å; N528-Y530 PolarHBondContact ND2-OH 3.16Å
529	A	88.9	Confident	83.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	111.4	172.1	0	0	0	0	0	109.3	A40 H41 I152 M183	A40-A529 WeakPolarHBondContact CB-O 3.16Å; A40-A529 PolarHBondContact N-O 2.82Å; H41-A529 HydrophobicContact CB-CB 4.38Å; H41-A529 PolarHBondContact N-O 3.41Å; H41-A529 PolarHBondContact O-N 3.02Å; I152-A529 HydrophobicContact CD1-CB 3.83Å; M183-A529 HydrophobicContact CE-CB 3.91Å; M183-A529 HydrophobicContact SD-CB 3.56Å; M183-A529 VanDerWaalsContact SD-CB 3.56Å
530	Y	85.6	Confident	83.2	Confident	65 Å²	65	56.5 Å²	56.5	26%	0.255	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136.4	174.1	-63.6	-78.7	0	0	0	110.4	A39 F181 Q182 V184 N528 V532	A39-Y530 HydrophobicContact CB-CD1 4.24Å; A39-Y530 HydrophobicContact CB-CE1 3.72Å; F181-Y530 CarbonylContact C-O 3.46Å; F181-Y530 WeakPolarHBondContact CA-O 3.46Å; Q182-Y530 PolarHBondContact N-O 3.33Å; Q182-Y530 PolarHBondContact O-N 3.41Å; V184-Y530 HydrophobicContact CB-CD2 4.31Å; V184-Y530 HydrophobicContact CB-CE2 4.01Å; V184-Y530 HydrophobicContact CG2-CD2 3.86Å; V184-Y530 HydrophobicContact CG2-CE2 3.98Å; N528-Y530 HydrophobicContact CB-CD2 4.3Å; N528-Y530 HydrophobicContact CB-CE2 3.55Å; N528-Y530 PolarHBondContact ND2-OH 3.16Å; Y530-V532 PolarHBondContact O-N 3.06Å
531	R	82.1	Confident	82.7	Confident	140 Å²	140	57.7 Å²	57.7	53%	0.528	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	114.4	170.6	-170.5	176.3	177	172.5	1.6	108.6	A40 N179	A40-R531 HydrophobicContact CB-CB 4.46Å; N179-R531 HydrophobicContact CB-CG 4.04Å; N179-R531 PolarHBondContact ND2-NH2 3.14Å; N179-R531 PolarHBondContact OD1-NE 2.72Å; N179-R531 VanDerWaalsContact OD1-NE 3.14Å; N179-R531 PolarHBondContact OD1-NH2 2.78Å
532	V	76.6	Confident	82.5	Confident	50 Å²	50	57.8 Å²	57.8	30%	0.303	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	139.8	-173.7	-176	0	0	0	0	110	G180 Q182 Y530	G180-V532 WeakPolarHBondContact CA-O 3.25Å; G180-V532 PolarHBondContact N-O 3.35Å; G180-V532 PolarHBondContact O-N 3Å; G180-V532 VanDerWaalsContact O-O 3.13Å; Q182-V532 HydrophobicContact CB-CB 4.42Å; Q182-V532 HydrophobicContact CB-CG2 3.7Å; Y530-V532 PolarHBondContact O-N 3.06Å
533	K	74.6	Confident	82.5	Confident	97 Å²	97	60.5 Å²	60.5	42%	0.422	32%	0.318	S	S	.	.			trans	-83.4	134.8	173.5	-70	-63	-170.9	-177.7	0	109.9	N179 F537	N179-K533 PolarHBondContact OD1-NZ 2.91Å; K533-F537 HydrophobicContact CB-CB 4.45Å; K533-F537 HydrophobicContact CB-CD1 4.45Å; K533-F537 HydrophobicContact CB-CG 4.49Å
534	P	70.7	Confident	82.2	Confident	27 Å²	27	63.6 Å²	63.6	18%	0.175	34%	0.339	C	S	.	.			trans	-64.2	150	-179.5	-29.2	41.5	0	0	0	112.7	T175 A178 I536 F537	T175-P534 HydrophobicContact CG2-CB 4.49Å; T175-P534 VanDerWaalsContact O-CG 3.28Å; T175-P534 WeakPolarHBondContact O-CG 3.07Å; A178-P534 WeakPolarHBondContact O-CD 3.12Å; P534-I536 PolarHBondContact O-N 3.34Å; P534-F537 WeakPolarHBondContact O-CB 3.49Å; P534-F537 PolarHBondContact O-N 3.07Å
535	A	70.3	Confident	81.9	Confident	82 Å²	82	62.4 Å²	62.4	68%	0.678	34%	0.337	S	S	*	.	H	α-helix	trans	-57.6	-22.4	-179.6	0	0	0	0	0	114.2	F537 D538 L539	A535-F537 PolarHBondContact O-N 3.49Å; A535-D538 PolarHBondContact O-N 2.92Å; A535-L539 PolarHBondContact O-N 3.49Å
536	I	72.6	Confident	81.8	Confident	57 Å²	57	64.9 Å²	64.9	29%	0.292	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-28.5	174.7	-60.2	166.9	0	0	0	111.1	L172 T175 A176 P534 D538 L539 L540	L172-I536 HydrophobicContact CD2-CD1 4.19Å; T175-I536 HydrophobicContact CG2-CD1 3.89Å; A176-I536 HydrophobicContact CB-CG2 4.16Å; P534-I536 PolarHBondContact O-N 3.34Å; I536-D538 VanDerWaalsContact C-N 3.3Å; I536-D538 PolarHBondContact O-N 3.38Å; I536-L539 WeakPolarHBondContact O-CB 3.28Å; I536-L539 PolarHBondContact O-N 3.5Å; I536-L540 HydrophobicContact CG2-CD1 4.39Å; I536-L540 PolarHBondContact O-N 3.32Å
537	F	75.8	Confident	81.6	Confident	58 Å²	58	65.2 Å²	65.2	25%	0.254	37%	0.366	S	S	.	.	H	α-helix	trans	-59.5	-43	174.1	-177.8	-99.3	0	0	0	111.1	K533 P534 A535 L539 L540 L541	K533-F537 HydrophobicContact CB-CB 4.45Å; K533-F537 HydrophobicContact CB-CD1 4.45Å; K533-F537 HydrophobicContact CB-CG 4.49Å; P534-F537 WeakPolarHBondContact O-CB 3.49Å; P534-F537 PolarHBondContact O-N 3.07Å; A535-F537 PolarHBondContact O-N 3.49Å; F537-L539 VanDerWaalsContact C-N 3.29Å; F537-L539 PolarHBondContact O-N 3.4Å; F537-L540 PolarHBondContact O-N 3.49Å; F537-L541 WeakPolarHBondContact O-CB 3.47Å; F537-L541 PolarHBondContact O-N 2.93Å
538	D	79.5	Confident	81.3	Confident	103 Å²	103	67.4 Å²	67.4	55%	0.551	38%	0.375	S	S	*	.	H	α-helix	trans	-65.1	-34.6	177.7	-64.1	-19.2	0	0	0	111.8	A535 I536 L541 A542	A535-D538 PolarHBondContact O-N 2.92Å; I536-D538 VanDerWaalsContact C-N 3.3Å; I536-D538 PolarHBondContact O-N 3.38Å; D538-L541 PolarHBondContact O-N 2.85Å; D538-A542 VanDerWaalsContact O-CB 3.32Å; D538-A542 WeakPolarHBondContact O-CB 3.35Å; D538-A542 PolarHBondContact O-N 2.88Å
539	L	81.8	Confident	81	Confident	124 Å²	124	71.4 Å²	71.4	65%	0.649	40%	0.395	S	S	*	.	H	α-helix	trans	-67.2	-43.3	174.7	-176.5	68.8	0	0	0	111.8	A535 I536 F537 L541 A542 L543	A535-L539 PolarHBondContact O-N 3.49Å; I536-L539 WeakPolarHBondContact O-CB 3.28Å; I536-L539 PolarHBondContact O-N 3.5Å; F537-L539 VanDerWaalsContact C-N 3.29Å; F537-L539 PolarHBondContact O-N 3.4Å; L539-L541 VanDerWaalsContact C-N 3.35Å; L539-A542 PolarHBondContact O-N 2.94Å; L539-L543 WeakPolarHBondContact O-CB 3.32Å; L539-L543 PolarHBondContact O-N 2.97Å
540	L	80.3	Confident	80.9	Confident	67 Å²	67	72.9 Å²	72.9	35%	0.351	41%	0.411	S	S	.	.	H	α-helix	trans	-65.1	-41.3	174.7	-83	163	0	0	0	111.3	A176 I536 F537 A542 L543 C544	A176-L540 HydrophobicContact CB-CD1 3.19Å; I536-L540 HydrophobicContact CG2-CD1 4.39Å; I536-L540 PolarHBondContact O-N 3.32Å; F537-L540 PolarHBondContact O-N 3.49Å; L540-A542 VanDerWaalsContact C-N 3.33Å; L540-A542 PolarHBondContact O-N 3.27Å; L540-L543 PolarHBondContact O-N 3.41Å; L540-C544 WeakPolarHBondContact O-CB 3.38Å; L540-C544 PolarHBondContact O-N 2.87Å; L540-C544 PolarHBondContact O-SG 3.41Å
541	L	80.5	Confident	80.7	Confident	56 Å²	56	76.6 Å²	76.6	29%	0.293	43%	0.432	S	S	.	.	H	α-helix	trans	-59.2	-46.3	174.2	-169.2	75	0	0	0	110.4	L29 F537 D538 L539 L543 C544 I545	L29-L541 HydrophobicContact CD2-CD1 3.73Å; F537-L541 WeakPolarHBondContact O-CB 3.47Å; F537-L541 PolarHBondContact O-N 2.93Å; D538-L541 PolarHBondContact O-N 2.85Å; L539-L541 VanDerWaalsContact C-N 3.35Å; L541-L543 VanDerWaalsContact C-N 3.33Å; L541-L543 PolarHBondContact O-N 2.93Å; L541-C544 PolarHBondContact O-N 3.34Å; L541-I545 HydrophobicContact CD2-CD1 4.43Å; L541-I545 HydrophobicContact CG-CD1 3.97Å; L541-I545 WeakPolarHBondContact O-CB 3.46Å; L541-I545 WeakPolarHBondContact O-CD1 3.01Å; L541-I545 WeakPolarHBondContact O-CG1 3.46Å; L541-I545 PolarHBondContact O-N 2.85Å
542	A	83.7	Confident	80.6	Confident	54 Å²	54	72.3 Å²	72.3	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-41.4	175.9	0	0	0	0	0	112.1	D538 L539 L540 I545 A546	D538-A542 VanDerWaalsContact O-CB 3.32Å; D538-A542 WeakPolarHBondContact O-CB 3.35Å; D538-A542 PolarHBondContact O-N 2.88Å; L539-A542 PolarHBondContact O-N 2.94Å; L540-A542 VanDerWaalsContact C-N 3.33Å; L540-A542 PolarHBondContact O-N 3.27Å; A542-I545 PolarHBondContact O-N 3.38Å; A542-A546 WeakPolarHBondContact O-CB 3.25Å; A542-A546 PolarHBondContact O-N 3.18Å
543	L	86	Confident	80.9	Confident	114 Å²	114	76.7 Å²	76.7	60%	0.597	43%	0.431	S	S	*	.	H	α-helix	trans	-65.9	-42.2	176.3	-169.2	149.8	0	0	0	111.6	L539 L540 L541 A546 A547	L539-L543 WeakPolarHBondContact O-CB 3.32Å; L539-L543 PolarHBondContact O-N 2.97Å; L540-L543 PolarHBondContact O-N 3.41Å; L541-L543 VanDerWaalsContact C-N 3.33Å; L541-L543 PolarHBondContact O-N 2.93Å; L543-A546 PolarHBondContact O-N 3.08Å; L543-A547 VanDerWaalsContact O-CB 3.31Å; L543-A547 WeakPolarHBondContact O-CB 3.44Å; L543-A547 PolarHBondContact O-N 3.49Å
544	C	83.3	Confident	81.2	Confident	73 Å²	73	76.6 Å²	76.6	49%	0.493	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-43.1	174.3	-72.4	0	0	0	0	111.7	L540 L541 A547 Y548	L540-C544 WeakPolarHBondContact O-CB 3.38Å; L540-C544 PolarHBondContact O-N 2.87Å; L540-C544 PolarHBondContact O-SG 3.41Å; L541-C544 PolarHBondContact O-N 3.34Å; C544-A547 PolarHBondContact O-N 3.45Å; C544-Y548 VanDerWaalsContact O-CB 3.25Å; C544-Y548 WeakPolarHBondContact O-CB 3.32Å; C544-Y548 PolarHBondContact O-N 3.29Å
545	I	85.3	Confident	81.5	Confident	70 Å²	70	77.4 Å²	77.4	36%	0.359	44%	0.444	S	S	.	.	H	α-helix	trans	-63.2	-45	175.7	-68.3	163.6	0	0	0	110.2	L541 A542 Y548 L549	L541-I545 HydrophobicContact CD2-CD1 4.43Å; L541-I545 HydrophobicContact CG-CD1 3.97Å; L541-I545 WeakPolarHBondContact O-CB 3.46Å; L541-I545 WeakPolarHBondContact O-CD1 3.01Å; L541-I545 WeakPolarHBondContact O-CG1 3.46Å; L541-I545 PolarHBondContact O-N 2.85Å; A542-I545 PolarHBondContact O-N 3.38Å; I545-Y548 PolarHBondContact O-N 2.92Å; I545-L549 HydrophobicContact CG2-CD1 3.97Å; I545-L549 HydrophobicContact CG2-CG 4.47Å; I545-L549 WeakPolarHBondContact O-CB 3.41Å; I545-L549 WeakPolarHBondContact O-CG 3.27Å; I545-L549 PolarHBondContact O-N 3.42Å
546	A	87.3	Confident	81.8	Confident	61 Å²	61	78.7 Å²	78.7	50%	0.504	44%	0.438	S	S	.	.	H	α-helix	trans	-63.8	-44.1	178.1	0	0	0	0	0	112.2	A542 L543 L549 G550	A542-A546 WeakPolarHBondContact O-CB 3.25Å; A542-A546 PolarHBondContact O-N 3.18Å; L543-A546 PolarHBondContact O-N 3.08Å; A546-L549 PolarHBondContact O-N 3.5Å; A546-G550 PolarHBondContact O-N 2.98Å
547	A	86.8	Confident	82.1	Confident	53 Å²	53	81.3 Å²	81.3	44%	0.438	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-41.8	176.3	0	0	0	0	0	111.6	L543 C544 G550 M551	L543-A547 VanDerWaalsContact O-CB 3.31Å; L543-A547 WeakPolarHBondContact O-CB 3.44Å; L543-A547 PolarHBondContact O-N 3.49Å; C544-A547 PolarHBondContact O-N 3.45Å; A547-G550 PolarHBondContact O-N 3.27Å; A547-M551 WeakPolarHBondContact O-CB 3.46Å; A547-M551 VanDerWaalsContact O-CG 3.32Å; A547-M551 WeakPolarHBondContact O-CG 3.46Å; A547-M551 PolarHBondContact O-N 3.03Å
548	Y	84.2	Confident	82.1	Confident	45 Å²	45	81.9 Å²	81.9	18%	0.176	46%	0.455	C	S	.	.	H	α-helix	trans	-61.1	-50.4	175.4	170.8	-103.3	0	0	0	111.8	F21 I22 I25 C544 I545 G550 M551 M552	F21-Y548 PolarHBondContact O-OH 3.47Å; I22-Y548 WeakPolarHBondContact CA-OH 3.32Å; I25-Y548 HydrophobicContact CB-CE2 4.19Å; I25-Y548 HydrophobicContact CD1-CD2 3.99Å; I25-Y548 HydrophobicContact CD1-CE2 3.6Å; I25-Y548 HydrophobicContact CG1-CE2 4.47Å; I25-Y548 HydrophobicContact CG2-CD2 4.23Å; I25-Y548 HydrophobicContact CG2-CE2 4.15Å; C544-Y548 VanDerWaalsContact O-CB 3.25Å; C544-Y548 WeakPolarHBondContact O-CB 3.32Å; C544-Y548 PolarHBondContact O-N 3.29Å; I545-Y548 PolarHBondContact O-N 2.92Å; Y548-G550 VanDerWaalsContact C-N 3.3Å; Y548-G550 PolarHBondContact O-N 3.44Å; Y548-M551 PolarHBondContact O-N 2.91Å; Y548-M552 HydrophobicContact CE1-CG 4.4Å; Y548-M552 HydrophobicContact CE1-SD 4.24Å; Y548-M552 HydrophobicContact CE2-CG 4.19Å; Y548-M552 WeakPolarHBondContact O-CB 3.24Å; Y548-M552 PolarHBondContact O-N 2.84Å
549	L	84.5	Confident	81.7	Confident	103 Å²	103	82.4 Å²	82.4	54%	0.539	45%	0.452	S	S	.	.	H	α-helix	trans	-61.4	-40.1	177.1	-71.7	172	0	0	0	111.6	I545 A546 M552 Y553	I545-L549 HydrophobicContact CG2-CD1 3.97Å; I545-L549 HydrophobicContact CG2-CG 4.47Å; I545-L549 WeakPolarHBondContact O-CB 3.41Å; I545-L549 WeakPolarHBondContact O-CG 3.27Å; I545-L549 PolarHBondContact O-N 3.42Å; A546-L549 PolarHBondContact O-N 3.5Å; L549-M552 PolarHBondContact O-N 2.92Å; L549-Y553 WeakPolarHBondContact O-CB 3.36Å; L549-Y553 PolarHBondContact O-N 3.42Å
550	G	86.8	Confident	81.1	Confident	32 Å²	32	79.1 Å²	79.1	33%	0.33	45%	0.449	S	S	.	.	H	α-helix	trans	-62.3	-46.8	175.1	0	0	0	0	0	112.8	A546 A547 Y548 Y553 L554	A546-G550 PolarHBondContact O-N 2.98Å; A547-G550 PolarHBondContact O-N 3.27Å; Y548-G550 VanDerWaalsContact C-N 3.3Å; Y548-G550 PolarHBondContact O-N 3.44Å; G550-Y553 PolarHBondContact O-N 2.95Å; G550-L554 WeakPolarHBondContact O-CG 3.26Å; G550-L554 PolarHBondContact O-N 3.45Å
551	M	82.2	Confident	80.3	Confident	142 Å²	142	81.2 Å²	81.2	70%	0.7	46%	0.46	S	S	*	.	H	α-helix	trans	-63.4	-41.8	175.6	-73	-129.5	-64.6	0	0	111.9	A547 Y548 L554 A555	A547-M551 WeakPolarHBondContact O-CB 3.46Å; A547-M551 VanDerWaalsContact O-CG 3.32Å; A547-M551 WeakPolarHBondContact O-CG 3.46Å; A547-M551 PolarHBondContact O-N 3.03Å; Y548-M551 PolarHBondContact O-N 2.91Å; M551-L554 PolarHBondContact O-N 3.49Å; M551-A555 VanDerWaalsContact O-CB 3.27Å; M551-A555 WeakPolarHBondContact O-CB 3.47Å; M551-A555 PolarHBondContact O-N 2.99Å
552	M	79.2	Confident	79.5	Confident	51 Å²	51	83.2 Å²	83.2	25%	0.251	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-45.3	174.9	-99.4	-143.2	69.3	0	0	112	I22 Y548 L549 L554 A555 I556	I22-M552 HydrophobicContact CD1-CE 3.75Å; I22-M552 HydrophobicContact CD1-SD 4.44Å; I22-M552 HydrophobicContact CG1-CE 3.66Å; I22-M552 HydrophobicContact CG1-SD 3.69Å; Y548-M552 HydrophobicContact CE1-CG 4.4Å; Y548-M552 HydrophobicContact CE1-SD 4.24Å; Y548-M552 HydrophobicContact CE2-CG 4.19Å; Y548-M552 WeakPolarHBondContact O-CB 3.24Å; Y548-M552 PolarHBondContact O-N 2.84Å; L549-M552 PolarHBondContact O-N 2.92Å; M552-L554 PolarHBondContact O-N 3.15Å; M552-A555 PolarHBondContact O-N 3.42Å; M552-I556 HydrophobicContact CE-CD1 3.78Å; M552-I556 HydrophobicContact CE-CG1 4.43Å; M552-I556 VanDerWaalsContact O-CG1 3.32Å; M552-I556 WeakPolarHBondContact O-CG1 3.39Å; M552-I556 PolarHBondContact O-N 2.83Å
553	Y	83.1	Confident	78.7	Confident	142 Å²	142	88 Å²	88	56%	0.557	48%	0.478	S	S	*	.	H	α-helix	trans	-61.2	-45.5	177.5	-178.6	-103.2	0	0	0	111.7	L549 G550 A555 I556 Q557	L549-Y553 WeakPolarHBondContact O-CB 3.36Å; L549-Y553 PolarHBondContact O-N 3.42Å; G550-Y553 PolarHBondContact O-N 2.95Å; Y553-A555 PolarHBondContact O-N 3.02Å; Y553-I556 PolarHBondContact O-N 3.21Å; Y553-Q557 HydrophobicContact CD1-CG 4.44Å; Y553-Q557 HydrophobicContact CE1-CG 4.12Å; Y553-Q557 VanDerWaalsContact CE1-NE2 3.25Å; Y553-Q557 WeakPolarHBondContact O-CG 3.33Å; Y553-Q557 PolarHBondContact O-N 3.38Å; Y553-Q557 PolarHBondContact OH-NE2 2.89Å
554	L	81.9	Confident	77.7	Confident	94 Å²	94	85.2 Å²	85.2	49%	0.492	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-37.7	175.7	-72.5	172.5	0	0	0	112.4	G550 M551 M552 Q557 N558	G550-L554 WeakPolarHBondContact O-CG 3.26Å; G550-L554 PolarHBondContact O-N 3.45Å; M551-L554 PolarHBondContact O-N 3.49Å; M552-L554 PolarHBondContact O-N 3.15Å; L554-Q557 PolarHBondContact O-N 3.08Å; L554-N558 VanDerWaalsContact O-CB 3.26Å; L554-N558 WeakPolarHBondContact O-CB 3.38Å; L554-N558 PolarHBondContact O-N 3.16Å; L554-N558 PolarHBondContact O-ND2 3Å
555	A	75.9	Confident	76.9	Confident	45 Å²	45	85.4 Å²	85.4	37%	0.372	47%	0.467	S	S	.	.	H	α-helix	trans	-65.9	-38.8	176.3	0	0	0	0	0	111.8	M551 M552 Y553 N558 F559	M551-A555 VanDerWaalsContact O-CB 3.27Å; M551-A555 WeakPolarHBondContact O-CB 3.47Å; M551-A555 PolarHBondContact O-N 2.99Å; M552-A555 PolarHBondContact O-N 3.42Å; Y553-A555 PolarHBondContact O-N 3.02Å; A555-N558 CarbonylContact O-C 3.6Å; A555-F559 WeakPolarHBondContact O-CA 3.23Å; A555-F559 WeakPolarHBondContact O-CB 3.43Å; A555-F559 PolarHBondContact O-N 2.89Å
556	I	78.1	Confident	76	Confident	108 Å²	108	85.6 Å²	85.6	55%	0.554	47%	0.471	S	S	*	.	H	α-helix	trans	-68.2	-46.4	175.1	-68.2	166.3	0	0	0	110.8	M552 Y553 N558 F559	M552-I556 HydrophobicContact CE-CD1 3.78Å; M552-I556 HydrophobicContact CE-CG1 4.43Å; M552-I556 VanDerWaalsContact O-CG1 3.32Å; M552-I556 WeakPolarHBondContact O-CG1 3.39Å; M552-I556 PolarHBondContact O-N 2.83Å; Y553-I556 PolarHBondContact O-N 3.21Å; I556-N558 VanDerWaalsContact C-N 3.33Å; I556-N558 PolarHBondContact O-N 3.07Å; I556-F559 VanDerWaalsContact O-CB 3.25Å; I556-F559 WeakPolarHBondContact O-CB 3.45Å; I556-F559 PolarHBondContact O-N 3.28Å
557	Q	79	Confident	74.9	Confident	112 Å²	112	90 Å²	90	52%	0.523	48%	0.475	S	S	.	.	H	α-helix	trans	-63	-40.6	178.4	-75.8	-166.6	-27.2	0	0	112.4	Y553 L554 F559	Y553-Q557 HydrophobicContact CD1-CG 4.44Å; Y553-Q557 HydrophobicContact CE1-CG 4.12Å; Y553-Q557 VanDerWaalsContact CE1-NE2 3.25Å; Y553-Q557 WeakPolarHBondContact O-CG 3.33Å; Y553-Q557 PolarHBondContact O-N 3.38Å; Y553-Q557 PolarHBondContact OH-NE2 2.89Å; L554-Q557 PolarHBondContact O-N 3.08Å; Q557-F559 VanDerWaalsContact C-N 3.29Å; Q557-F559 PolarHBondContact O-N 3.5Å
558	N	75.7	Confident	73.8	Confident	70 Å²	70	97.5 Å²	97.5	37%	0.374	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	13.5	-179.7	-63	-57	0	0	0	113.1	L554 A555 I556 G560 L561 L562	L554-N558 VanDerWaalsContact O-CB 3.26Å; L554-N558 WeakPolarHBondContact O-CB 3.38Å; L554-N558 PolarHBondContact O-N 3.16Å; L554-N558 PolarHBondContact O-ND2 3Å; A555-N558 CarbonylContact O-C 3.6Å; I556-N558 VanDerWaalsContact C-N 3.33Å; I556-N558 PolarHBondContact O-N 3.07Å; N558-G560 PolarHBondContact O-N 3.42Å; N558-L561 WeakPolarHBondContact O-CB 3.49Å; N558-L561 PolarHBondContact O-N 3.48Å; N558-L562 PolarHBondContact O-N 3.45Å
559	F	70.3	Confident	73	Confident	114 Å²	114	101.8 Å²	101.8	50%	0.5	52%	0.516	S	S	.	.	H	α-helix	trans	-61.5	-31.2	-177.7	-155.3	-95	0	0	0	112	A555 I556 Q557 L562 Y563	A555-F559 WeakPolarHBondContact O-CA 3.23Å; A555-F559 WeakPolarHBondContact O-CB 3.43Å; A555-F559 PolarHBondContact O-N 2.89Å; I556-F559 VanDerWaalsContact O-CB 3.25Å; I556-F559 WeakPolarHBondContact O-CB 3.45Å; I556-F559 PolarHBondContact O-N 3.28Å; Q557-F559 VanDerWaalsContact C-N 3.29Å; Q557-F559 PolarHBondContact O-N 3.5Å; F559-L562 PolarHBondContact O-N 3.34Å; F559-Y563 VanDerWaalsContact O-CB 3.23Å; F559-Y563 WeakPolarHBondContact O-CB 3.3Å; F559-Y563 PolarHBondContact O-N 3.17Å
560	G	68.4	Low	71.9	Confident	56 Å²	56	101.7 Å²	101.7	58%	0.577	52%	0.52	S	S	*	.	H	α-helix	trans	-65.7	-38.8	173.1	0	0	0	0	0	113.7	N558 S564	N558-G560 PolarHBondContact O-N 3.42Å; G560-S564 WeakPolarHBondContact O-CB 3.28Å; G560-S564 PolarHBondContact O-N 3.45Å; G560-S564 PolarHBondContact O-OG 2.88Å
561	L	64.9	Low	70.5	Confident	111 Å²	111	106.2 Å²	106.2	58%	0.581	53%	0.533	S	S	*	.	H	α-helix	trans	-66.9	-45.5	173	-90.9	153.7	0	0	0	110.6	N558 Y563 S564 V565	N558-L561 WeakPolarHBondContact O-CB 3.49Å; N558-L561 PolarHBondContact O-N 3.48Å; L561-Y563 PolarHBondContact O-N 3.44Å; L561-S564 PolarHBondContact O-N 2.93Å; L561-S564 PolarHBondContact O-OG 2.73Å; L561-V565 WeakPolarHBondContact O-CG2 3.45Å; L561-V565 PolarHBondContact O-N 3.18Å
562	L	62.6	Low	69.1	Low	98 Å²	98	105 Å²	105	51%	0.513	54%	0.535	S	S	.	.	H	α-helix	trans	-62.6	-41.9	178.3	-142.7	137.7	0	0	0	111.5	N558 F559 V565 V566	N558-L562 PolarHBondContact O-N 3.45Å; F559-L562 PolarHBondContact O-N 3.34Å; L562-V565 PolarHBondContact O-N 3Å; L562-V566 HydrophobicContact CD2-CG2 4.42Å; L562-V566 WeakPolarHBondContact O-CB 3.35Å; L562-V566 VanDerWaalsContact O-CG2 3.28Å; L562-V566 WeakPolarHBondContact O-CG2 3.48Å; L562-V566 PolarHBondContact O-N 2.65Å
563	Y	66.1	Low	68	Low	154 Å²	154	112.6 Å²	112.6	60%	0.604	57%	0.567	S	S	*	*	H	α-helix	trans	-62.7	-42.1	173.4	-171.8	-97.9	0	0	0	112.2	F559 L561 V566 R567	F559-Y563 VanDerWaalsContact O-CB 3.23Å; F559-Y563 WeakPolarHBondContact O-CB 3.3Å; F559-Y563 PolarHBondContact O-N 3.17Å; L561-Y563 PolarHBondContact O-N 3.44Å; Y563-V566 PolarHBondContact O-N 2.99Å; Y563-R567 VanDerWaalsContact O-CB 3.25Å; Y563-R567 WeakPolarHBondContact O-CB 3.25Å; Y563-R567 PolarHBondContact O-N 3.36Å
564	S	65.1	Low	66	Low	56 Å²	56	110.2 Å²	110.2	39%	0.392	58%	0.577	S	S	.	*	H	α-helix	trans	-67	-35.6	176.7	72.4	0	0	0	0	113.6	G560 L561 R568	G560-S564 WeakPolarHBondContact O-CB 3.28Å; G560-S564 PolarHBondContact O-N 3.45Å; G560-S564 PolarHBondContact O-OG 2.88Å; L561-S564 PolarHBondContact O-N 2.93Å; L561-S564 PolarHBondContact O-OG 2.73Å; S564-R568 PolarHBondContact O-N 3.44Å
565	V	67	Low	64.3	Low	76 Å²	76	115.4 Å²	115.4	46%	0.461	60%	0.595	S	S	.	*	H	α-helix	trans	-69	-45.4	175.1	170.3	0	0	0	0	110.7	L561 L562 R567 R568 I569	L561-V565 WeakPolarHBondContact O-CG2 3.45Å; L561-V565 PolarHBondContact O-N 3.18Å; L562-V565 PolarHBondContact O-N 3Å; V565-R567 VanDerWaalsContact C-N 3.33Å; V565-R567 PolarHBondContact O-N 2.99Å; V565-R568 WeakPolarHBondContact O-CB 3.4Å; V565-R568 PolarHBondContact O-N 3.18Å; V565-R568 VanDerWaalsContact O-N 3.15Å; V565-I569 HydrophobicContact CG1-CD1 3.91Å; V565-I569 WeakPolarHBondContact O-CG1 3.49Å; V565-I569 PolarHBondContact O-N 2.94Å
566	V	67.4	Low	62.7	Low	74 Å²	74	120.1 Å²	120.1	45%	0.448	62%	0.619	S	S	.	*	H	α-helix	trans	-62	-41.4	175.4	171.3	0	0	0	0	110.9	L562 Y563 R568 I569 T570	L562-V566 HydrophobicContact CD2-CG2 4.42Å; L562-V566 WeakPolarHBondContact O-CB 3.35Å; L562-V566 VanDerWaalsContact O-CG2 3.28Å; L562-V566 WeakPolarHBondContact O-CG2 3.48Å; L562-V566 PolarHBondContact O-N 2.65Å; Y563-V566 PolarHBondContact O-N 2.99Å; V566-R568 VanDerWaalsContact C-N 3.31Å; V566-R568 PolarHBondContact O-N 2.93Å; V566-I569 PolarHBondContact O-N 3.42Å; V566-T570 PolarHBondContact O-N 3.15Å; V566-T570 PolarHBondContact O-OG1 3.03Å
567	R	62.7	Low	60.9	Low	155 Å²	155	126.8 Å²	126.8	59%	0.585	65%	0.647	S	S	*	*	H	α-helix	trans	-64	-33.5	175.1	-166.4	176.6	-177.7	-170.4	1	112.6	Y563 V565 T570 Q571	Y563-R567 VanDerWaalsContact O-CB 3.25Å; Y563-R567 WeakPolarHBondContact O-CB 3.25Å; Y563-R567 PolarHBondContact O-N 3.36Å; V565-R567 VanDerWaalsContact C-N 3.33Å; V565-R567 PolarHBondContact O-N 2.99Å; R567-T570 WeakPolarHBondContact CA-OG1 3.37Å; R567-Q571 WeakPolarHBondContact O-CG 3.34Å; R567-Q571 PolarHBondContact O-N 3.2Å
568	R	65.6	Low	60	Low	209 Å²	209	127.6 Å²	127.6	79%	0.789	65%	0.654	S	S	*	*	H	α-helix	trans	-68.5	-35.8	173	-109.7	-178.9	-177.9	174.1	1.6	112.8	S564 V565 V566	S564-R568 PolarHBondContact O-N 3.44Å; V565-R568 WeakPolarHBondContact O-CB 3.4Å; V565-R568 PolarHBondContact O-N 3.18Å; V565-R568 VanDerWaalsContact O-N 3.15Å; V566-R568 VanDerWaalsContact C-N 3.31Å; V566-R568 PolarHBondContact O-N 2.93Å
569	I	66.6	Low	59.2	Low	136 Å²	136	130.6 Å²	130.6	70%	0.697	67%	0.668	S	S	*	*	H	α-helix	trans	-78.4	-30.8	-179.8	-66.6	166.8	0	0	0	111.5	V565 V566	V565-I569 HydrophobicContact CG1-CD1 3.91Å; V565-I569 WeakPolarHBondContact O-CG1 3.49Å; V565-I569 PolarHBondContact O-N 2.94Å; V566-I569 PolarHBondContact O-N 3.42Å
570	T	62.3	Low	58.6	Low	101 Å²	101	131.5 Å²	131.5	62%	0.62	68%	0.678	S	S	*	*	H	α-helix	trans	-91.5	-4.3	179.8	42	0	0	0	0	114.6	V566 R567 P572	V566-T570 PolarHBondContact O-N 3.15Å; V566-T570 PolarHBondContact O-OG1 3.03Å; R567-T570 WeakPolarHBondContact CA-OG1 3.37Å; T570-P572 WeakPolarHBondContact O-CD 3.37Å
571	Q	56.6	Low	58	Low	127 Å²	127	135.9 Å²	135.9	59%	0.593	68%	0.683	S	S	*	*	S	Bend	trans	-68.2	120.7	172.3	-91.8	179.5	-1.5	0	0	110.3	R567 K573	R567-Q571 WeakPolarHBondContact O-CG 3.34Å; R567-Q571 PolarHBondContact O-N 3.2Å; Q571-K573 PolarHBondContact O-N 2.93Å
572	P	53.3	Low	57.6	Low	115 Å²	115	137.5 Å²	137.5	75%	0.747	69%	0.69	S	S	*	*			trans	-66.8	132.6	175.9	26.4	-30.6	0	0	0	109.1	T570 A574	T570-P572 WeakPolarHBondContact O-CD 3.37Å; P572-A574 PolarHBondContact O-N 3.41Å
573	K	54.2	Low	57.2	Low	211 Å²	211	140.1 Å²	140.1	92%	0.917	70%	0.702	S	S	*	*			trans	-54.4	108.5	169.4	-86.2	-177.9	175.7	177.5	0	108.3	Q571 K575	Q571-K573 PolarHBondContact O-N 2.93Å; K573-K575 PolarHBondContact O-N 3.23Å
574	A	42.3	Very low	56.6	Low	93 Å²	93	139.1 Å²	139.1	77%	0.769	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-61	122.9	174.4	0	0	0	0	0	109	P572 V576	P572-A574 PolarHBondContact O-N 3.41Å; A574-V576 PolarHBondContact O-N 3.25Å
575	K	45.3	Very low	55.9	Low	202 Å²	202	145.5 Å²	145.5	88%	0.878	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-61.3	117.4	168.2	-76.8	-179.5	176	179.3	0	107.7	K573	K573-K575 PolarHBondContact O-N 3.23Å
576	V	44	Very low	55	Low	144 Å²	144	151.3 Å²	151.3	87%	0.873	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-74.5	122.1	166.9	-178.3	0	0	0	0	106.4	A574	A574-V576 PolarHBondContact O-N 3.25Å
577	H	39.8	Very low	53.9	Low	249 Å²	249	158.4 Å²	158.4	100%	1.153	78%	0.784	S	S	*	*			trans	-75.1	0	174.6	-98	-63.7	0	0	0	111.7

Retrieved 577 of 577 residues in 522.4 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).