A0A3Q0KBZ4_SCHMA Loading...

Putative g-protein coupled receptor

AlphaFold DB , UniProt , Accession A0A3Q0KBZ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 548 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	48.4	Very low	46.8	Very low	89 Å²	89	64.3 Å²	64.3	44%	0.438	35%	0.348	S	S	.	.				0	-71.3	0	-108.9	-164.4	-42.3	0	0	112.4	S3 A4 L5 M45 L65	M1-S3 PolarHBondContact O-N 3.32Å; M1-A4 PolarHBondContact O-N 3.42Å; M1-L5 WeakPolarHBondContact O-CB 3.28Å; M1-L5 PolarHBondContact O-N 3.21Å; M1-M45 HydrophobicContact CE-CE 3.61Å; M1-M45 HydrophobicContact CE-CG 4.35Å; M1-M45 HydrophobicContact SD-CE 3.35Å; M1-M45 WeakPolarHBondContact SD-CE 3.43Å; M1-L65 HydrophobicContact CE-CD1 3.8Å; M1-L65 HydrophobicContact SD-CD1 3.76Å; M1-L65 HydrophobicContact SD-CD2 4.21Å; M1-L65 HydrophobicContact SD-CG 4.5Å
2	K	45.8	Very low	46.5	Very low	84 Å²	84	67.1 Å²	67.1	37%	0.365	36%	0.357	S	S	.	.	H	α-helix	trans	-54.1	-32.4	-178.8	-153.6	-174.1	169.6	-170.2	0	113.5	L6 F428 L430	K2-L6 WeakPolarHBondContact O-CB 3.41Å; K2-L6 PolarHBondContact O-N 3.33Å; K2-F428 HydrophobicContact CD-CD1 4.02Å; K2-F428 PolarHBondContact NZ-O 3.4Å; K2-L430 HydrophobicContact CB-CD1 4.1Å; K2-L430 HydrophobicContact CD-CD1 3.45Å; K2-L430 VanDerWaalsContact CD-CD1 3.45Å; K2-L430 HydrophobicContact CG-CD1 3.61Å
3	S	45.1	Very low	45.9	Very low	49 Å²	49	77.1 Å²	77.1	34%	0.343	40%	0.396	S	S	.	.	H	α-helix	trans	-62.2	-60	168.7	47.7	0	0	0	0	113.1	M1 L5 L6 E7	M1-S3 PolarHBondContact O-N 3.32Å; S3-L5 PolarHBondContact O-N 3.05Å; S3-L6 WeakPolarHBondContact O-CB 3.37Å; S3-L6 PolarHBondContact O-N 3.1Å; S3-E7 PolarHBondContact O-N 3.19Å
4	A	48.6	Very low	45.2	Very low	38 Å²	38	79.5 Å²	79.5	31%	0.314	42%	0.416	S	S	.	.	H	α-helix	trans	-58	-31.8	178.7	0	0	0	0	0	112.8	M1 E7 A8	M1-A4 PolarHBondContact O-N 3.42Å; A4-E7 WeakPolarHBondContact O-CB 3.27Å; A4-E7 PolarHBondContact O-N 3.15Å; A4-A8 WeakPolarHBondContact O-CB 3.14Å; A4-A8 PolarHBondContact O-N 3.01Å
5	L	48	Very low	44.4	Very low	4 Å²	4	82.1 Å²	82.1	2%	0.021	43%	0.43	C	S	.	.	H	α-helix	trans	-77.7	-32.7	-179.7	-153.7	155.2	0	0	0	110.9	M1 S3 Q9 V33 M45 Y48	M1-L5 WeakPolarHBondContact O-CB 3.28Å; M1-L5 PolarHBondContact O-N 3.21Å; S3-L5 PolarHBondContact O-N 3.05Å; L5-Q9 WeakPolarHBondContact O-CB 3.38Å; L5-Q9 VanDerWaalsContact O-CG 3.32Å; L5-Q9 WeakPolarHBondContact O-CG 3.14Å; L5-Q9 PolarHBondContact O-N 2.88Å; L5-V33 HydrophobicContact CD2-CG2 4.03Å; L5-M45 HydrophobicContact CD1-CE 4.19Å; L5-Y48 HydrophobicContact CD1-CD1 3.74Å; L5-Y48 HydrophobicContact CD1-CE1 3.59Å; L5-Y48 HydrophobicContact CD2-CD1 4.29Å; L5-Y48 HydrophobicContact CD2-CE1 3.29Å; L5-Y48 HydrophobicContact CG-CD1 4.34Å; L5-Y48 HydrophobicContact CG-CE1 3.72Å
6	L	50.5	Low	43.6	Very low	61 Å²	61	84.4 Å²	84.4	32%	0.319	46%	0.455	S	S	.	.	H	α-helix	trans	-68.6	-40.9	166.5	-168.9	74.7	0	0	0	111.2	K2 S3 A8 Q9 I10 L430	K2-L6 WeakPolarHBondContact O-CB 3.41Å; K2-L6 PolarHBondContact O-N 3.33Å; S3-L6 WeakPolarHBondContact O-CB 3.37Å; S3-L6 PolarHBondContact O-N 3.1Å; L6-A8 VanDerWaalsContact C-N 3.33Å; L6-A8 PolarHBondContact O-N 3.31Å; L6-Q9 PolarHBondContact O-N 3.41Å; L6-I10 HydrophobicContact CD2-CD1 4.11Å; L6-I10 HydrophobicContact CG-CD1 3.9Å; L6-I10 HydrophobicContact CG-CG1 4.37Å; L6-I10 WeakPolarHBondContact O-CB 3.19Å; L6-I10 WeakPolarHBondContact O-CD1 3.16Å; L6-I10 WeakPolarHBondContact O-CG1 3.33Å; L6-I10 PolarHBondContact O-N 2.9Å; L6-L430 HydrophobicContact CB-CD2 3.98Å; L6-L430 HydrophobicContact CD1-CD2 3.55Å; L6-L430 HydrophobicContact CD2-CD2 3.55Å; L6-L430 HydrophobicContact CD2-CG 3.91Å; L6-L430 HydrophobicContact CG-CD2 3.86Å
7	E	49.2	Very low	42.9	Very low	96 Å²	96	88.9 Å²	88.9	45%	0.449	47%	0.473	S	S	.	.	H	α-helix	trans	-58.7	-46.4	173.6	-73	173.7	174.2	0	0	110.6	S3 A4 Q9 I10 V11 P436	S3-E7 PolarHBondContact O-N 3.19Å; A4-E7 WeakPolarHBondContact O-CB 3.27Å; A4-E7 PolarHBondContact O-N 3.15Å; E7-Q9 PolarHBondContact O-N 3.19Å; E7-I10 PolarHBondContact O-N 3.23Å; E7-V11 VanDerWaalsContact O-CG2 3.31Å; E7-V11 WeakPolarHBondContact O-CG2 3.22Å; E7-V11 PolarHBondContact O-N 3.46Å; E7-P436 WeakPolarHBondContact OE1-CG 3.43Å
8	A	48.5	Very low	42.4	Very low	22 Å²	22	94.1 Å²	94.1	18%	0.182	49%	0.493	C	S	.	.	H	α-helix	trans	-61.2	-43.3	175.1	0	0	0	0	0	112.8	A4 L6 I10 V11 E12 V53	A4-A8 WeakPolarHBondContact O-CB 3.14Å; A4-A8 PolarHBondContact O-N 3.01Å; L6-A8 VanDerWaalsContact C-N 3.33Å; L6-A8 PolarHBondContact O-N 3.31Å; A8-I10 VanDerWaalsContact C-N 3.35Å; A8-I10 PolarHBondContact O-N 3.41Å; A8-V11 WeakPolarHBondContact O-CB 3Å; A8-V11 PolarHBondContact O-N 3.24Å; A8-E12 PolarHBondContact O-N 3.36Å; A8-V53 HydrophobicContact CB-CG1 3.86Å
9	Q	49.2	Very low	42.2	Very low	73 Å²	73	98.4 Å²	98.4	34%	0.341	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-33	175.5	-76.8	-177.4	-21.3	0	0	113.2	L5 L6 E7 V11 E12 K13 Y48	L5-Q9 WeakPolarHBondContact O-CB 3.38Å; L5-Q9 VanDerWaalsContact O-CG 3.32Å; L5-Q9 WeakPolarHBondContact O-CG 3.14Å; L5-Q9 PolarHBondContact O-N 2.88Å; L6-Q9 PolarHBondContact O-N 3.41Å; E7-Q9 PolarHBondContact O-N 3.19Å; Q9-V11 VanDerWaalsContact C-N 3.29Å; Q9-E12 PolarHBondContact O-N 3Å; Q9-K13 PolarHBondContact O-N 3.14Å; Q9-Y48 PolarHBondContact NE2-OH 3.44Å; Q9-Y48 VanDerWaalsContact NE2-OH 3.15Å
10	I	44.5	Very low	41.9	Very low	108 Å²	108	100.9 Å²	100.9	55%	0.554	52%	0.518	S	S	*	.	H	α-helix	trans	-66	-36.3	173.3	-71.4	164.7	0	0	0	109.9	L6 E7 A8	L6-I10 HydrophobicContact CD2-CD1 4.11Å; L6-I10 HydrophobicContact CG-CD1 3.9Å; L6-I10 HydrophobicContact CG-CG1 4.37Å; L6-I10 WeakPolarHBondContact O-CB 3.19Å; L6-I10 WeakPolarHBondContact O-CD1 3.16Å; L6-I10 WeakPolarHBondContact O-CG1 3.33Å; L6-I10 PolarHBondContact O-N 2.9Å; E7-I10 PolarHBondContact O-N 3.23Å; A8-I10 VanDerWaalsContact C-N 3.35Å; A8-I10 PolarHBondContact O-N 3.41Å
11	V	37	Very low	42	Very low	83 Å²	83	100.1 Å²	100.1	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-71.2	-35	175.9	175.4	0	0	0	0	112.1	E7 A8 Q9 K13 T14	E7-V11 VanDerWaalsContact O-CG2 3.31Å; E7-V11 WeakPolarHBondContact O-CG2 3.22Å; E7-V11 PolarHBondContact O-N 3.46Å; A8-V11 WeakPolarHBondContact O-CB 3Å; A8-V11 PolarHBondContact O-N 3.24Å; Q9-V11 VanDerWaalsContact C-N 3.29Å; V11-K13 PolarHBondContact O-N 2.87Å; V11-T14 PolarHBondContact O-N 3.05Å; V11-T14 PolarHBondContact O-OG1 3.03Å
12	E	43.1	Very low	41.6	Very low	98 Å²	98	102 Å²	102	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-75.8	-24.3	-174.6	-156.9	167.1	-145.4	0	0	113.8	A8 Q9 T14 N15	A8-E12 PolarHBondContact O-N 3.36Å; Q9-E12 PolarHBondContact O-N 3Å; E12-T14 PolarHBondContact O-N 3.01Å; E12-N15 PolarHBondContact O-N 3.17Å; E12-N15 VanDerWaalsContact O-N 3.12Å
13	K	38.9	Very low	41.4	Very low	197 Å²	197	104.5 Å²	104.5	86%	0.857	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-14.7	170.9	-90	-174.8	178.5	177.4	0	113.9	Q9 V11	Q9-K13 PolarHBondContact O-N 3.14Å; V11-K13 PolarHBondContact O-N 2.87Å
14	T	36.1	Very low	41.2	Very low	111 Å²	111	108.8 Å²	108.8	68%	0.681	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-9	177.6	31.7	0	0	0	0	115.7	V11 E12	V11-T14 PolarHBondContact O-N 3.05Å; V11-T14 PolarHBondContact O-OG1 3.03Å; E12-T14 PolarHBondContact O-N 3.01Å
15	N	33.7	Very low	41.5	Very low	118 Å²	118	109.5 Å²	109.5	63%	0.631	58%	0.583	S	S	*	*			trans	-129.5	82.1	-178.3	-81.2	-21.9	0	0	0	112.5	E12 H17	E12-N15 PolarHBondContact O-N 3.17Å; E12-N15 VanDerWaalsContact O-N 3.12Å; N15-H17 VanDerWaalsContact C-N 3.28Å; N15-H17 PolarHBondContact O-N 2.96Å
16	S	31.1	Very low	41.7	Very low	119 Å²	119	112.2 Å²	112.2	83%	0.832	59%	0.593	S	S	*	*			trans	-72.1	79.5	164.4	58	0	0	0	0	110.5
17	H	32.3	Very low	42.1	Very low	161 Å²	161	114.9 Å²	114.9	75%	0.745	61%	0.608	S	S	*	*			trans	-123.6	116.7	166.9	-87	-62.5	0	0	0	111.2	N15 Y19	N15-H17 VanDerWaalsContact C-N 3.28Å; N15-H17 PolarHBondContact O-N 2.96Å; H17-Y19 PolarHBondContact O-N 2.63Å; H17-Y19 VanDerWaalsContact O-N 3.16Å
18	H	33.3	Very low	43	Very low	183 Å²	183	115.8 Å²	115.8	85%	0.847	62%	0.616	S	S	*	*			trans	-38.3	104.3	179.5	-69.6	-58.3	0	0	0	115.3
19	Y	38.9	Very low	44	Very low	175 Å²	175	118.6 Å²	118.6	69%	0.686	62%	0.624	S	S	*	*			trans	-88.2	127.9	145.2	-84.4	-86.3	0	0	0	108.5	H17 H21	H17-Y19 PolarHBondContact O-N 2.63Å; H17-Y19 VanDerWaalsContact O-N 3.16Å; Y19-H21 PolarHBondContact O-CD2 3.34Å; Y19-H21 PolarHBondContact O-N 3.22Å
20	N	35.4	Very low	45.3	Very low	148 Å²	148	116.2 Å²	116.2	79%	0.791	62%	0.615	S	S	*	*			trans	-69.1	92.4	-179.9	-77.2	-29.9	0	0	0	110.3	T22	N20-T22 PolarHBondContact O-N 3.42Å
21	H	44	Very low	46.9	Very low	86 Å²	86	115 Å²	115	40%	0.398	62%	0.617	S	S	.	*			trans	-87.9	88.6	176.3	-65	-58.7	0	0	0	111.2	Y19 Y26	Y19-H21 PolarHBondContact O-CD2 3.34Å; Y19-H21 PolarHBondContact O-N 3.22Å; H21-Y26 HydrophobicContact CB-CD1 3.91Å; H21-Y26 HydrophobicContact CB-CE1 4.46Å; H21-Y26 HydrophobicContact CB-CG 4.32Å; H21-Y26 AromaticContact CD2-CD1 3.91Å; H21-Y26 AromaticContact CD2-CE1 3.65Å; H21-Y26 AromaticContact CE1-CD1 3.69Å; H21-Y26 AromaticContact CE1-CE1 2.95Å; H21-Y26 WeakPolarHBondContact CE1-CE1 3.2Å; H21-Y26 AromaticContact CE1-CE2 3.86Å; H21-Y26 AromaticContact CE1-CZ 3.03Å; H21-Y26 PolarHBondContact CE1-OH 2.8Å; H21-Y26 AromaticContact CG-CD1 3.38Å; H21-Y26 AromaticContact CG-CE1 3.46Å; H21-Y26 VanDerWaalsContact CG-CE1 3.46Å; H21-Y26 AromaticContact ND1-CD1 3.21Å; H21-Y26 WeakPolarHBondContact ND1-CD1 3.05Å; H21-Y26 AromaticContact ND1-CD2 3.89Å; H21-Y26 AromaticContact ND1-CE1 2.99Å; H21-Y26 WeakPolarHBondContact ND1-CE1 3.23Å; H21-Y26 AromaticContact ND1-CE2 3.7Å; H21-Y26 AromaticContact ND1-CG 3.66Å; H21-Y26 AromaticContact ND1-CZ 3.24Å; H21-Y26 AromaticContact NE2-CE1 3.37Å; H21-Y26 WeakPolarHBondContact NE2-CE1 3.46Å; H21-Y26 AromaticContact NE2-CZ 3.84Å
22	T	39.6	Very low	48.6	Very low	128 Å²	128	116.1 Å²	116.1	79%	0.785	62%	0.62	S	S	*	*			trans	-105.2	32.2	176.7	53.8	0	0	0	0	113.6	N20	N20-T22 PolarHBondContact O-N 3.42Å
23	L	41.9	Very low	50.1	Low	137 Å²	137	113.8 Å²	113.8	72%	0.717	61%	0.612	S	S	*	*	S	Bend	trans	-113.3	124.6	162.5	-94.9	96.3	0	0	0	110.5	G25 Y26	L23-G25 PolarHBondContact O-N 2.97Å; L23-Y26 PolarHBondContact O-N 3.24Å
24	P	41	Very low	51.8	Low	138 Å²	138	105.5 Å²	105.5	90%	0.896	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	125.8	176.2	23.6	-29.3	0	0	0	109.9
25	G	55.3	Low	53.7	Low	53 Å²	53	108.1 Å²	108.1	55%	0.546	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	103.4	-3.8	-179.9	0	0	0	0	0	115.9	L23 D28 F29	L23-G25 PolarHBondContact O-N 2.97Å; G25-D28 PolarHBondContact O-N 3.29Å; G25-F29 PolarHBondContact O-N 3.16Å
26	Y	52	Low	55.7	Low	62 Å²	62	106.4 Å²	106.4	24%	0.243	57%	0.573	C	S	.	*	H	α-helix	trans	-63.1	-46	178.2	-179.4	-86.8	0	0	0	113	H21 L23 D28 F29 C30 Y51	H21-Y26 HydrophobicContact CB-CD1 3.91Å; H21-Y26 HydrophobicContact CB-CE1 4.46Å; H21-Y26 HydrophobicContact CB-CG 4.32Å; H21-Y26 AromaticContact CD2-CD1 3.91Å; H21-Y26 AromaticContact CD2-CE1 3.65Å; H21-Y26 AromaticContact CE1-CD1 3.69Å; H21-Y26 AromaticContact CE1-CE1 2.95Å; H21-Y26 WeakPolarHBondContact CE1-CE1 3.2Å; H21-Y26 AromaticContact CE1-CE2 3.86Å; H21-Y26 AromaticContact CE1-CZ 3.03Å; H21-Y26 PolarHBondContact CE1-OH 2.8Å; H21-Y26 AromaticContact CG-CD1 3.38Å; H21-Y26 AromaticContact CG-CE1 3.46Å; H21-Y26 VanDerWaalsContact CG-CE1 3.46Å; H21-Y26 AromaticContact ND1-CD1 3.21Å; H21-Y26 WeakPolarHBondContact ND1-CD1 3.05Å; H21-Y26 AromaticContact ND1-CD2 3.89Å; H21-Y26 AromaticContact ND1-CE1 2.99Å; H21-Y26 WeakPolarHBondContact ND1-CE1 3.23Å; H21-Y26 AromaticContact ND1-CE2 3.7Å; H21-Y26 AromaticContact ND1-CG 3.66Å; H21-Y26 AromaticContact ND1-CZ 3.24Å; H21-Y26 AromaticContact NE2-CE1 3.37Å; H21-Y26 WeakPolarHBondContact NE2-CE1 3.46Å; H21-Y26 AromaticContact NE2-CZ 3.84Å; L23-Y26 PolarHBondContact O-N 3.24Å; Y26-D28 PolarHBondContact O-N 2.86Å; Y26-F29 PolarHBondContact O-N 2.82Å; Y26-C30 PolarHBondContact O-N 3.46Å; Y26-Y51 PolarHBondContact OH-O 3.07Å
27	D	59.3	Low	58.1	Low	117 Å²	117	102.7 Å²	102.7	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-61.2	-31.5	179.8	-65.9	-23.6	0	0	0	112.5	S31	D27-S31 WeakPolarHBondContact O-CB 3.28Å; D27-S31 PolarHBondContact O-N 3.03Å; D27-S31 PolarHBondContact O-OG 3.15Å
28	D	67.4	Low	60.4	Low	115 Å²	115	95.4 Å²	95.4	62%	0.615	51%	0.513	S	S	*	.	H	α-helix	trans	-73.6	-37.9	179.3	-166.3	31.5	0	0	0	112.2	G25 Y26 S31	G25-D28 PolarHBondContact O-N 3.29Å; Y26-D28 PolarHBondContact O-N 2.86Å; D28-S31 PolarHBondContact O-N 3.14Å
29	F	70.5	Confident	62.7	Low	80 Å²	80	89.8 Å²	89.8	35%	0.351	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-42.7	178.9	179.3	-106.1	0	0	0	112.4	G25 Y26 Q47 Y48 C52	G25-F29 PolarHBondContact O-N 3.16Å; Y26-F29 PolarHBondContact O-N 2.82Å; F29-Q47 HydrophobicContact CZ-CB 4.13Å; F29-Y48 HydrophobicContact CE1-CD2 4.43Å; F29-C52 WeakPolarHBondContact CD1-SG 3.41Å; F29-C52 VanDerWaalsContact CE1-SG 3.59Å
30	C	76.2	Confident	64.6	Low	23 Å²	23	82.6 Å²	82.6	16%	0.155	47%	0.473	C	S	.	.	H	α-helix	trans	-80.1	-20.8	-178.4	-61.8	0	0	0	0	114	Y26 N32 Y48 C52	Y26-C30 PolarHBondContact O-N 3.46Å; C30-N32 PolarHBondContact O-N 2.91Å; C30-Y48 PolarHBondContact O-OH 2.92Å; C30-C52 WeakPolarHBondContact CA-SG 3.36Å; C30-C52 HydrophobicContact CB-CB 3.51Å; C30-C52 WeakPolarHBondContact CB-SG 3.41Å; C30-C52 WeakPolarHBondContact SG-CA 3.33Å; C30-C52 WeakPolarHBondContact SG-CB 3.44Å; C30-C52 CovalentContact SG-SG 2.04Å; C30-C52 PolarHBondContact SG-SG 3.35Å
31	S	76.7	Confident	66.9	Low	84 Å²	84	78.4 Å²	78.4	59%	0.587	45%	0.447	S	S	*	.	H	α-helix	trans	-64.3	-26.2	175.6	-68.9	0	0	0	0	113.2	D27 D28	D27-S31 WeakPolarHBondContact O-CB 3.28Å; D27-S31 PolarHBondContact O-N 3.03Å; D27-S31 PolarHBondContact O-OG 3.15Å; D28-S31 PolarHBondContact O-N 3.14Å
32	N	72.8	Confident	68.8	Low	106 Å²	106	74.9 Å²	74.9	57%	0.567	43%	0.431	S	S	*	.	S	Bend	trans	-127.1	121.2	-174.4	-65.7	-60.3	0	0	0	111.9	C30	C30-N32 PolarHBondContact O-N 2.91Å
33	V	74.8	Confident	70.8	Confident	48 Å²	48	72.5 Å²	72.5	29%	0.291	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-59.8	135.7	171.5	-178.2	0	0	0	0	109.5	L5 Q35 M45	L5-V33 HydrophobicContact CD2-CG2 4.03Å; V33-Q35 PolarHBondContact O-N 3.04Å; V33-M45 HydrophobicContact CG1-SD 4.34Å
34	P	76	Confident	72.7	Confident	24 Å²	24	67.3 Å²	67.3	16%	0.156	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-51.8	131.7	178.2	-28.1	33.7	0	0	0	112.3	A44 M45 Y48	P34-A44 HydrophobicContact CB-CB 3.92Å; P34-A44 HydrophobicContact CG-CB 4.19Å; P34-M45 HydrophobicContact CB-SD 3.91Å; P34-M45 HydrophobicContact CG-SD 3.85Å; P34-Y48 VanDerWaalsContact CD-CD2 3.48Å; P34-Y48 HydrophobicContact CG-CD2 4.11Å; P34-Y48 HydrophobicContact CG-CG 4.13Å
35	Q	75.7	Confident	74.7	Confident	166 Å²	166	61 Å²	61	78%	0.776	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-74.4	149.4	176.8	-64.8	-173.9	-3.5	0	0	110.9	V33 T37 Y41	V33-Q35 PolarHBondContact O-N 3.04Å; Q35-T37 PolarHBondContact O-N 3.17Å; Q35-Y41 WeakPolarHBondContact O-CD2 3.34Å
36	L	75.6	Confident	76.1	Confident	81 Å²	81	60.5 Å²	60.5	42%	0.424	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-66.5	117.4	177.9	-171.2	68.2	0	0	0	110.7	Y41 I241 L424	L36-Y41 HydrophobicContact CB-CE2 4.37Å; L36-Y41 HydrophobicContact CD1-CD1 3.71Å; L36-Y41 HydrophobicContact CD1-CD2 3.94Å; L36-Y41 HydrophobicContact CD1-CE1 3.67Å; L36-Y41 HydrophobicContact CD1-CE2 3.88Å; L36-Y41 HydrophobicContact CD1-CG 3.84Å; L36-I241 HydrophobicContact CB-CG2 4.25Å; L36-I241 HydrophobicContact CD2-CG2 3.73Å; L36-I241 HydrophobicContact CG-CG2 3.78Å; L36-L424 HydrophobicContact CD2-CD2 4.12Å
37	T	80.3	Confident	77.6	Confident	41 Å²	41	61.1 Å²	61.1	25%	0.252	34%	0.336	S	S	.	.			trans	-125.3	158.9	177.6	66.2	0	0	0	0	111.7	Q35 S39 Q242	Q35-T37 PolarHBondContact O-N 3.17Å; T37-S39 PolarHBondContact O-N 3.45Å; T37-S39 PolarHBondContact OG1-O 3.3Å; T37-Q242 HydrophobicContact CG2-CG 3.88Å
38	S	80.5	Confident	78.7	Confident	8 Å²	8	55.6 Å²	55.6	6%	0.056	31%	0.306	C	S	.	.	S	Bend	trans	-73.2	-7.2	172.1	74.4	0	0	0	0	113.3	S225 T228 Q242	S38-S225 WeakPolarHBondContact O-CA 3.47Å; S38-S225 WeakPolarHBondContact O-CB 3.32Å; S38-S225 PolarHBondContact O-OG 3.47Å; S38-S225 VanDerWaalsContact O-OG 3.1Å; S38-T228 WeakPolarHBondContact O-CG2 3.48Å; S38-Q242 PolarHBondContact OG-NE2 3.44Å
39	S	81.8	Confident	79.5	Confident	66 Å²	66	50.2 Å²	50.2	46%	0.462	28%	0.278	S	S	.	.	S	Bend	trans	-147.5	128.7	-177.7	57.3	0	0	0	0	110.9	T37 Y41 V226	T37-S39 PolarHBondContact O-N 3.45Å; T37-S39 PolarHBondContact OG1-O 3.3Å; S39-Y41 PolarHBondContact O-N 2.87Å; S39-V226 CarbonylContact C-O 3.59Å; S39-V226 WeakPolarHBondContact CA-O 3.43Å
40	G	80.7	Confident	80	Confident	24 Å²	24	52.4 Å²	52.4	25%	0.247	29%	0.287	C	S	.	.	S	Bend	trans	73.4	10.1	176.3	0	0	0	0	0	114.4	E43 A44 V226	G40-E43 PolarHBondContact O-N 3.49Å; G40-A44 VanDerWaalsContact O-CB 3.29Å; G40-A44 WeakPolarHBondContact O-CB 3.3Å; G40-A44 PolarHBondContact O-N 3Å; G40-V226 PolarHBondContact N-O 3.06Å
41	Y	82.9	Confident	80.2	Confident	59 Å²	59	57 Å²	57	23%	0.231	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-44.5	178.8	174.4	-105.5	0	0	0	111.9	Q35 L36 S39 E43 A44 M45	Q35-Y41 WeakPolarHBondContact O-CD2 3.34Å; L36-Y41 HydrophobicContact CB-CE2 4.37Å; L36-Y41 HydrophobicContact CD1-CD1 3.71Å; L36-Y41 HydrophobicContact CD1-CD2 3.94Å; L36-Y41 HydrophobicContact CD1-CE1 3.67Å; L36-Y41 HydrophobicContact CD1-CE2 3.88Å; L36-Y41 HydrophobicContact CD1-CG 3.84Å; S39-Y41 PolarHBondContact O-N 2.87Å; Y41-E43 VanDerWaalsContact C-N 3.34Å; Y41-E43 PolarHBondContact O-N 2.85Å; Y41-A44 PolarHBondContact O-N 3.24Å; Y41-M45 HydrophobicContact CD1-CG 4.41Å; Y41-M45 HydrophobicContact CD2-CG 4.23Å; Y41-M45 HydrophobicContact CE1-CG 3.95Å; Y41-M45 HydrophobicContact CE2-CG 3.77Å; Y41-M45 HydrophobicContact CE2-SD 4.07Å; Y41-M45 WeakPolarHBondContact O-CB 3.29Å; Y41-M45 WeakPolarHBondContact O-CG 3.13Å; Y41-M45 PolarHBondContact O-N 2.89Å
42	L	83.4	Confident	80.4	Confident	12 Å²	12	53.5 Å²	53.5	6%	0.063	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-44.3	178.6	-179.1	61.5	0	0	0	110.8	M45 I46 L69 D227 P231	L42-M45 PolarHBondContact O-N 2.83Å; L42-I46 HydrophobicContact CD1-CD1 4.31Å; L42-I46 HydrophobicContact CG-CD1 3.98Å; L42-I46 VanDerWaalsContact O-CG1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.42Å; L42-I46 PolarHBondContact O-N 3.09Å; L42-L69 HydrophobicContact CD1-CD2 4.06Å; L42-L69 HydrophobicContact CD2-CD2 3.56Å; L42-L69 HydrophobicContact CG-CD2 4.46Å; L42-D227 WeakPolarHBondContact CB-O 3.38Å; L42-D227 PolarHBondContact N-O 2.94Å; L42-P231 HydrophobicContact CD2-CG 4.33Å
43	E	82.2	Confident	80.6	Confident	79 Å²	79	49 Å²	49	37%	0.369	25%	0.254	S	S	.	.	H	α-helix	trans	-63	-45.3	177.3	-177.7	57.2	-151.8	0	0	111.7	G40 Y41 M45 I46 Q47	G40-E43 PolarHBondContact O-N 3.49Å; Y41-E43 VanDerWaalsContact C-N 3.34Å; Y41-E43 PolarHBondContact O-N 2.85Å; E43-M45 VanDerWaalsContact C-N 3.28Å; E43-M45 PolarHBondContact O-N 2.82Å; E43-I46 PolarHBondContact O-N 3.31Å; E43-Q47 WeakPolarHBondContact O-CB 3.49Å; E43-Q47 WeakPolarHBondContact O-CG 3.48Å; E43-Q47 PolarHBondContact O-N 2.92Å; E43-Q47 PolarHBondContact OE1-NE2 3.46Å
44	A	82.5	Confident	80.4	Confident	28 Å²	28	48 Å²	48	23%	0.231	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-38.3	176.3	0	0	0	0	0	111.9	P34 G40 Y41 Y48	P34-A44 HydrophobicContact CB-CB 3.92Å; P34-A44 HydrophobicContact CG-CB 4.19Å; G40-A44 VanDerWaalsContact O-CB 3.29Å; G40-A44 WeakPolarHBondContact O-CB 3.3Å; G40-A44 PolarHBondContact O-N 3Å; Y41-A44 PolarHBondContact O-N 3.24Å; A44-Y48 WeakPolarHBondContact O-CB 3.41Å; A44-Y48 PolarHBondContact O-N 3.1Å
45	M	82.3	Confident	80.1	Confident	4 Å²	4	49 Å²	49	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-68	-42.2	174.4	-73.9	-57.1	-59.8	0	0	112.4	M1 L5 V33 P34 Y41 L42 E43 Q47 Y48 V49	M1-M45 HydrophobicContact CE-CE 3.61Å; M1-M45 HydrophobicContact CE-CG 4.35Å; M1-M45 HydrophobicContact SD-CE 3.35Å; M1-M45 WeakPolarHBondContact SD-CE 3.43Å; L5-M45 HydrophobicContact CD1-CE 4.19Å; V33-M45 HydrophobicContact CG1-SD 4.34Å; P34-M45 HydrophobicContact CB-SD 3.91Å; P34-M45 HydrophobicContact CG-SD 3.85Å; Y41-M45 HydrophobicContact CD1-CG 4.41Å; Y41-M45 HydrophobicContact CD2-CG 4.23Å; Y41-M45 HydrophobicContact CE1-CG 3.95Å; Y41-M45 HydrophobicContact CE2-CG 3.77Å; Y41-M45 HydrophobicContact CE2-SD 4.07Å; Y41-M45 WeakPolarHBondContact O-CB 3.29Å; Y41-M45 WeakPolarHBondContact O-CG 3.13Å; Y41-M45 PolarHBondContact O-N 2.89Å; L42-M45 PolarHBondContact O-N 2.83Å; E43-M45 VanDerWaalsContact C-N 3.28Å; E43-M45 PolarHBondContact O-N 2.82Å; M45-Q47 VanDerWaalsContact C-N 3.33Å; M45-Q47 PolarHBondContact O-N 3.43Å; M45-Y48 PolarHBondContact O-N 2.96Å; M45-V49 WeakPolarHBondContact O-CG2 3.47Å; M45-V49 PolarHBondContact O-N 2.66Å
46	I	83.9	Confident	79.8	Confident	43 Å²	43	47.5 Å²	47.5	22%	0.221	27%	0.265	C	S	.	.	H	α-helix	trans	-60.2	-45.2	174.9	-71.1	166.2	0	0	0	110.1	L42 E43 V49 K50 L62 L65	L42-I46 HydrophobicContact CD1-CD1 4.31Å; L42-I46 HydrophobicContact CG-CD1 3.98Å; L42-I46 VanDerWaalsContact O-CG1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.42Å; L42-I46 PolarHBondContact O-N 3.09Å; E43-I46 PolarHBondContact O-N 3.31Å; I46-V49 PolarHBondContact O-N 3.2Å; I46-K50 VanDerWaalsContact O-CB 3.3Å; I46-K50 WeakPolarHBondContact O-CB 3.38Å; I46-K50 PolarHBondContact O-N 3.39Å; I46-L62 HydrophobicContact CG1-CD1 4.27Å; I46-L62 HydrophobicContact CG2-CD1 4.1Å; I46-L65 HydrophobicContact CG1-CD2 3.95Å
47	Q	83.6	Confident	79.6	Confident	75 Å²	75	48.6 Å²	48.6	35%	0.35	27%	0.267	S	S	.	.	H	α-helix	trans	-63.8	-42.9	176.9	-71.2	179	3.4	0	0	111.9	F29 E43 M45 V49 K50 Y51	F29-Q47 HydrophobicContact CZ-CB 4.13Å; E43-Q47 WeakPolarHBondContact O-CB 3.49Å; E43-Q47 WeakPolarHBondContact O-CG 3.48Å; E43-Q47 PolarHBondContact O-N 2.92Å; E43-Q47 PolarHBondContact OE1-NE2 3.46Å; M45-Q47 VanDerWaalsContact C-N 3.33Å; M45-Q47 PolarHBondContact O-N 3.43Å; Q47-V49 PolarHBondContact O-N 3.23Å; Q47-K50 PolarHBondContact O-N 3.41Å; Q47-Y51 HydrophobicContact CB-CD2 4.17Å; Q47-Y51 HydrophobicContact CB-CE2 4.36Å; Q47-Y51 HydrophobicContact CG-CE2 4.4Å; Q47-Y51 WeakPolarHBondContact O-CB 3.47Å; Q47-Y51 WeakPolarHBondContact O-CD2 3.27Å; Q47-Y51 PolarHBondContact O-N 3.44Å
48	Y	83.6	Confident	79.5	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-59.5	-48	176	-173.8	-82.6	0	0	0	111.6	L5 Q9 F29 C30 P34 A44 M45 K50 Y51 C52	L5-Y48 HydrophobicContact CD1-CD1 3.74Å; L5-Y48 HydrophobicContact CD1-CE1 3.59Å; L5-Y48 HydrophobicContact CD2-CD1 4.29Å; L5-Y48 HydrophobicContact CD2-CE1 3.29Å; L5-Y48 HydrophobicContact CG-CD1 4.34Å; L5-Y48 HydrophobicContact CG-CE1 3.72Å; Q9-Y48 PolarHBondContact NE2-OH 3.44Å; Q9-Y48 VanDerWaalsContact NE2-OH 3.15Å; F29-Y48 HydrophobicContact CE1-CD2 4.43Å; C30-Y48 PolarHBondContact O-OH 2.92Å; P34-Y48 VanDerWaalsContact CD-CD2 3.48Å; P34-Y48 HydrophobicContact CG-CD2 4.11Å; P34-Y48 HydrophobicContact CG-CG 4.13Å; A44-Y48 WeakPolarHBondContact O-CB 3.41Å; A44-Y48 PolarHBondContact O-N 3.1Å; M45-Y48 PolarHBondContact O-N 2.96Å; Y48-K50 VanDerWaalsContact C-N 3.31Å; Y48-K50 PolarHBondContact O-N 3.44Å; Y48-Y51 PolarHBondContact O-N 3.41Å; Y48-C52 HydrophobicContact CD1-CB 4.21Å; Y48-C52 HydrophobicContact CD2-CB 4.04Å; Y48-C52 HydrophobicContact CE1-CB 4.01Å; Y48-C52 HydrophobicContact CE2-CB 3.91Å; Y48-C52 HydrophobicContact CG-CB 4.23Å; Y48-C52 WeakPolarHBondContact O-CA 3.34Å; Y48-C52 WeakPolarHBondContact O-CB 3.29Å; Y48-C52 PolarHBondContact O-N 2.93Å
49	V	82.5	Confident	79.5	Confident	3 Å²	3	55 Å²	55	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-39.7	177.1	171.7	0	0	0	0	111.6	M45 I46 Q47 M61	M45-V49 WeakPolarHBondContact O-CG2 3.47Å; M45-V49 PolarHBondContact O-N 2.66Å; I46-V49 PolarHBondContact O-N 3.2Å; Q47-V49 PolarHBondContact O-N 3.23Å; V49-M61 HydrophobicContact CG1-CB 3.89Å; V49-M61 HydrophobicContact CG1-CE 3.83Å
50	K	81.9	Confident	79.4	Confident	126 Å²	126	54.3 Å²	54.3	55%	0.548	28%	0.284	S	S	.	.	H	α-helix	trans	-70.1	-38.7	-177.9	-172.3	178.6	-177.2	-179	0	113.3	I46 Q47 Y48 N58	I46-K50 VanDerWaalsContact O-CB 3.3Å; I46-K50 WeakPolarHBondContact O-CB 3.38Å; I46-K50 PolarHBondContact O-N 3.39Å; Q47-K50 PolarHBondContact O-N 3.41Å; Y48-K50 VanDerWaalsContact C-N 3.31Å; Y48-K50 PolarHBondContact O-N 3.44Å; K50-N58 PolarHBondContact O-ND2 3.07Å
51	Y	80.4	Confident	79.4	Confident	118 Å²	118	54.6 Å²	54.6	46%	0.463	28%	0.279	S	S	.	.	H	α-helix	trans	-103.4	-30	-171.3	-67.3	-63.8	0	0	0	113.9	Y26 Q47 Y48	Y26-Y51 PolarHBondContact OH-O 3.07Å; Q47-Y51 HydrophobicContact CB-CD2 4.17Å; Q47-Y51 HydrophobicContact CB-CE2 4.36Å; Q47-Y51 HydrophobicContact CG-CE2 4.4Å; Q47-Y51 WeakPolarHBondContact O-CB 3.47Å; Q47-Y51 WeakPolarHBondContact O-CD2 3.27Å; Q47-Y51 PolarHBondContact O-N 3.44Å; Y48-Y51 PolarHBondContact O-N 3.41Å
52	C	80.7	Confident	79.4	Confident	11 Å²	11	54.7 Å²	54.7	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-109	-6.8	-169.2	-59.2	0	0	0	0	114.6	F29 C30 Y48	F29-C52 WeakPolarHBondContact CD1-SG 3.41Å; F29-C52 VanDerWaalsContact CE1-SG 3.59Å; C30-C52 WeakPolarHBondContact CA-SG 3.36Å; C30-C52 HydrophobicContact CB-CB 3.51Å; C30-C52 WeakPolarHBondContact CB-SG 3.41Å; C30-C52 WeakPolarHBondContact SG-CA 3.33Å; C30-C52 WeakPolarHBondContact SG-CB 3.44Å; C30-C52 CovalentContact SG-SG 2.04Å; C30-C52 PolarHBondContact SG-SG 3.35Å; Y48-C52 HydrophobicContact CD1-CB 4.21Å; Y48-C52 HydrophobicContact CD2-CB 4.04Å; Y48-C52 HydrophobicContact CE1-CB 4.01Å; Y48-C52 HydrophobicContact CE2-CB 3.91Å; Y48-C52 HydrophobicContact CG-CB 4.23Å; Y48-C52 WeakPolarHBondContact O-CA 3.34Å; Y48-C52 WeakPolarHBondContact O-CB 3.29Å; Y48-C52 PolarHBondContact O-N 2.93Å
53	V	76.6	Confident	79.4	Confident	13 Å²	13	59.4 Å²	59.4	8%	0.079	31%	0.305	C	S	.	.	S	Bend	trans	-102.9	137.9	167.1	-172.4	0	0	0	0	107.4	A8 N58 M61	A8-V53 HydrophobicContact CB-CG1 3.86Å; V53-N58 VanDerWaalsContact CB-OD1 3.3Å; V53-N58 WeakPolarHBondContact CB-OD1 3.4Å; V53-N58 WeakPolarHBondContact CG1-OD1 3.37Å; V53-N58 PolarHBondContact O-ND2 3.49Å; V53-N58 PolarHBondContact O-OD1 2.88Å; V53-M61 HydrophobicContact CB-CE 3.36Å; V53-M61 HydrophobicContact CG1-CE 3.16Å; V53-M61 HydrophobicContact CG1-SD 4.34Å; V53-M61 HydrophobicContact CG2-CE 3.6Å; V53-M61 HydrophobicContact CG2-SD 4.46Å
54	G	70.5	Confident	79.4	Confident	27 Å²	27	60.2 Å²	60.2	28%	0.278	31%	0.311	S	S	.	.			trans	-99	152.1	-178.6	0	0	0	0	0	113.1
55	G	71.4	Confident	79.3	Confident	43 Å²	43	59.8 Å²	59.8	44%	0.443	31%	0.305	S	S	.	.	S	Bend	trans	84.9	-167.7	170.3	0	0	0	0	0	115.7	H57 N58	G55-H57 PolarHBondContact O-N 2.94Å; G55-H57 VanDerWaalsContact O-N 3.11Å; G55-N58 PolarHBondContact O-N 3.17Å
56	N	68.6	Low	79.4	Confident	136 Å²	136	63.3 Å²	63.3	73%	0.727	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.3	-179.2	-70.7	2	0	0	0	113.5	N58	N56-N58 PolarHBondContact O-N 3.4Å
57	H	71.7	Confident	79.3	Confident	103 Å²	103	66 Å²	66	48%	0.477	34%	0.34	S	S	.	.	H	α-helix	trans	-65.6	-21.3	179.7	-57.6	99.4	0	0	0	113.6	G55 E60 M61	G55-H57 PolarHBondContact O-N 2.94Å; G55-H57 VanDerWaalsContact O-N 3.11Å; H57-E60 PolarHBondContact O-N 2.75Å; H57-M61 HydrophobicContact CB-CE 4.45Å; H57-M61 WeakPolarHBondContact O-CB 3.48Å; H57-M61 WeakPolarHBondContact O-CE 3.4Å; H57-M61 VanDerWaalsContact O-CG 3.31Å; H57-M61 WeakPolarHBondContact O-CG 3.39Å; H57-M61 PolarHBondContact O-N 3Å
58	N	77.9	Confident	79.3	Confident	34 Å²	34	66.3 Å²	66.3	18%	0.182	34%	0.342	C	S	.	.	H	α-helix	trans	-64.3	-46	-177.8	-65.5	3.3	0	0	0	112	K50 V53 G55 N56 L62	K50-N58 PolarHBondContact O-ND2 3.07Å; V53-N58 VanDerWaalsContact CB-OD1 3.3Å; V53-N58 WeakPolarHBondContact CB-OD1 3.4Å; V53-N58 WeakPolarHBondContact CG1-OD1 3.37Å; V53-N58 PolarHBondContact O-ND2 3.49Å; V53-N58 PolarHBondContact O-OD1 2.88Å; G55-N58 PolarHBondContact O-N 3.17Å; N56-N58 PolarHBondContact O-N 3.4Å; N58-L62 VanDerWaalsContact O-CB 3.24Å; N58-L62 WeakPolarHBondContact O-CB 3.41Å; N58-L62 PolarHBondContact O-N 3.1Å
59	E	80.5	Confident	79.2	Confident	149 Å²	149	67.8 Å²	67.8	70%	0.696	35%	0.35	S	S	*	.	H	α-helix	trans	-66.5	-44.1	179	-66.1	-173	176.3	0	0	110.4	L62 Q63	E59-L62 PolarHBondContact O-N 2.92Å; E59-Q63 WeakPolarHBondContact O-CB 3.32Å; E59-Q63 VanDerWaalsContact O-CG 3.25Å; E59-Q63 WeakPolarHBondContact O-CG 3.36Å; E59-Q63 PolarHBondContact O-N 3.3Å
60	E	80.6	Confident	79.3	Confident	53 Å²	53	71.2 Å²	71.2	25%	0.248	37%	0.371	C	S	.	.	H	α-helix	trans	-60.5	-48.5	176.8	-67.5	177.8	178.6	0	0	111.9	H57 L62 Q63 I64 Y453	H57-E60 PolarHBondContact O-N 2.75Å; E60-L62 PolarHBondContact O-N 3.46Å; E60-Q63 WeakPolarHBondContact O-CB 3.24Å; E60-Q63 PolarHBondContact O-N 3.06Å; E60-I64 VanDerWaalsContact O-CG1 3.27Å; E60-I64 WeakPolarHBondContact O-CG1 3.36Å; E60-I64 PolarHBondContact O-N 2.98Å; E60-Y453 PolarHBondContact OE1-OH 3.33Å
61	M	79.4	Confident	79.4	Confident	29 Å²	29	69.1 Å²	69.1	14%	0.143	36%	0.363	C	S	.	.	H	α-helix	trans	-66.7	-36.2	177.5	-72.6	-172	-66.8	0	0	112.7	V49 V53 H57 Q63 I64 L65	V49-M61 HydrophobicContact CG1-CB 3.89Å; V49-M61 HydrophobicContact CG1-CE 3.83Å; V53-M61 HydrophobicContact CB-CE 3.36Å; V53-M61 HydrophobicContact CG1-CE 3.16Å; V53-M61 HydrophobicContact CG1-SD 4.34Å; V53-M61 HydrophobicContact CG2-CE 3.6Å; V53-M61 HydrophobicContact CG2-SD 4.46Å; H57-M61 HydrophobicContact CB-CE 4.45Å; H57-M61 WeakPolarHBondContact O-CB 3.48Å; H57-M61 WeakPolarHBondContact O-CE 3.4Å; H57-M61 VanDerWaalsContact O-CG 3.31Å; H57-M61 WeakPolarHBondContact O-CG 3.39Å; H57-M61 PolarHBondContact O-N 3Å; M61-Q63 VanDerWaalsContact C-N 3.31Å; M61-I64 PolarHBondContact O-N 3.46Å; M61-L65 VanDerWaalsContact O-CB 3.3Å; M61-L65 WeakPolarHBondContact O-CB 3.33Å; M61-L65 PolarHBondContact O-N 3.46Å
62	L	83.2	Confident	79.6	Confident	62 Å²	62	66.1 Å²	66.1	33%	0.325	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-37	176.3	-174.8	62.8	0	0	0	110.8	I46 N58 E59 E60 L65 T66	I46-L62 HydrophobicContact CG1-CD1 4.27Å; I46-L62 HydrophobicContact CG2-CD1 4.1Å; N58-L62 VanDerWaalsContact O-CB 3.24Å; N58-L62 WeakPolarHBondContact O-CB 3.41Å; N58-L62 PolarHBondContact O-N 3.1Å; E59-L62 PolarHBondContact O-N 2.92Å; E60-L62 PolarHBondContact O-N 3.46Å; L62-L65 HydrophobicContact CD1-CD2 4.48Å; L62-T66 WeakPolarHBondContact O-CB 3.31Å; L62-T66 PolarHBondContact O-N 3.29Å; L62-T66 PolarHBondContact O-OG1 2.92Å
63	Q	83.1	Confident	79.9	Confident	110 Å²	110	67.4 Å²	67.4	51%	0.514	36%	0.361	S	S	.	.	H	α-helix	trans	-62.8	-48.6	170.8	-75.1	176.4	-0.5	0	0	111.1	E59 E60 M61 L65 T66 I67	E59-Q63 WeakPolarHBondContact O-CB 3.32Å; E59-Q63 VanDerWaalsContact O-CG 3.25Å; E59-Q63 WeakPolarHBondContact O-CG 3.36Å; E59-Q63 PolarHBondContact O-N 3.3Å; E60-Q63 WeakPolarHBondContact O-CB 3.24Å; E60-Q63 PolarHBondContact O-N 3.06Å; M61-Q63 VanDerWaalsContact C-N 3.31Å; Q63-L65 PolarHBondContact O-N 3.34Å; Q63-T66 PolarHBondContact O-N 3.27Å; Q63-I67 VanDerWaalsContact O-CG1 3.3Å; Q63-I67 WeakPolarHBondContact O-CG1 3.27Å; Q63-I67 PolarHBondContact O-N 3.42Å
64	I	83.1	Confident	80.5	Confident	97 Å²	97	73.2 Å²	73.2	50%	0.497	39%	0.385	S	S	.	.	H	α-helix	trans	-58	-47.7	176	-68.4	164.5	0	0	0	110.4	E60 M61 T66 I67 E68	E60-I64 VanDerWaalsContact O-CG1 3.27Å; E60-I64 WeakPolarHBondContact O-CG1 3.36Å; E60-I64 PolarHBondContact O-N 2.98Å; M61-I64 PolarHBondContact O-N 3.46Å; I64-T66 VanDerWaalsContact C-N 3.28Å; I64-T66 PolarHBondContact O-N 3.4Å; I64-I67 PolarHBondContact O-N 3.19Å; I64-E68 HydrophobicContact CG2-CG 4.1Å; I64-E68 VanDerWaalsContact O-CB 3.29Å; I64-E68 WeakPolarHBondContact O-CB 3.45Å; I64-E68 WeakPolarHBondContact O-CG 3.39Å; I64-E68 PolarHBondContact O-N 3.26Å
65	L	80.1	Confident	81.4	Confident	19 Å²	19	74.5 Å²	74.5	10%	0.099	38%	0.384	C	S	.	.	H	α-helix	trans	-58.4	-41.7	177.7	177.3	59.4	0	0	0	111.7	M1 I46 M61 L62 Q63 L69	M1-L65 HydrophobicContact CE-CD1 3.8Å; M1-L65 HydrophobicContact SD-CD1 3.76Å; M1-L65 HydrophobicContact SD-CD2 4.21Å; M1-L65 HydrophobicContact SD-CG 4.5Å; I46-L65 HydrophobicContact CG1-CD2 3.95Å; M61-L65 VanDerWaalsContact O-CB 3.3Å; M61-L65 WeakPolarHBondContact O-CB 3.33Å; M61-L65 PolarHBondContact O-N 3.46Å; L62-L65 HydrophobicContact CD1-CD2 4.48Å; Q63-L65 PolarHBondContact O-N 3.34Å; L65-L69 VanDerWaalsContact O-CB 3.31Å; L65-L69 WeakPolarHBondContact O-CB 3.49Å; L65-L69 PolarHBondContact O-N 2.8Å
66	T	83.5	Confident	82.4	Confident	77 Å²	77	72.5 Å²	72.5	47%	0.472	36%	0.363	S	S	.	.	H	α-helix	trans	-65.7	-47.1	178	-58	0	0	0	0	110.9	L62 Q63 I64 L69 T70	L62-T66 WeakPolarHBondContact O-CB 3.31Å; L62-T66 PolarHBondContact O-N 3.29Å; L62-T66 PolarHBondContact O-OG1 2.92Å; Q63-T66 PolarHBondContact O-N 3.27Å; I64-T66 VanDerWaalsContact C-N 3.28Å; I64-T66 PolarHBondContact O-N 3.4Å; T66-L69 PolarHBondContact O-N 3.41Å; T66-T70 WeakPolarHBondContact O-CG2 3.34Å; T66-T70 PolarHBondContact O-N 2.84Å; T66-T70 PolarHBondContact O-OG1 3.39Å
67	I	83.6	Confident	83.5	Confident	99 Å²	99	68.3 Å²	68.3	51%	0.508	34%	0.341	S	S	.	.	H	α-helix	trans	-58.5	-51.4	177.3	-68.7	164.8	0	0	0	110.1	Q63 I64 L69 T70 E71	Q63-I67 VanDerWaalsContact O-CG1 3.3Å; Q63-I67 WeakPolarHBondContact O-CG1 3.27Å; Q63-I67 PolarHBondContact O-N 3.42Å; I64-I67 PolarHBondContact O-N 3.19Å; I67-L69 VanDerWaalsContact C-N 3.31Å; I67-L69 PolarHBondContact O-N 2.93Å; I67-T70 WeakPolarHBondContact CA-OG1 3.41Å; I67-T70 PolarHBondContact O-N 2.94Å; I67-T70 VanDerWaalsContact O-N 3.09Å; I67-T70 PolarHBondContact O-OG1 3.02Å; I67-E71 HydrophobicContact CG2-CG 4.41Å; I67-E71 PolarHBondContact O-N 2.89Å
68	E	81.8	Confident	84.7	Confident	83 Å²	83	63.8 Å²	63.8	39%	0.388	32%	0.32	S	S	.	.	H	α-helix	trans	-56.3	-43.2	178	-75.2	-68.8	166.6	0	0	112.6	I64 L72 Y479	I64-E68 HydrophobicContact CG2-CG 4.1Å; I64-E68 VanDerWaalsContact O-CB 3.29Å; I64-E68 WeakPolarHBondContact O-CB 3.45Å; I64-E68 WeakPolarHBondContact O-CG 3.39Å; I64-E68 PolarHBondContact O-N 3.26Å; E68-L72 VanDerWaalsContact O-CB 3.24Å; E68-L72 WeakPolarHBondContact O-CB 3.47Å; E68-L72 PolarHBondContact O-N 3.35Å; E68-Y479 VanDerWaalsContact CD-OH 3.28Å; E68-Y479 PolarHBondContact OE1-OH 3.34Å; E68-Y479 WeakPolarHBondContact OE2-CE1 3.35Å; E68-Y479 VanDerWaalsContact OE2-CZ 3.24Å; E68-Y479 PolarHBondContact OE2-OH 2.72Å
69	L	82	Confident	85.5	Confident	31 Å²	31	68.3 Å²	68.3	16%	0.162	34%	0.338	C	S	.	.	H	α-helix	trans	-67.9	-39.3	177.5	-166.1	66.1	0	0	0	111.8	L42 L65 T66 I67 N73 I229 P231	L42-L69 HydrophobicContact CD1-CD2 4.06Å; L42-L69 HydrophobicContact CD2-CD2 3.56Å; L42-L69 HydrophobicContact CG-CD2 4.46Å; L65-L69 VanDerWaalsContact O-CB 3.31Å; L65-L69 WeakPolarHBondContact O-CB 3.49Å; L65-L69 PolarHBondContact O-N 2.8Å; T66-L69 PolarHBondContact O-N 3.41Å; I67-L69 VanDerWaalsContact C-N 3.31Å; I67-L69 PolarHBondContact O-N 2.93Å; L69-N73 WeakPolarHBondContact O-CB 3.41Å; L69-N73 PolarHBondContact O-N 3.02Å; L69-I229 VanDerWaalsContact CD1-O 3.23Å; L69-I229 WeakPolarHBondContact CD1-O 3.45Å; L69-P231 HydrophobicContact CD2-CG 4.42Å
70	T	84.6	Confident	86.2	Confident	76 Å²	76	67 Å²	67	47%	0.466	34%	0.335	S	S	.	.	H	α-helix	trans	-66.5	-42.3	176.7	55.4	0	0	0	0	112.2	T66 I67 N73 F74	T66-T70 WeakPolarHBondContact O-CG2 3.34Å; T66-T70 PolarHBondContact O-N 2.84Å; T66-T70 PolarHBondContact O-OG1 3.39Å; I67-T70 WeakPolarHBondContact CA-OG1 3.41Å; I67-T70 PolarHBondContact O-N 2.94Å; I67-T70 VanDerWaalsContact O-N 3.09Å; I67-T70 PolarHBondContact O-OG1 3.02Å; T70-N73 PolarHBondContact O-N 2.87Å; T70-F74 VanDerWaalsContact O-CB 3.28Å; T70-F74 WeakPolarHBondContact O-CB 3.28Å; T70-F74 PolarHBondContact O-N 2.97Å
71	E	84.8	Confident	87	Confident	81 Å²	81	70.1 Å²	70.1	38%	0.379	35%	0.353	S	S	.	.	H	α-helix	trans	-65.3	-44.6	175.6	-74.7	-59.9	145.6	0	0	111.4	I67 N73 F74 H75	I67-E71 HydrophobicContact CG2-CG 4.41Å; I67-E71 PolarHBondContact O-N 2.89Å; E71-N73 VanDerWaalsContact C-N 3.32Å; E71-N73 PolarHBondContact O-N 3.17Å; E71-F74 PolarHBondContact O-N 2.95Å; E71-H75 WeakPolarHBondContact O-CB 3.5Å; E71-H75 PolarHBondContact O-CD2 3.16Å; E71-H75 PolarHBondContact O-N 2.78Å; E71-H75 IonicContact OE2-CD2 3.46Å; E71-H75 IonicContact OE2-NE2 2.67Å; E71-H75 PolarHBondContact OE2-NE2 3.45Å
72	L	84.7	Confident	87.8	Confident	55 Å²	55	71.2 Å²	71.2	29%	0.288	36%	0.358	S	S	.	.	H	α-helix	trans	-58.3	-44.7	174.1	-177.8	71.5	0	0	0	111.4	E68 N76 W147 Y479	E68-L72 VanDerWaalsContact O-CB 3.24Å; E68-L72 WeakPolarHBondContact O-CB 3.47Å; E68-L72 PolarHBondContact O-N 3.35Å; L72-N76 WeakPolarHBondContact CD1-ND2 3.47Å; L72-N76 WeakPolarHBondContact O-CB 3.49Å; L72-N76 PolarHBondContact O-N 2.95Å; L72-N76 PolarHBondContact O-ND2 3.4Å; L72-W147 HydrophobicContact CG-CH2 4.28Å; L72-Y479 HydrophobicContact CB-CD1 3.99Å; L72-Y479 HydrophobicContact CB-CE1 4.4Å; L72-Y479 HydrophobicContact CD1-CD1 3.75Å
73	N	87.2	Confident	88.5	Confident	38 Å²	38	69 Å²	69	20%	0.203	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-45.3	177.4	-173.1	68.5	0	0	0	111.1	L69 T70 E71 H75 N76 L77 W147	L69-N73 WeakPolarHBondContact O-CB 3.41Å; L69-N73 PolarHBondContact O-N 3.02Å; T70-N73 PolarHBondContact O-N 2.87Å; E71-N73 VanDerWaalsContact C-N 3.32Å; E71-N73 PolarHBondContact O-N 3.17Å; N73-H75 PolarHBondContact O-N 2.91Å; N73-N76 PolarHBondContact O-N 2.96Å; N73-L77 WeakPolarHBondContact O-CG 3.3Å; N73-L77 PolarHBondContact O-N 3.27Å; N73-W147 HydrophobicContact CB-CZ3 4.49Å
74	F	89.3	Confident	89.2	Confident	136 Å²	136	67.9 Å²	67.9	60%	0.596	34%	0.343	S	S	*	.	H	α-helix	trans	-59	-48.9	179.6	-178.5	-105.6	0	0	0	112.3	T70 E71 N76 L77	T70-F74 VanDerWaalsContact O-CB 3.28Å; T70-F74 WeakPolarHBondContact O-CB 3.28Å; T70-F74 PolarHBondContact O-N 2.97Å; E71-F74 PolarHBondContact O-N 2.95Å; F74-N76 VanDerWaalsContact C-N 3.29Å; F74-N76 PolarHBondContact O-N 3.26Å; F74-L77 PolarHBondContact O-N 3.29Å
75	H	89	Confident	89.9	Confident	53 Å²	53	68.1 Å²	68.1	25%	0.245	34%	0.344	C	S	.	.	H	α-helix	trans	-69.8	-22.8	-178.8	-77.9	-59.1	0	0	0	114.4	E71 N73	E71-H75 WeakPolarHBondContact O-CB 3.5Å; E71-H75 PolarHBondContact O-CD2 3.16Å; E71-H75 PolarHBondContact O-N 2.78Å; E71-H75 IonicContact OE2-CD2 3.46Å; E71-H75 IonicContact OE2-NE2 2.67Å; E71-H75 PolarHBondContact OE2-NE2 3.45Å; N73-H75 PolarHBondContact O-N 2.91Å
76	N	91.1	Very high	90.7	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.011	34%	0.342	C	S	.	.	H	α-helix	trans	-93.6	-10.4	-179.8	-74.8	-53.5	0	0	0	115	L72 N73 F74 W147 Y479 G482 R483	L72-N76 WeakPolarHBondContact CD1-ND2 3.47Å; L72-N76 WeakPolarHBondContact O-CB 3.49Å; L72-N76 PolarHBondContact O-N 2.95Å; L72-N76 PolarHBondContact O-ND2 3.4Å; N73-N76 PolarHBondContact O-N 2.96Å; F74-N76 VanDerWaalsContact C-N 3.29Å; F74-N76 PolarHBondContact O-N 3.26Å; N76-W147 HydrophobicContact CB-CD2 3.42Å; N76-W147 VanDerWaalsContact CB-CD2 3.42Å; N76-W147 HydrophobicContact CB-CE3 3.59Å; N76-W147 HydrophobicContact CB-CG 4.11Å; N76-W147 HydrophobicContact CB-CH2 3.6Å; N76-W147 HydrophobicContact CB-CZ2 3.43Å; N76-W147 VanDerWaalsContact CB-CZ2 3.43Å; N76-W147 HydrophobicContact CB-CZ3 3.67Å; N76-W147 VanDerWaalsContact ND2-CH2 3.31Å; N76-W147 WeakPolarHBondContact ND2-CH2 3.49Å; N76-Y479 PolarHBondContact ND2-O 3.44Å; N76-Y479 PolarHBondContact OD1-O 3.06Å; N76-G482 WeakPolarHBondContact OD1-CA 3.48Å; N76-G482 PolarHBondContact OD1-N 2.86Å; N76-R483 PolarHBondContact OD1-N 3.05Å
77	L	93.3	Very high	91.4	Very high	48 Å²	48	66.8 Å²	66.8	25%	0.251	33%	0.334	S	S	.	.	S	Bend	trans	-63.1	138	169.4	-73	157.2	0	0	0	110.4	N73 F74 W147 H148 R483	N73-L77 WeakPolarHBondContact O-CG 3.3Å; N73-L77 PolarHBondContact O-N 3.27Å; F74-L77 PolarHBondContact O-N 3.29Å; L77-W147 HydrophobicContact CD2-CB 4.41Å; L77-W147 WeakPolarHBondContact CD2-O 3.14Å; L77-H148 VanDerWaalsContact CD2-CE1 3.45Å; L77-H148 WeakPolarHBondContact CD2-CE1 3.44Å; L77-H148 WeakPolarHBondContact CD2-ND1 3.2Å; L77-R483 WeakPolarHBondContact O-CD 3.23Å
78	L	95.1	Very high	92.1	Very high	7 Å²	7	65.4 Å²	65.4	4%	0.037	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-65	142.3	164.5	-86.6	64.1	0	0	0	109	E82 L83 L86 L145 H148 R483 T486 L487	L78-E82 HydrophobicContact CB-CB 4.2Å; L78-E82 HydrophobicContact CD2-CB 4.29Å; L78-E82 HydrophobicContact CG-CB 4.32Å; L78-L83 HydrophobicContact CB-CB 4.35Å; L78-L86 HydrophobicContact CD2-CD2 3.79Å; L78-L145 HydrophobicContact CD2-CD2 4.44Å; L78-H148 PolarHBondContact N-NE2 3.34Å; L78-H148 VanDerWaalsContact N-NE2 3.17Å; L78-H148 PolarHBondContact O-CE1 3.05Å; L78-R483 HydrophobicContact CD1-CG 4.27Å; L78-T486 HydrophobicContact CD1-CG2 3.53Å; L78-L487 HydrophobicContact CD2-CD2 3.89Å; L78-L487 HydrophobicContact CG-CD2 4.16Å
79	K	95.1	Very high	92.9	Very high	130 Å²	130	64.9 Å²	64.9	57%	0.565	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-59.5	149.7	169.3	-68.4	177.5	179.4	175	0	109.1	N81 E82 L83 R483	K79-N81 PolarHBondContact O-N 2.83Å; K79-N81 VanDerWaalsContact O-N 3.16Å; K79-E82 HydrophobicContact CB-CB 4.44Å; K79-E82 HydrophobicContact CB-CG 4.1Å; K79-E82 WeakPolarHBondContact CB-OE2 3.2Å; K79-E82 PolarHBondContact N-OE2 3.49Å; K79-E82 WeakPolarHBondContact O-CA 3.16Å; K79-E82 WeakPolarHBondContact O-CB 3.43Å; K79-E82 PolarHBondContact O-N 2.88Å; K79-L83 PolarHBondContact O-N 3.43Å; K79-R483 VanDerWaalsContact CD-NH2 3.26Å
80	L	95.6	Very high	93.6	Very high	120 Å²	120	63.4 Å²	63.4	63%	0.628	32%	0.324	S	S	*	.	H	α-helix	trans	-51	-44.8	-180	-177.5	61.3	0	0	0	112.5	E82 L83 I84	L80-E82 PolarHBondContact O-N 3.34Å; L80-L83 PolarHBondContact O-N 2.91Å; L80-I84 HydrophobicContact CD1-CD1 3.89Å; L80-I84 HydrophobicContact CD1-CG1 4.21Å; L80-I84 HydrophobicContact CG-CD1 3.82Å; L80-I84 HydrophobicContact CG-CG1 4.5Å; L80-I84 VanDerWaalsContact O-CG1 3.31Å; L80-I84 WeakPolarHBondContact O-CG1 3.41Å; L80-I84 PolarHBondContact O-N 3.28Å
81	N	97.3	Very high	94.2	Very high	119 Å²	119	62.9 Å²	62.9	64%	0.636	32%	0.32	S	S	*	.	H	α-helix	trans	-63	-41	177.5	-63.1	-5.3	0	0	0	112.4	K79 I85	K79-N81 PolarHBondContact O-N 2.83Å; K79-N81 VanDerWaalsContact O-N 3.16Å; N81-I85 WeakPolarHBondContact O-CB 3.3Å; N81-I85 WeakPolarHBondContact O-CD1 3.47Å; N81-I85 WeakPolarHBondContact O-CG1 3.32Å; N81-I85 PolarHBondContact O-N 2.76Å
82	E	96.4	Very high	94.9	Very high	52 Å²	52	63.5 Å²	63.5	24%	0.243	33%	0.33	C	S	.	.	H	α-helix	trans	-65.2	-43	177.5	-65.2	171.7	151.3	0	0	110.9	L78 K79 L80 L86 R483	L78-E82 HydrophobicContact CB-CB 4.2Å; L78-E82 HydrophobicContact CD2-CB 4.29Å; L78-E82 HydrophobicContact CG-CB 4.32Å; K79-E82 HydrophobicContact CB-CB 4.44Å; K79-E82 HydrophobicContact CB-CG 4.1Å; K79-E82 WeakPolarHBondContact CB-OE2 3.2Å; K79-E82 PolarHBondContact N-OE2 3.49Å; K79-E82 WeakPolarHBondContact O-CA 3.16Å; K79-E82 WeakPolarHBondContact O-CB 3.43Å; K79-E82 PolarHBondContact O-N 2.88Å; L80-E82 PolarHBondContact O-N 3.34Å; E82-L86 WeakPolarHBondContact O-CB 3.01Å; E82-L86 PolarHBondContact O-N 3.39Å; E82-R483 IonicContact OE1-CZ 3.65Å; E82-R483 IonicContact OE1-NE 2.71Å; E82-R483 IonicContact OE1-NH2 3.4Å; E82-R483 PolarHBondContact OE1-NH2 2.92Å; E82-R483 IonicContact OE2-CZ 3.99Å; E82-R483 IonicContact OE2-NE 2.81Å; E82-R483 PolarHBondContact OE2-NE 2.86Å; E82-R483 IonicContact OE2-NH2 3.99Å; E82-R483 PolarHBondContact OE2-NH2 3.09Å
83	L	97.6	Very high	95.5	Very high	17 Å²	17	62.4 Å²	62.4	9%	0.089	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-49	177.6	-179.4	66.4	0	0	0	111.6	L78 K79 L80 L86 I87 L145	L78-L83 HydrophobicContact CB-CB 4.35Å; K79-L83 PolarHBondContact O-N 3.43Å; L80-L83 PolarHBondContact O-N 2.91Å; L83-L86 PolarHBondContact O-N 3.34Å; L83-I87 HydrophobicContact CD1-CD1 3.85Å; L83-I87 HydrophobicContact CD1-CG1 4.38Å; L83-I87 HydrophobicContact CG-CD1 3.92Å; L83-I87 VanDerWaalsContact O-CG1 3.31Å; L83-I87 WeakPolarHBondContact O-CG1 3.46Å; L83-I87 PolarHBondContact O-N 2.72Å; L83-L145 HydrophobicContact CD1-CD1 3.93Å; L83-L145 HydrophobicContact CD1-CD2 3.71Å; L83-L145 HydrophobicContact CD1-CG 4.46Å
84	I	97.9	Very high	96	Very high	86 Å²	86	61.6 Å²	61.6	44%	0.441	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-50	179.8	-67.8	169	0	0	0	110.5	L80 L86 I87 C88	L80-I84 HydrophobicContact CD1-CD1 3.89Å; L80-I84 HydrophobicContact CD1-CG1 4.21Å; L80-I84 HydrophobicContact CG-CD1 3.82Å; L80-I84 HydrophobicContact CG-CG1 4.5Å; L80-I84 VanDerWaalsContact O-CG1 3.31Å; L80-I84 WeakPolarHBondContact O-CG1 3.41Å; L80-I84 PolarHBondContact O-N 3.28Å; I84-L86 VanDerWaalsContact C-N 3.3Å; I84-L86 PolarHBondContact O-N 2.89Å; I84-I87 PolarHBondContact O-N 3.44Å; I84-C88 WeakPolarHBondContact O-CB 3.24Å; I84-C88 PolarHBondContact O-N 3.04Å; I84-C88 PolarHBondContact O-SG 2.94Å
85	I	97.9	Very high	96.4	Very high	101 Å²	101	60 Å²	60	52%	0.518	32%	0.316	S	S	.	.	H	α-helix	trans	-58.3	-45.4	179.3	-70.5	167.6	0	0	0	110.4	N81 C88 I89	N81-I85 WeakPolarHBondContact O-CB 3.3Å; N81-I85 WeakPolarHBondContact O-CD1 3.47Å; N81-I85 WeakPolarHBondContact O-CG1 3.32Å; N81-I85 PolarHBondContact O-N 2.76Å; I85-C88 PolarHBondContact O-N 3.29Å; I85-I89 HydrophobicContact CG2-CD1 3.64Å; I85-I89 HydrophobicContact CG2-CG1 4.36Å; I85-I89 VanDerWaalsContact O-CG1 3.27Å; I85-I89 WeakPolarHBondContact O-CG1 3.33Å; I85-I89 PolarHBondContact O-N 3.35Å
86	L	97.4	Very high	96.8	Very high	11 Å²	11	62.8 Å²	62.8	6%	0.058	33%	0.328	C	S	.	.	H	α-helix	trans	-58.9	-51.5	178.6	178.4	67	0	0	0	111.6	L78 E82 L83 I84 C88 I89 Y90 L141 L145 L494	L78-L86 HydrophobicContact CD2-CD2 3.79Å; E82-L86 WeakPolarHBondContact O-CB 3.01Å; E82-L86 PolarHBondContact O-N 3.39Å; L83-L86 PolarHBondContact O-N 3.34Å; I84-L86 VanDerWaalsContact C-N 3.3Å; I84-L86 PolarHBondContact O-N 2.89Å; L86-C88 VanDerWaalsContact C-N 3.35Å; L86-C88 PolarHBondContact O-N 3.1Å; L86-I89 PolarHBondContact O-N 2.91Å; L86-Y90 HydrophobicContact CD1-CD2 3.64Å; L86-Y90 HydrophobicContact CD1-CE2 3.45Å; L86-Y90 VanDerWaalsContact CD1-CE2 3.45Å; L86-Y90 HydrophobicContact CG-CD2 4.15Å; L86-Y90 HydrophobicContact CG-CE2 4.29Å; L86-Y90 WeakPolarHBondContact O-CD2 3.44Å; L86-Y90 PolarHBondContact O-N 2.93Å; L86-L141 HydrophobicContact CD2-CD1 4.35Å; L86-L141 HydrophobicContact CG-CD1 4.37Å; L86-L145 HydrophobicContact CD2-CD2 3.98Å; L86-L494 HydrophobicContact CD1-CD1 4.44Å
87	I	97.7	Very high	97.1	Very high	57 Å²	57	62.7 Å²	62.7	29%	0.292	33%	0.327	S	S	.	.	H	α-helix	trans	-61.9	-43	180	-68.6	169.6	0	0	0	110.9	L83 I84 Y90 T91 L145	L83-I87 HydrophobicContact CD1-CD1 3.85Å; L83-I87 HydrophobicContact CD1-CG1 4.38Å; L83-I87 HydrophobicContact CG-CD1 3.92Å; L83-I87 VanDerWaalsContact O-CG1 3.31Å; L83-I87 WeakPolarHBondContact O-CG1 3.46Å; L83-I87 PolarHBondContact O-N 2.72Å; I84-I87 PolarHBondContact O-N 3.44Å; I87-Y90 PolarHBondContact O-N 3.15Å; I87-T91 VanDerWaalsContact O-CB 3.31Å; I87-T91 WeakPolarHBondContact O-CB 3.45Å; I87-T91 PolarHBondContact O-N 2.95Å; I87-T91 PolarHBondContact O-OG1 3.45Å; I87-L145 HydrophobicContact CG1-CD1 4.42Å
88	C	98.3	Very high	97.3	Very high	70 Å²	70	61 Å²	61	47%	0.473	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-49.8	177	-72.1	0	0	0	0	111.6	I84 I85 L86 T91 T92	I84-C88 WeakPolarHBondContact O-CB 3.24Å; I84-C88 PolarHBondContact O-N 3.04Å; I84-C88 PolarHBondContact O-SG 2.94Å; I85-C88 PolarHBondContact O-N 3.29Å; L86-C88 VanDerWaalsContact C-N 3.35Å; L86-C88 PolarHBondContact O-N 3.1Å; C88-T91 PolarHBondContact O-N 3.46Å; C88-T92 PolarHBondContact O-N 3.25Å; C88-T92 PolarHBondContact O-OG1 3.45Å; C88-T92 VanDerWaalsContact O-OG1 3.05Å
89	I	98	Very high	97.4	Very high	73 Å²	73	64.6 Å²	64.6	37%	0.374	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-47.7	179.8	-66.2	169.8	0	0	0	110.7	I85 L86 T91 T92 M93 L494	I85-I89 HydrophobicContact CG2-CD1 3.64Å; I85-I89 HydrophobicContact CG2-CG1 4.36Å; I85-I89 VanDerWaalsContact O-CG1 3.27Å; I85-I89 WeakPolarHBondContact O-CG1 3.33Å; I85-I89 PolarHBondContact O-N 3.35Å; L86-I89 PolarHBondContact O-N 2.91Å; I89-T91 VanDerWaalsContact C-N 3.34Å; I89-T91 PolarHBondContact O-N 3.25Å; I89-T92 PolarHBondContact O-N 2.98Å; I89-M93 HydrophobicContact CG2-CG 4.35Å; I89-M93 HydrophobicContact CG2-SD 3.94Å; I89-M93 WeakPolarHBondContact O-CB 3.48Å; I89-M93 VanDerWaalsContact O-CG 3.31Å; I89-M93 WeakPolarHBondContact O-CG 3.36Å; I89-M93 PolarHBondContact O-N 3.45Å; I89-L494 HydrophobicContact CG2-CD1 4.21Å; I89-L494 HydrophobicContact CG2-CD2 3.59Å
90	Y	97.7	Very high	97.4	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.1	-48.4	177.3	-97.4	-100.8	0	0	0	111.8	L86 I87 T92 M93 I94 L141 S490 L493 L494 L497	L86-Y90 HydrophobicContact CD1-CD2 3.64Å; L86-Y90 HydrophobicContact CD1-CE2 3.45Å; L86-Y90 VanDerWaalsContact CD1-CE2 3.45Å; L86-Y90 HydrophobicContact CG-CD2 4.15Å; L86-Y90 HydrophobicContact CG-CE2 4.29Å; L86-Y90 WeakPolarHBondContact O-CD2 3.44Å; L86-Y90 PolarHBondContact O-N 2.93Å; I87-Y90 PolarHBondContact O-N 3.15Å; Y90-T92 PolarHBondContact O-N 3.41Å; Y90-M93 PolarHBondContact O-N 2.93Å; Y90-I94 HydrophobicContact CD1-CD1 4.42Å; Y90-I94 WeakPolarHBondContact O-CB 3.42Å; Y90-I94 WeakPolarHBondContact O-CD1 3.47Å; Y90-I94 VanDerWaalsContact O-CG1 3.25Å; Y90-I94 WeakPolarHBondContact O-CG1 3.33Å; Y90-I94 PolarHBondContact O-N 2.92Å; Y90-L141 HydrophobicContact CD1-CB 4.16Å; Y90-L141 HydrophobicContact CD1-CD1 4.15Å; Y90-L141 HydrophobicContact CD1-CD2 4.18Å; Y90-L141 HydrophobicContact CD1-CG 4.4Å; Y90-L141 HydrophobicContact CD2-CD1 4.12Å; Y90-L141 HydrophobicContact CE1-CB 4.33Å; Y90-L141 HydrophobicContact CE1-CD1 4.3Å; Y90-L141 HydrophobicContact CE2-CD1 4.29Å; Y90-L141 HydrophobicContact CG-CD1 4.04Å; Y90-L141 HydrophobicContact CG-CD2 4.07Å; Y90-S490 PolarHBondContact OH-O 3.02Å; Y90-L493 WeakPolarHBondContact OH-CB 3.48Å; Y90-L494 HydrophobicContact CD2-CD2 3.51Å; Y90-L494 HydrophobicContact CD2-CG 4.06Å; Y90-L494 HydrophobicContact CE2-CD1 4.06Å; Y90-L494 HydrophobicContact CE2-CD2 3.43Å; Y90-L494 VanDerWaalsContact CE2-CD2 3.43Å; Y90-L494 HydrophobicContact CE2-CG 3.47Å; Y90-L494 VanDerWaalsContact CE2-CG 3.47Å; Y90-L494 HydrophobicContact CG-CD2 4.18Å; Y90-L497 HydrophobicContact CD1-CD1 3.79Å; Y90-L497 HydrophobicContact CE1-CD1 3.88Å; Y90-L497 HydrophobicContact CG-CD1 4.45Å
91	T	97.7	Very high	97.4	Very high	64 Å²	64	53.3 Å²	53.3	39%	0.393	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-47	-178.2	-55.6	0	0	0	0	110.8	I87 C88 I89 M93 I94 L95	I87-T91 VanDerWaalsContact O-CB 3.31Å; I87-T91 WeakPolarHBondContact O-CB 3.45Å; I87-T91 PolarHBondContact O-N 2.95Å; I87-T91 PolarHBondContact O-OG1 3.45Å; C88-T91 PolarHBondContact O-N 3.46Å; I89-T91 VanDerWaalsContact C-N 3.34Å; I89-T91 PolarHBondContact O-N 3.25Å; T91-M93 PolarHBondContact O-N 2.86Å; T91-I94 PolarHBondContact O-N 2.83Å; T91-L95 HydrophobicContact CG2-CD1 4.07Å; T91-L95 HydrophobicContact CG2-CG 4.49Å; T91-L95 WeakPolarHBondContact O-CB 3.31Å; T91-L95 VanDerWaalsContact O-CG 3.26Å; T91-L95 WeakPolarHBondContact O-CG 3.47Å; T91-L95 PolarHBondContact O-N 3.22Å
92	T	97.9	Very high	97.4	Very high	95 Å²	95	52.7 Å²	52.7	58%	0.583	29%	0.29	S	S	*	.	H	α-helix	trans	-61.5	-43.1	177.5	-58.4	0	0	0	0	111.9	C88 I89 Y90 L95 F96	C88-T92 PolarHBondContact O-N 3.25Å; C88-T92 PolarHBondContact O-OG1 3.45Å; C88-T92 VanDerWaalsContact O-OG1 3.05Å; I89-T92 PolarHBondContact O-N 2.98Å; Y90-T92 PolarHBondContact O-N 3.41Å; T92-L95 PolarHBondContact O-N 2.89Å; T92-F96 VanDerWaalsContact O-CB 3.3Å; T92-F96 WeakPolarHBondContact O-CB 3.31Å; T92-F96 PolarHBondContact O-N 3.4Å
93	M	97.5	Very high	97.3	Very high	32 Å²	32	51.8 Å²	51.8	16%	0.158	29%	0.286	C	S	.	.	H	α-helix	trans	-67.9	-41.8	178.7	-70.9	-173.5	78.7	0	0	112.5	I89 Y90 T91 L95 F96 G97 L494 L497 V498 C501	I89-M93 HydrophobicContact CG2-CG 4.35Å; I89-M93 HydrophobicContact CG2-SD 3.94Å; I89-M93 WeakPolarHBondContact O-CB 3.48Å; I89-M93 VanDerWaalsContact O-CG 3.31Å; I89-M93 WeakPolarHBondContact O-CG 3.36Å; I89-M93 PolarHBondContact O-N 3.45Å; Y90-M93 PolarHBondContact O-N 2.93Å; T91-M93 PolarHBondContact O-N 2.86Å; M93-L95 PolarHBondContact O-N 3.27Å; M93-F96 PolarHBondContact O-N 3.35Å; M93-G97 PolarHBondContact O-N 3.45Å; M93-L494 HydrophobicContact SD-CD2 3.61Å; M93-L497 HydrophobicContact CB-CB 4.32Å; M93-L497 HydrophobicContact CB-CD1 4.26Å; M93-L497 HydrophobicContact CE-CB 3.57Å; M93-L497 HydrophobicContact SD-CB 4.23Å; M93-V498 HydrophobicContact CE-CB 4.2Å; M93-V498 HydrophobicContact CE-CG2 3.5Å; M93-V498 VanDerWaalsContact CE-N 3.3Å; M93-C501 PolarHBondContact O-SG 2.85Å
94	I	98.1	Very high	97.2	Very high	20 Å²	20	51 Å²	51	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-46.8	175.4	-74.9	164.5	0	0	0	110.6	Y90 T91 S98 C133 Q137 P138 L497	Y90-I94 HydrophobicContact CD1-CD1 4.42Å; Y90-I94 WeakPolarHBondContact O-CB 3.42Å; Y90-I94 WeakPolarHBondContact O-CD1 3.47Å; Y90-I94 VanDerWaalsContact O-CG1 3.25Å; Y90-I94 WeakPolarHBondContact O-CG1 3.33Å; Y90-I94 PolarHBondContact O-N 2.92Å; T91-I94 PolarHBondContact O-N 2.83Å; I94-S98 VanDerWaalsContact O-CB 3.24Å; I94-S98 WeakPolarHBondContact O-CB 3.05Å; I94-S98 PolarHBondContact O-N 3.07Å; I94-S98 PolarHBondContact O-OG 3.43Å; I94-C133 HydrophobicContact CG2-CB 4.45Å; I94-C133 WeakPolarHBondContact CG2-O 3.48Å; I94-Q137 HydrophobicContact CD1-CB 4.01Å; I94-Q137 HydrophobicContact CG1-CB 4.1Å; I94-P138 HydrophobicContact CD1-CG 4.17Å; I94-L497 HydrophobicContact CG1-CD1 4.4Å; I94-L497 HydrophobicContact CG1-CD2 4.08Å
95	L	97.9	Very high	97.1	Very high	103 Å²	103	47.8 Å²	47.8	54%	0.539	27%	0.267	S	S	.	.	H	α-helix	trans	-63.9	-44.7	177.9	-70.2	174.8	0	0	0	111.6	T91 T92 M93 S98 C99	T91-L95 HydrophobicContact CG2-CD1 4.07Å; T91-L95 HydrophobicContact CG2-CG 4.49Å; T91-L95 WeakPolarHBondContact O-CB 3.31Å; T91-L95 VanDerWaalsContact O-CG 3.26Å; T91-L95 WeakPolarHBondContact O-CG 3.47Å; T91-L95 PolarHBondContact O-N 3.22Å; T92-L95 PolarHBondContact O-N 2.89Å; M93-L95 PolarHBondContact O-N 3.27Å; L95-S98 WeakPolarHBondContact CA-OG 3.2Å; L95-S98 PolarHBondContact O-OG 3.03Å; L95-S98 VanDerWaalsContact O-OG 3.04Å; L95-C99 VanDerWaalsContact O-CB 3.24Å; L95-C99 WeakPolarHBondContact O-CB 3.49Å; L95-C99 PolarHBondContact O-N 3.48Å; L95-C99 PolarHBondContact O-SG 2.92Å
96	F	97.1	Very high	97	Very high	111 Å²	111	49 Å²	49	49%	0.487	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-48.2	179.5	-176.5	-99.8	0	0	0	112.3	T92 M93 S98 C99 G100 C501 V505	T92-F96 VanDerWaalsContact O-CB 3.3Å; T92-F96 WeakPolarHBondContact O-CB 3.31Å; T92-F96 PolarHBondContact O-N 3.4Å; M93-F96 PolarHBondContact O-N 3.35Å; F96-S98 PolarHBondContact O-N 3.13Å; F96-C99 PolarHBondContact O-N 3.31Å; F96-G100 PolarHBondContact O-N 3.45Å; F96-C501 HydrophobicContact CD1-CB 3.6Å; F96-C501 HydrophobicContact CE1-CB 3.92Å; F96-C501 VanDerWaalsContact CE1-O 3.27Å; F96-C501 WeakPolarHBondContact CE1-O 3.3Å; F96-V505 HydrophobicContact CE1-CG2 4.03Å; F96-V505 HydrophobicContact CZ-CG2 3.69Å
97	G	97.1	Very high	96.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.8	-41	178.7	0	0	0	0	0	112.7	M93 S101	M93-G97 PolarHBondContact O-N 3.45Å; G97-S101 VanDerWaalsContact O-CB 3.25Å; G97-S101 WeakPolarHBondContact O-CB 3.27Å; G97-S101 PolarHBondContact O-N 3.39Å; G97-S101 PolarHBondContact O-OG 3.29Å
98	S	97.6	Very high	96.7	Very high	12 Å²	12	45.9 Å²	45.9	8%	0.084	25%	0.25	C	C	.	.	H	α-helix	trans	-68.3	-47.8	176.4	57.5	0	0	0	0	112.5	I94 L95 F96 G100 S101 L102 L130	I94-S98 VanDerWaalsContact O-CB 3.24Å; I94-S98 WeakPolarHBondContact O-CB 3.05Å; I94-S98 PolarHBondContact O-N 3.07Å; I94-S98 PolarHBondContact O-OG 3.43Å; L95-S98 WeakPolarHBondContact CA-OG 3.2Å; L95-S98 PolarHBondContact O-OG 3.03Å; L95-S98 VanDerWaalsContact O-OG 3.04Å; F96-S98 PolarHBondContact O-N 3.13Å; S98-G100 PolarHBondContact O-N 3.04Å; S98-S101 PolarHBondContact O-N 2.93Å; S98-L102 VanDerWaalsContact O-CB 3.26Å; S98-L102 WeakPolarHBondContact O-CB 3.45Å; S98-L102 PolarHBondContact O-N 2.99Å; S98-L130 WeakPolarHBondContact O-CD2 3.25Å
99	C	96.8	Very high	96.4	Very high	84 Å²	84	47.4 Å²	47.4	57%	0.568	25%	0.252	S	S	*	.	H	α-helix	trans	-56.9	-47.6	175.8	-76.4	0	0	0	0	112	L95 F96 L102 L103	L95-C99 VanDerWaalsContact O-CB 3.24Å; L95-C99 WeakPolarHBondContact O-CB 3.49Å; L95-C99 PolarHBondContact O-N 3.48Å; L95-C99 PolarHBondContact O-SG 2.92Å; F96-C99 PolarHBondContact O-N 3.31Å; C99-L102 PolarHBondContact O-N 3.25Å; C99-L103 WeakPolarHBondContact O-CB 3.23Å; C99-L103 PolarHBondContact O-N 2.9Å
100	G	95.3	Very high	96.2	Very high	12 Å²	12	49 Å²	49	12%	0.124	25%	0.254	C	S	.	.	H	α-helix	trans	-66	-42.2	-179.9	0	0	0	0	0	112.6	F96 S98 L103 V104 P504	F96-G100 PolarHBondContact O-N 3.45Å; S98-G100 PolarHBondContact O-N 3.04Å; G100-L103 WeakPolarHBondContact O-CB 3.29Å; G100-L103 PolarHBondContact O-N 3.35Å; G100-V104 WeakPolarHBondContact O-CG2 3.43Å; G100-V104 PolarHBondContact O-N 2.85Å; G100-V104 VanDerWaalsContact O-N 3.09Å; G100-P504 VanDerWaalsContact CA-CG 3.47Å; G100-P504 WeakPolarHBondContact O-CG 3.37Å
101	S	96.1	Very high	95.9	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-67.9	-39.7	178.8	-58.9	0	0	0	0	111.7	G97 S98 L103 V104 V105	G97-S101 VanDerWaalsContact O-CB 3.25Å; G97-S101 WeakPolarHBondContact O-CB 3.27Å; G97-S101 PolarHBondContact O-N 3.39Å; G97-S101 PolarHBondContact O-OG 3.29Å; S98-S101 PolarHBondContact O-N 2.93Å; S101-L103 VanDerWaalsContact C-N 3.32Å; S101-L103 PolarHBondContact O-N 2.97Å; S101-V104 PolarHBondContact O-N 2.86Å; S101-V105 WeakPolarHBondContact O-CG2 3.21Å; S101-V105 PolarHBondContact O-N 2.98Å; S101-V105 VanDerWaalsContact O-N 3.08Å
102	L	96.9	Very high	95.5	Very high	105 Å²	105	53.9 Å²	53.9	55%	0.55	28%	0.277	S	S	.	.	H	α-helix	trans	-61.3	-41.4	173.7	-175.5	62.3	0	0	0	111.6	S98 C99 V104 V105 Y106 L130	S98-L102 VanDerWaalsContact O-CB 3.26Å; S98-L102 WeakPolarHBondContact O-CB 3.45Å; S98-L102 PolarHBondContact O-N 2.99Å; C99-L102 PolarHBondContact O-N 3.25Å; L102-V104 PolarHBondContact O-N 3.06Å; L102-V105 PolarHBondContact O-N 3.2Å; L102-Y106 VanDerWaalsContact O-CB 3.26Å; L102-Y106 WeakPolarHBondContact O-CB 3.24Å; L102-Y106 PolarHBondContact O-N 3.41Å; L102-L130 HydrophobicContact CB-CD2 4.21Å
103	L	95	Very high	95.1	Very high	33 Å²	33	58.7 Å²	58.7	17%	0.173	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-41.5	176.7	179.9	66.4	0	0	0	112.3	C99 G100 S101 T107 F518 M521 F522	C99-L103 WeakPolarHBondContact O-CB 3.23Å; C99-L103 PolarHBondContact O-N 2.9Å; G100-L103 WeakPolarHBondContact O-CB 3.29Å; G100-L103 PolarHBondContact O-N 3.35Å; S101-L103 VanDerWaalsContact C-N 3.32Å; S101-L103 PolarHBondContact O-N 2.97Å; L103-T107 VanDerWaalsContact O-CB 3.3Å; L103-T107 WeakPolarHBondContact O-CB 3.41Å; L103-T107 PolarHBondContact O-N 2.87Å; L103-T107 PolarHBondContact O-OG1 2.92Å; L103-F518 HydrophobicContact CD1-CD1 4.39Å; L103-F518 HydrophobicContact CD1-CE1 4.33Å; L103-F518 HydrophobicContact CD2-CD1 3.83Å; L103-F518 HydrophobicContact CD2-CD2 4.16Å; L103-F518 HydrophobicContact CD2-CE1 3.7Å; L103-F518 HydrophobicContact CD2-CE2 4.01Å; L103-F518 HydrophobicContact CD2-CG 4.08Å; L103-F518 HydrophobicContact CD2-CZ 3.78Å; L103-F518 HydrophobicContact CG-CD1 3.96Å; L103-F518 HydrophobicContact CG-CE1 3.55Å; L103-F518 HydrophobicContact CG-CZ 3.93Å; L103-M521 HydrophobicContact CD1-SD 3.48Å; L103-M521 WeakPolarHBondContact CD1-SD 3.14Å; L103-F522 HydrophobicContact CD1-CE2 3.78Å; L103-F522 HydrophobicContact CD1-CZ 4.31Å; L103-F522 HydrophobicContact CD2-CE2 3.73Å; L103-F522 HydrophobicContact CD2-CZ 4.5Å; L103-F522 HydrophobicContact CG-CE2 4.42Å
104	V	94.9	Very high	94.7	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-49.1	175.5	170.6	0	0	0	0	110.4	G100 S101 L102 T107 V108 I122 A126 P504 Y507 F514 F518	G100-V104 WeakPolarHBondContact O-CG2 3.43Å; G100-V104 PolarHBondContact O-N 2.85Å; G100-V104 VanDerWaalsContact O-N 3.09Å; S101-V104 PolarHBondContact O-N 2.86Å; L102-V104 PolarHBondContact O-N 3.06Å; V104-T107 PolarHBondContact O-N 3.46Å; V104-V108 PolarHBondContact O-N 3.4Å; V104-I122 HydrophobicContact CG1-CG2 3.74Å; V104-A126 HydrophobicContact CB-CB 4.18Å; V104-A126 HydrophobicContact CG1-CB 3.92Å; V104-P504 HydrophobicContact CG2-CB 4.16Å; V104-P504 HydrophobicContact CG2-CG 4.4Å; V104-Y507 HydrophobicContact CG1-CD2 4.38Å; V104-Y507 HydrophobicContact CG2-CD2 3.88Å; V104-F514 HydrophobicContact CG1-CE1 3.9Å; V104-F514 HydrophobicContact CG1-CZ 4.28Å; V104-F518 HydrophobicContact CG2-CZ 4.04Å
105	V	96.5	Very high	94.4	Very high	19 Å²	19	62.4 Å²	62.4	12%	0.115	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-51.5	177.7	175.1	0	0	0	0	110.8	S101 L102 T107 V108 I109 V123 A126 I127 L130	S101-V105 WeakPolarHBondContact O-CG2 3.21Å; S101-V105 PolarHBondContact O-N 2.98Å; S101-V105 VanDerWaalsContact O-N 3.08Å; L102-V105 PolarHBondContact O-N 3.2Å; V105-T107 VanDerWaalsContact C-N 3.32Å; V105-T107 PolarHBondContact O-N 3.43Å; V105-V108 PolarHBondContact O-N 3.34Å; V105-I109 HydrophobicContact CG1-CD1 3.69Å; V105-I109 HydrophobicContact CG1-CG1 4.45Å; V105-I109 WeakPolarHBondContact O-CG1 3.4Å; V105-I109 PolarHBondContact O-N 3Å; V105-V123 HydrophobicContact CG2-CG1 4.33Å; V105-A126 HydrophobicContact CG2-CB 3.84Å; V105-I127 HydrophobicContact CG2-CG1 4.14Å; V105-L130 HydrophobicContact CG2-CD1 4.16Å
106	Y	95.7	Very high	94.1	Very high	125 Å²	125	60.1 Å²	60.1	49%	0.49	29%	0.292	S	S	.	.	H	α-helix	trans	-56	-45.1	179.7	175.5	-102.4	0	0	0	112	L102 V108 I109 R110 M521	L102-Y106 VanDerWaalsContact O-CB 3.26Å; L102-Y106 WeakPolarHBondContact O-CB 3.24Å; L102-Y106 PolarHBondContact O-N 3.41Å; Y106-V108 PolarHBondContact O-N 2.84Å; Y106-I109 PolarHBondContact O-N 3.42Å; Y106-R110 HydrophobicContact CE1-CB 4.49Å; Y106-R110 HydrophobicContact CE1-CG 4.5Å; Y106-R110 WeakPolarHBondContact O-CB 3.05Å; Y106-R110 PolarHBondContact O-N 3.41Å; Y106-M521 HydrophobicContact CD1-CE 3.6Å; Y106-M521 HydrophobicContact CD1-SD 3.79Å; Y106-M521 HydrophobicContact CE1-CE 3.52Å; Y106-M521 HydrophobicContact CE1-SD 3.77Å
107	T	93.9	Very high	93.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-45.1	-179.1	-63.3	0	0	0	0	112.4	L103 V104 V105 K111 M114 F514 E517 F518 M521	L103-T107 VanDerWaalsContact O-CB 3.3Å; L103-T107 WeakPolarHBondContact O-CB 3.41Å; L103-T107 PolarHBondContact O-N 2.87Å; L103-T107 PolarHBondContact O-OG1 2.92Å; V104-T107 PolarHBondContact O-N 3.46Å; V105-T107 VanDerWaalsContact C-N 3.32Å; V105-T107 PolarHBondContact O-N 3.43Å; T107-K111 PolarHBondContact O-N 2.62Å; T107-K111 VanDerWaalsContact O-N 3.17Å; T107-M114 HydrophobicContact CG2-CE 3.98Å; T107-M114 HydrophobicContact CG2-SD 3.83Å; T107-F514 HydrophobicContact CG2-CD1 4Å; T107-F514 HydrophobicContact CG2-CE1 4.28Å; T107-E517 HydrophobicContact CG2-CB 3.51Å; T107-E517 HydrophobicContact CG2-CG 3.94Å; T107-F518 HydrophobicContact CG2-CE1 4.42Å; T107-F518 WeakPolarHBondContact OG1-CE1 3.43Å; T107-M521 HydrophobicContact CG2-CE 4.34Å; T107-M521 VanDerWaalsContact OG1-CE 3.31Å; T107-M521 WeakPolarHBondContact OG1-CE 3.38Å
108	V	93.8	Very high	93.1	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.024	29%	0.289	C	S	.	.	H	α-helix	trans	-69.4	-39.5	179.8	177	0	0	0	0	111.4	V104 V105 Y106 M114 R115 N119 V123 F514	V104-V108 PolarHBondContact O-N 3.4Å; V105-V108 PolarHBondContact O-N 3.34Å; Y106-V108 PolarHBondContact O-N 2.84Å; V108-M114 HydrophobicContact CG2-CE 4.4Å; V108-R115 WeakPolarHBondContact O-CG 3.45Å; V108-N119 HydrophobicContact CG1-CB 4.22Å; V108-N119 HydrophobicContact CG2-CB 4.3Å; V108-V123 HydrophobicContact CB-CG2 3.62Å; V108-V123 HydrophobicContact CG1-CG2 3.71Å; V108-V123 HydrophobicContact CG2-CG2 3.75Å; V108-F514 HydrophobicContact CG2-CE1 3.65Å; V108-F514 HydrophobicContact CG2-CZ 3.49Å; V108-F514 VanDerWaalsContact CG2-CZ 3.49Å
109	I	93.8	Very high	92.8	Very high	102 Å²	102	59 Å²	59	52%	0.523	29%	0.287	S	S	.	.	H	α-helix	trans	-63.8	-48.7	176.3	-68.2	173.7	0	0	0	110.1	V105 Y106 K111 R115	V105-I109 HydrophobicContact CG1-CD1 3.69Å; V105-I109 HydrophobicContact CG1-CG1 4.45Å; V105-I109 WeakPolarHBondContact O-CG1 3.4Å; V105-I109 PolarHBondContact O-N 3Å; Y106-I109 PolarHBondContact O-N 3.42Å; I109-K111 VanDerWaalsContact C-N 3.32Å; I109-K111 PolarHBondContact O-N 3.04Å; I109-R115 PolarHBondContact O-NE 2.89Å; I109-R115 PolarHBondContact O-NH2 3.45Å
110	R	93.2	Very high	92.6	Very high	107 Å²	107	56.9 Å²	56.9	40%	0.404	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-31.9	-175.6	-174.4	-98.7	-159.9	152.9	9.8	113.3	Y106 E517	Y106-R110 HydrophobicContact CE1-CB 4.49Å; Y106-R110 HydrophobicContact CE1-CG 4.5Å; Y106-R110 WeakPolarHBondContact O-CB 3.05Å; Y106-R110 PolarHBondContact O-N 3.41Å; R110-E517 IonicContact NH1-OE2 2.7Å; R110-E517 PolarHBondContact NH1-OE2 3.46Å
111	K	91	Very high	92.5	Very high	68 Å²	68	56.7 Å²	56.7	30%	0.296	27%	0.266	S	S	.	.			trans	-108.7	106.7	-179.2	-68.8	-57.5	-170.8	-165.1	0	112.6	T107 I109 K113 M114 E517	T107-K111 PolarHBondContact O-N 2.62Å; T107-K111 VanDerWaalsContact O-N 3.17Å; I109-K111 VanDerWaalsContact C-N 3.32Å; I109-K111 PolarHBondContact O-N 3.04Å; K111-K113 VanDerWaalsContact C-N 3.29Å; K111-K113 PolarHBondContact O-N 2.93Å; K111-M114 HydrophobicContact CB-CB 4.18Å; K111-M114 HydrophobicContact CB-CG 3.98Å; K111-M114 HydrophobicContact CB-SD 4.12Å; K111-M114 WeakPolarHBondContact O-CA 3.4Å; K111-M114 WeakPolarHBondContact O-CB 3.09Å; K111-M114 PolarHBondContact O-N 3Å; K111-E517 VanDerWaalsContact CE-OE1 3.3Å; K111-E517 WeakPolarHBondContact CE-OE1 3.45Å; K111-E517 WeakPolarHBondContact CE-OE2 3.33Å; K111-E517 HydrophobicContact CG-CG 4.2Å; K111-E517 WeakPolarHBondContact CG-OE2 3.43Å; K111-E517 IonicContact NZ-OE2 3.46Å
112	T	89.5	Confident	92.3	Very high	97 Å²	97	56.8 Å²	56.8	60%	0.595	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-52.8	-41.8	176.5	52.7	0	0	0	0	113.4	M114 R115	T112-M114 PolarHBondContact O-N 3.49Å; T112-M114 VanDerWaalsContact O-N 3.13Å; T112-R115 WeakPolarHBondContact O-CB 3.28Å; T112-R115 PolarHBondContact O-N 3.47Å
113	K	89.9	Confident	92.2	Very high	196 Å²	196	52.7 Å²	52.7	85%	0.852	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-61.5	-20.3	176.6	-65.3	-173.4	179.7	-177.1	0	113.8	K111	K111-K113 VanDerWaalsContact C-N 3.29Å; K111-K113 PolarHBondContact O-N 2.93Å
114	M	88.8	Confident	92.3	Very high	11 Å²	11	51.4 Å²	51.4	5%	0.054	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-90.6	-5.3	176	-66.6	-174.2	69.5	0	0	112.9	T107 V108 K111 T112 T116 N119 N513 F514 E517	T107-M114 HydrophobicContact CG2-CE 3.98Å; T107-M114 HydrophobicContact CG2-SD 3.83Å; V108-M114 HydrophobicContact CG2-CE 4.4Å; K111-M114 HydrophobicContact CB-CB 4.18Å; K111-M114 HydrophobicContact CB-CG 3.98Å; K111-M114 HydrophobicContact CB-SD 4.12Å; K111-M114 WeakPolarHBondContact O-CA 3.4Å; K111-M114 WeakPolarHBondContact O-CB 3.09Å; K111-M114 PolarHBondContact O-N 3Å; T112-M114 PolarHBondContact O-N 3.49Å; T112-M114 VanDerWaalsContact O-N 3.13Å; M114-T116 PolarHBondContact O-N 3.33Å; M114-N119 WeakPolarHBondContact O-CB 3.19Å; M114-N119 PolarHBondContact O-ND2 2.96Å; M114-N513 HydrophobicContact CE-CB 4.17Å; M114-F514 HydrophobicContact CE-CD1 3.79Å; M114-F514 HydrophobicContact CE-CD2 3.74Å; M114-F514 HydrophobicContact CE-CE1 3.73Å; M114-F514 HydrophobicContact CE-CE2 3.71Å; M114-F514 HydrophobicContact CE-CG 3.81Å; M114-F514 HydrophobicContact CE-CZ 3.71Å; M114-E517 HydrophobicContact SD-CG 3.88Å
115	R	92.6	Very high	92.2	Very high	120 Å²	120	51.3 Å²	51.3	45%	0.453	24%	0.238	S	C	.	.			trans	-79.5	52.6	179.7	-57.4	179.2	-171.2	171.9	-0.7	112.1	V108 I109 T112 N197	V108-R115 WeakPolarHBondContact O-CG 3.45Å; I109-R115 PolarHBondContact O-NE 2.89Å; I109-R115 PolarHBondContact O-NH2 3.45Å; T112-R115 WeakPolarHBondContact O-CB 3.28Å; T112-R115 PolarHBondContact O-N 3.47Å; R115-N197 PolarHBondContact O-ND2 2.91Å
116	T	90	Very high	92.2	Very high	55 Å²	55	50.5 Å²	50.5	34%	0.337	23%	0.233	S	C	.	.			trans	-92.6	155.2	177.8	64.3	0	0	0	0	110.4	M114 R118 N119 L120	M114-T116 PolarHBondContact O-N 3.33Å; T116-R118 PolarHBondContact O-N 2.87Å; T116-R118 VanDerWaalsContact O-N 3.16Å; T116-N119 PolarHBondContact O-N 3.19Å; T116-L120 PolarHBondContact O-N 3.16Å
117	P	87.6	Confident	92.3	Very high	26 Å²	26	47.7 Å²	47.7	17%	0.169	23%	0.226	C	C	.	.	H	α-helix	trans	-51.8	-42.1	-179.6	-23.1	29.3	0	0	0	112.8	N119 L120 F121 V195 N197 A200	P117-N119 PolarHBondContact O-N 2.89Å; P117-L120 WeakPolarHBondContact O-CB 3.43Å; P117-L120 PolarHBondContact O-N 3.04Å; P117-F121 WeakPolarHBondContact O-CD2 3.19Å; P117-F121 PolarHBondContact O-N 3.13Å; P117-V195 WeakPolarHBondContact CG-O 3.29Å; P117-N197 WeakPolarHBondContact CD-OD1 3.42Å; P117-N197 VanDerWaalsContact CG-OD1 3.28Å; P117-N197 WeakPolarHBondContact CG-OD1 3.15Å; P117-A200 HydrophobicContact CB-CB 4.01Å
118	R	87.1	Confident	92.4	Very high	67 Å²	67	47.7 Å²	47.7	25%	0.253	23%	0.226	S	C	.	.	H	α-helix	trans	-56.8	-48.1	175	177.9	-179.4	-61.7	143.7	9.1	112.9	T116 L120 F121 I122 D182	T116-R118 PolarHBondContact O-N 2.87Å; T116-R118 VanDerWaalsContact O-N 3.16Å; R118-L120 PolarHBondContact O-N 2.78Å; R118-F121 PolarHBondContact O-N 3.2Å; R118-I122 PolarHBondContact O-N 3.01Å; R118-D182 IonicContact CZ-OD2 3.66Å; R118-D182 IonicContact NE-OD2 3.75Å; R118-D182 PolarHBondContact NE-OD2 3.2Å; R118-D182 IonicContact NH2-OD2 3.93Å; R118-D182 PolarHBondContact NH2-OD2 3.11Å; R118-D182 VanDerWaalsContact NH2-OD2 3.13Å
119	N	90.4	Very high	92.5	Very high	7 Å²	7	47.6 Å²	47.6	4%	0.037	23%	0.225	C	C	.	.	H	α-helix	trans	-72.8	-21.5	-177.7	-71.2	-6.5	0	0	0	111.6	V108 M114 T116 P117 I122 V123	V108-N119 HydrophobicContact CG1-CB 4.22Å; V108-N119 HydrophobicContact CG2-CB 4.3Å; M114-N119 WeakPolarHBondContact O-CB 3.19Å; M114-N119 PolarHBondContact O-ND2 2.96Å; T116-N119 PolarHBondContact O-N 3.19Å; P117-N119 PolarHBondContact O-N 2.89Å; N119-I122 PolarHBondContact O-N 3.39Å; N119-V123 WeakPolarHBondContact O-CG2 3.48Å; N119-V123 PolarHBondContact O-N 2.87Å
120	L	93.3	Very high	92.7	Very high	38 Å²	38	44 Å²	44	20%	0.199	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-38.4	170	-61.7	178.4	0	0	0	111.7	T116 P117 R118 V123 N124 N197 A200 I204	T116-L120 PolarHBondContact O-N 3.16Å; P117-L120 WeakPolarHBondContact O-CB 3.43Å; P117-L120 PolarHBondContact O-N 3.04Å; R118-L120 PolarHBondContact O-N 2.78Å; L120-V123 PolarHBondContact O-N 3.41Å; L120-N124 PolarHBondContact O-N 3.4Å; L120-N197 HydrophobicContact CD1-CB 4.18Å; L120-A200 HydrophobicContact CD1-CB 4.14Å; L120-I204 HydrophobicContact CB-CD1 3.97Å
121	F	92.7	Very high	92.9	Very high	9 Å²	9	42.1 Å²	42.1	4%	0.039	20%	0.204	C	C	.	.	H	α-helix	trans	-67.5	-36.6	173.2	-65.3	-59.7	0	0	0	112.8	P117 R118 V123 N124 L125 A178 I179 A200 I203 I204	P117-F121 WeakPolarHBondContact O-CD2 3.19Å; P117-F121 PolarHBondContact O-N 3.13Å; R118-F121 PolarHBondContact O-N 3.2Å; F121-V123 VanDerWaalsContact C-N 3.33Å; F121-N124 WeakPolarHBondContact O-CB 3.46Å; F121-N124 PolarHBondContact O-N 3.39Å; F121-L125 PolarHBondContact O-N 3.44Å; F121-A178 HydrophobicContact CD1-CB 3.85Å; F121-A178 HydrophobicContact CE1-CB 3.8Å; F121-A178 HydrophobicContact CG-CB 4.27Å; F121-A178 HydrophobicContact CZ-CB 4.15Å; F121-I179 HydrophobicContact CB-CD1 4.31Å; F121-I179 HydrophobicContact CB-CG1 3.68Å; F121-A200 HydrophobicContact CE2-CB 4.24Å; F121-A200 HydrophobicContact CZ-CB 4.03Å; F121-I203 HydrophobicContact CE1-CB 4.05Å; F121-I203 HydrophobicContact CE1-CG2 3.69Å; F121-I203 HydrophobicContact CZ-CB 4.24Å; F121-I203 HydrophobicContact CZ-CD1 4.06Å; F121-I203 HydrophobicContact CZ-CG2 4.1Å; F121-I204 HydrophobicContact CD1-CD1 4.42Å; F121-I204 HydrophobicContact CD1-CG1 4.1Å; F121-I204 HydrophobicContact CE1-CG1 4.14Å
122	I	92.4	Very high	93.1	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-43	173.2	-66.3	174.6	0	0	0	110.5	V104 R118 N119 L125 A126 I179 Y507 F514	V104-I122 HydrophobicContact CG1-CG2 3.74Å; R118-I122 PolarHBondContact O-N 3.01Å; N119-I122 PolarHBondContact O-N 3.39Å; I122-L125 PolarHBondContact O-N 2.89Å; I122-A126 PolarHBondContact O-N 3.15Å; I122-I179 HydrophobicContact CG1-CD1 4.44Å; I122-Y507 HydrophobicContact CD1-CD1 4.45Å; I122-Y507 HydrophobicContact CD1-CE1 4.16Å; I122-Y507 HydrophobicContact CG1-CE1 4.14Å; I122-Y507 HydrophobicContact CG2-CD1 4.29Å; I122-Y507 HydrophobicContact CG2-CD2 4.19Å; I122-Y507 HydrophobicContact CG2-CE1 3.93Å; I122-Y507 HydrophobicContact CG2-CE2 3.85Å; I122-Y507 HydrophobicContact CG2-CG 4.43Å; I122-F514 HydrophobicContact CD1-CE2 4.06Å; I122-F514 HydrophobicContact CG2-CE2 4.37Å; I122-F514 HydrophobicContact CG2-CZ 3.96Å
123	V	94.7	Very high	93.5	Very high	19 Å²	19	34.2 Å²	34.2	12%	0.115	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-41.3	174.3	167.5	0	0	0	0	111.1	V105 V108 N119 L120 F121 L125 A126 I127	V105-V123 HydrophobicContact CG2-CG1 4.33Å; V108-V123 HydrophobicContact CB-CG2 3.62Å; V108-V123 HydrophobicContact CG1-CG2 3.71Å; V108-V123 HydrophobicContact CG2-CG2 3.75Å; N119-V123 WeakPolarHBondContact O-CG2 3.48Å; N119-V123 PolarHBondContact O-N 2.87Å; L120-V123 PolarHBondContact O-N 3.41Å; F121-V123 VanDerWaalsContact C-N 3.33Å; V123-L125 VanDerWaalsContact C-N 3.33Å; V123-L125 PolarHBondContact O-N 3.01Å; V123-A126 PolarHBondContact O-N 3.14Å; V123-I127 HydrophobicContact CG1-CD1 3.73Å; V123-I127 HydrophobicContact CG1-CG1 4.25Å; V123-I127 WeakPolarHBondContact O-CG1 3.47Å; V123-I127 PolarHBondContact O-N 2.9Å
124	N	95.6	Very high	93.8	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.027	15%	0.147	C	C	.	.	H	α-helix	trans	-58.8	-45.4	176.6	-168.8	59	0	0	0	111.8	L120 F121 I127 S128 S175 I204 W208	L120-N124 PolarHBondContact O-N 3.4Å; F121-N124 WeakPolarHBondContact O-CB 3.46Å; F121-N124 PolarHBondContact O-N 3.39Å; N124-I127 PolarHBondContact O-N 3.32Å; N124-S128 PolarHBondContact O-N 3.47Å; N124-S175 PolarHBondContact ND2-OG 3Å; N124-I204 HydrophobicContact CB-CD1 4.14Å; N124-I204 HydrophobicContact CB-CG1 4.06Å; N124-I204 HydrophobicContact CB-CG2 4.48Å; N124-I204 VanDerWaalsContact OD1-CG2 3.28Å; N124-I204 WeakPolarHBondContact OD1-CG2 3.35Å; N124-W208 PolarHBondContact OD1-NE1 3.25Å
125	L	94.4	Very high	94.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.6	-43	175.3	-176.5	57.3	0	0	0	111.6	F121 I122 V123 I127 S128 D129 I176 I179 Y507	F121-L125 PolarHBondContact O-N 3.44Å; I122-L125 PolarHBondContact O-N 2.89Å; V123-L125 VanDerWaalsContact C-N 3.33Å; V123-L125 PolarHBondContact O-N 3.01Å; L125-I127 PolarHBondContact O-N 2.77Å; L125-S128 VanDerWaalsContact O-CB 3.3Å; L125-S128 WeakPolarHBondContact O-CB 3.38Å; L125-S128 PolarHBondContact O-N 2.96Å; L125-D129 VanDerWaalsContact O-CG 3.31Å; L125-D129 PolarHBondContact O-N 3.35Å; L125-I176 HydrophobicContact CD2-CG1 4.3Å; L125-I179 HydrophobicContact CD2-CD1 4.32Å; L125-Y507 WeakPolarHBondContact CD2-OH 3.02Å
126	A	95.8	Very high	94.3	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.017	14%	0.139	C	C	.	.	H	α-helix	trans	-65	-35.1	176.5	0	0	0	0	0	113.3	V104 V105 I122 V123 D129 L130	V104-A126 HydrophobicContact CB-CB 4.18Å; V104-A126 HydrophobicContact CG1-CB 3.92Å; V105-A126 HydrophobicContact CG2-CB 3.84Å; I122-A126 PolarHBondContact O-N 3.15Å; V123-A126 PolarHBondContact O-N 3.14Å; A126-D129 PolarHBondContact O-N 3.16Å; A126-L130 WeakPolarHBondContact O-CB 3.37Å; A126-L130 WeakPolarHBondContact O-CG 3.38Å; A126-L130 PolarHBondContact O-N 2.67Å
127	I	97	Very high	94.6	Very high	65 Å²	65	24.6 Å²	24.6	33%	0.333	12%	0.123	S	C	.	.	H	α-helix	trans	-66.9	-41.8	173.4	-69.7	168.6	0	0	0	110.4	V105 V123 N124 L125 L130 I131 W208	V105-I127 HydrophobicContact CG2-CG1 4.14Å; V123-I127 HydrophobicContact CG1-CD1 3.73Å; V123-I127 HydrophobicContact CG1-CG1 4.25Å; V123-I127 WeakPolarHBondContact O-CG1 3.47Å; V123-I127 PolarHBondContact O-N 2.9Å; N124-I127 PolarHBondContact O-N 3.32Å; L125-I127 PolarHBondContact O-N 2.77Å; I127-L130 WeakPolarHBondContact O-CB 3.28Å; I127-L130 PolarHBondContact O-N 3.26Å; I127-I131 HydrophobicContact CG2-CD1 4.41Å; I127-I131 WeakPolarHBondContact O-CG1 3.36Å; I127-I131 PolarHBondContact O-N 2.87Å; I127-W208 HydrophobicContact CG2-CZ2 4.1Å
128	S	96.7	Very high	95	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.7	-51.6	172.6	-152.4	0	0	0	0	110.5	N124 L125 L130 I131 L132 N168 S172	N124-S128 PolarHBondContact O-N 3.47Å; L125-S128 VanDerWaalsContact O-CB 3.3Å; L125-S128 WeakPolarHBondContact O-CB 3.38Å; L125-S128 PolarHBondContact O-N 2.96Å; S128-L130 VanDerWaalsContact C-N 3.29Å; S128-L130 PolarHBondContact O-N 3.45Å; S128-I131 PolarHBondContact O-N 3.39Å; S128-I131 VanDerWaalsContact O-N 3.08Å; S128-L132 PolarHBondContact O-N 3.34Å; S128-N168 WeakPolarHBondContact CB-OD1 3.05Å; S128-N168 PolarHBondContact O-OD1 3.42Å; S128-N168 PolarHBondContact OG-O 3.33Å; S128-N168 PolarHBondContact OG-OD1 2.84Å; S128-S172 PolarHBondContact OG-OG 2.67Å
129	D	96.2	Very high	95.5	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-61.6	-33.7	178.8	-66.8	-17.4	0	0	0	112.7	L125 A126 L132 C133 A500 N503	L125-D129 VanDerWaalsContact O-CG 3.31Å; L125-D129 PolarHBondContact O-N 3.35Å; A126-D129 PolarHBondContact O-N 3.16Å; D129-L132 WeakPolarHBondContact O-CB 3.17Å; D129-L132 PolarHBondContact O-N 3.01Å; D129-C133 WeakPolarHBondContact O-CB 3.36Å; D129-C133 PolarHBondContact O-N 3.25Å; D129-C133 PolarHBondContact O-SG 2.74Å; D129-C133 VanDerWaalsContact O-SG 3.32Å; D129-A500 HydrophobicContact CB-CB 4Å; D129-N503 PolarHBondContact OD2-ND2 3.26Å
130	L	97.6	Very high	95.8	Very high	27 Å²	27	24.4 Å²	24.4	14%	0.141	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-46.2	172	-80.1	168.4	0	0	0	112.1	S98 L102 V105 A126 I127 S128 L132 C133 L134	S98-L130 WeakPolarHBondContact O-CD2 3.25Å; L102-L130 HydrophobicContact CB-CD2 4.21Å; V105-L130 HydrophobicContact CG2-CD1 4.16Å; A126-L130 WeakPolarHBondContact O-CB 3.37Å; A126-L130 WeakPolarHBondContact O-CG 3.38Å; A126-L130 PolarHBondContact O-N 2.67Å; I127-L130 WeakPolarHBondContact O-CB 3.28Å; I127-L130 PolarHBondContact O-N 3.26Å; S128-L130 VanDerWaalsContact C-N 3.29Å; S128-L130 PolarHBondContact O-N 3.45Å; L130-L132 VanDerWaalsContact C-N 3.3Å; L130-L132 PolarHBondContact O-N 3.35Å; L130-C133 PolarHBondContact O-N 3.43Å; L130-L134 HydrophobicContact CD2-CD1 4.12Å; L130-L134 VanDerWaalsContact O-CB 3.28Å; L130-L134 WeakPolarHBondContact O-CB 3.47Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 3.26Å
131	I	97	Very high	95.9	Very high	66 Å²	66	23.5 Å²	23.5	34%	0.338	12%	0.121	S	C	.	.	H	α-helix	trans	-65.3	-38.2	177	-66.1	178	0	0	0	110.4	I127 S128 F135 T136 W208	I127-I131 HydrophobicContact CG2-CD1 4.41Å; I127-I131 WeakPolarHBondContact O-CG1 3.36Å; I127-I131 PolarHBondContact O-N 2.87Å; S128-I131 PolarHBondContact O-N 3.39Å; S128-I131 VanDerWaalsContact O-N 3.08Å; I131-F135 HydrophobicContact CG2-CB 4.43Å; I131-F135 WeakPolarHBondContact O-CA 3.37Å; I131-F135 WeakPolarHBondContact O-CB 3.26Å; I131-F135 PolarHBondContact O-N 3.01Å; I131-T136 PolarHBondContact O-N 3.4Å; I131-T136 PolarHBondContact O-OG1 3.23Å; I131-W208 HydrophobicContact CD1-CH2 3.69Å; I131-W208 HydrophobicContact CD1-CZ3 4.14Å
132	L	95.8	Very high	96.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-57.4	-55.9	172.9	-175.7	64.4	0	0	0	110.5	S128 D129 L130 T136 Q137 W406 V496 A500	S128-L132 PolarHBondContact O-N 3.34Å; D129-L132 WeakPolarHBondContact O-CB 3.17Å; D129-L132 PolarHBondContact O-N 3.01Å; L130-L132 VanDerWaalsContact C-N 3.3Å; L130-L132 PolarHBondContact O-N 3.35Å; L132-T136 HydrophobicContact CD1-CG2 3.97Å; L132-T136 WeakPolarHBondContact O-CB 3.43Å; L132-T136 PolarHBondContact O-N 2.89Å; L132-T136 VanDerWaalsContact O-N 3.15Å; L132-Q137 HydrophobicContact CD1-CG 3.96Å; L132-Q137 VanDerWaalsContact CD1-NE2 3.31Å; L132-Q137 HydrophobicContact CG-CG 3.94Å; L132-Q137 WeakPolarHBondContact O-CB 3.23Å; L132-Q137 WeakPolarHBondContact O-CG 3.13Å; L132-Q137 PolarHBondContact O-N 3.29Å; L132-W406 HydrophobicContact CD2-CZ2 4.35Å; L132-V496 HydrophobicContact CD1-CG1 4.4Å; L132-V496 HydrophobicContact CD2-CG1 3.94Å; L132-A500 HydrophobicContact CD2-CB 4.26Å
133	C	97.7	Very high	96.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	I	π-helix	trans	-68.8	-43.9	-175.3	-70.9	0	0	0	0	113.5	I94 D129 L130 P138	I94-C133 HydrophobicContact CG2-CB 4.45Å; I94-C133 WeakPolarHBondContact CG2-O 3.48Å; D129-C133 WeakPolarHBondContact O-CB 3.36Å; D129-C133 PolarHBondContact O-N 3.25Å; D129-C133 PolarHBondContact O-SG 2.74Å; D129-C133 VanDerWaalsContact O-SG 3.32Å; L130-C133 PolarHBondContact O-N 3.43Å; C133-P138 VanDerWaalsContact O-CD 3.27Å; C133-P138 WeakPolarHBondContact O-CD 3.25Å
134	L	96.7	Very high	96.2	Very high	105 Å²	105	26.5 Å²	26.5	55%	0.55	13%	0.133	S	C	.	.	I	π-helix	trans	-88.7	-26.7	-171.4	-63.2	177.8	0	0	0	113.6	L130	L130-L134 HydrophobicContact CD2-CD1 4.12Å; L130-L134 VanDerWaalsContact O-CB 3.28Å; L130-L134 WeakPolarHBondContact O-CB 3.47Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 3.26Å
135	F	95.8	Very high	96.2	Very high	74 Å²	74	26.4 Å²	26.4	33%	0.325	13%	0.133	S	C	.	.	I	π-helix	trans	-119.9	-46.8	-177.4	180	-100.8	0	0	0	113	I131 F139 V161	I131-F135 HydrophobicContact CG2-CB 4.43Å; I131-F135 WeakPolarHBondContact O-CA 3.37Å; I131-F135 WeakPolarHBondContact O-CB 3.26Å; I131-F135 PolarHBondContact O-N 3.01Å; F135-F139 HydrophobicContact CD2-CD2 4.4Å; F135-F139 AromaticContact CD2-CE2 3.86Å; F135-F139 HydrophobicContact CD2-CE2 3.86Å; F135-F139 HydrophobicContact CD2-CZ 4.4Å; F135-F139 HydrophobicContact CE2-CE2 4.1Å; F135-F139 HydrophobicContact CE2-CZ 4.26Å; F135-F139 WeakPolarHBondContact O-CD2 3.3Å; F135-V161 HydrophobicContact CE1-CG2 4.45Å; F135-V161 HydrophobicContact CZ-CG2 4.3Å
136	T	96.1	Very high	96.1	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-75.9	-45.9	-171.9	-55.9	0	0	0	0	112.1	I131 L132 N140 Q165	I131-T136 PolarHBondContact O-N 3.4Å; I131-T136 PolarHBondContact O-OG1 3.23Å; L132-T136 HydrophobicContact CD1-CG2 3.97Å; L132-T136 WeakPolarHBondContact O-CB 3.43Å; L132-T136 PolarHBondContact O-N 2.89Å; L132-T136 VanDerWaalsContact O-N 3.15Å; T136-N140 WeakPolarHBondContact CG2-ND2 3.32Å; T136-N140 VanDerWaalsContact O-CB 3.27Å; T136-N140 WeakPolarHBondContact O-CB 3.36Å; T136-N140 PolarHBondContact O-N 3.39Å; T136-Q165 HydrophobicContact CG2-CB 3.59Å; T136-Q165 HydrophobicContact CG2-CG 4.08Å
137	Q	96.2	Very high	95.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-73.5	-41.1	-170.4	-67.5	-66.8	-23.3	0	0	114.8	I94 L132 F139 N140 L141 L497	I94-Q137 HydrophobicContact CD1-CB 4.01Å; I94-Q137 HydrophobicContact CG1-CB 4.1Å; L132-Q137 HydrophobicContact CD1-CG 3.96Å; L132-Q137 VanDerWaalsContact CD1-NE2 3.31Å; L132-Q137 HydrophobicContact CG-CG 3.94Å; L132-Q137 WeakPolarHBondContact O-CB 3.23Å; L132-Q137 WeakPolarHBondContact O-CG 3.13Å; L132-Q137 PolarHBondContact O-N 3.29Å; Q137-F139 VanDerWaalsContact C-N 3.27Å; Q137-F139 PolarHBondContact O-N 3.23Å; Q137-N140 PolarHBondContact O-N 3.36Å; Q137-L141 WeakPolarHBondContact O-CB 3.37Å; Q137-L141 PolarHBondContact O-N 3.21Å; Q137-L497 HydrophobicContact CB-CD2 4.27Å; Q137-L497 HydrophobicContact CG-CD1 4.34Å; Q137-L497 HydrophobicContact CG-CD2 3.75Å; Q137-L497 HydrophobicContact CG-CG 3.96Å
138	P	96.4	Very high	95.7	Very high	46 Å²	46	28.9 Å²	28.9	30%	0.299	14%	0.14	S	C	.	.	H	α-helix	trans	-60.2	-40.6	176.2	-22.4	32.7	0	0	0	112	I94 C133 L141 L142	I94-P138 HydrophobicContact CD1-CG 4.17Å; C133-P138 VanDerWaalsContact O-CD 3.27Å; C133-P138 WeakPolarHBondContact O-CD 3.25Å; P138-L141 PolarHBondContact O-N 2.94Å; P138-L142 PolarHBondContact O-N 2.8Å; P138-L142 VanDerWaalsContact O-N 3.15Å
139	F	97	Very high	95.6	Very high	50 Å²	50	34 Å²	34	22%	0.219	16%	0.16	C	C	.	.	H	α-helix	trans	-77.7	-32.6	-180	-65.7	-101	0	0	0	112	F135 Q137 L141 L142 R143 W151 L153 V161	F135-F139 HydrophobicContact CD2-CD2 4.4Å; F135-F139 AromaticContact CD2-CE2 3.86Å; F135-F139 HydrophobicContact CD2-CE2 3.86Å; F135-F139 HydrophobicContact CD2-CZ 4.4Å; F135-F139 HydrophobicContact CE2-CE2 4.1Å; F135-F139 HydrophobicContact CE2-CZ 4.26Å; F135-F139 WeakPolarHBondContact O-CD2 3.3Å; Q137-F139 VanDerWaalsContact C-N 3.27Å; Q137-F139 PolarHBondContact O-N 3.23Å; F139-L141 VanDerWaalsContact C-N 3.34Å; F139-L142 PolarHBondContact O-N 3.35Å; F139-R143 WeakPolarHBondContact O-CB 3.38Å; F139-R143 PolarHBondContact O-N 2.95Å; F139-W151 HydrophobicContact CB-CH2 4.43Å; F139-W151 HydrophobicContact CD1-CH2 4.25Å; F139-L153 HydrophobicContact CD1-CD1 3.41Å; F139-L153 VanDerWaalsContact CD1-CD1 3.41Å; F139-L153 HydrophobicContact CE1-CD1 3.48Å; F139-L153 VanDerWaalsContact CE1-CD1 3.48Å; F139-V161 HydrophobicContact CB-CB 4.29Å; F139-V161 HydrophobicContact CB-CG1 3.79Å; F139-V161 HydrophobicContact CB-CG2 3.48Å; F139-V161 VanDerWaalsContact CB-CG2 3.48Å; F139-V161 HydrophobicContact CD1-CG2 4.07Å; F139-V161 HydrophobicContact CG-CG2 3.87Å
140	N	95.7	Very high	95.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65	-36.9	169.7	-94	-27.4	0	0	0	112.8	T136 Q137 R143 I144 Q165 L493	T136-N140 WeakPolarHBondContact CG2-ND2 3.32Å; T136-N140 VanDerWaalsContact O-CB 3.27Å; T136-N140 WeakPolarHBondContact O-CB 3.36Å; T136-N140 PolarHBondContact O-N 3.39Å; Q137-N140 PolarHBondContact O-N 3.36Å; N140-R143 WeakPolarHBondContact O-CB 3.39Å; N140-R143 PolarHBondContact O-N 2.99Å; N140-R143 PolarHBondContact OD1-NE 3.45Å; N140-R143 PolarHBondContact OD1-NH2 3.44Å; N140-I144 WeakPolarHBondContact O-CB 3.29Å; N140-I144 WeakPolarHBondContact O-CG1 3.39Å; N140-I144 PolarHBondContact O-N 3.45Å; N140-Q165 PolarHBondContact ND2-OE1 3.44Å; N140-Q165 PolarHBondContact OD1-OE1 3.01Å; N140-L493 HydrophobicContact CB-CD1 3.78Å
141	L	96.5	Very high	95.3	Very high	20 Å²	20	35.3 Å²	35.3	11%	0.105	17%	0.167	C	C	.	.	H	α-helix	trans	-61.5	-47	173.2	179.5	62	0	0	0	110.4	L86 Y90 Q137 P138 F139 R143 I144 L145	L86-L141 HydrophobicContact CD2-CD1 4.35Å; L86-L141 HydrophobicContact CG-CD1 4.37Å; Y90-L141 HydrophobicContact CD1-CB 4.16Å; Y90-L141 HydrophobicContact CD1-CD1 4.15Å; Y90-L141 HydrophobicContact CD1-CD2 4.18Å; Y90-L141 HydrophobicContact CD1-CG 4.4Å; Y90-L141 HydrophobicContact CD2-CD1 4.12Å; Y90-L141 HydrophobicContact CE1-CB 4.33Å; Y90-L141 HydrophobicContact CE1-CD1 4.3Å; Y90-L141 HydrophobicContact CE2-CD1 4.29Å; Y90-L141 HydrophobicContact CG-CD1 4.04Å; Y90-L141 HydrophobicContact CG-CD2 4.07Å; Q137-L141 WeakPolarHBondContact O-CB 3.37Å; Q137-L141 PolarHBondContact O-N 3.21Å; P138-L141 PolarHBondContact O-N 2.94Å; F139-L141 VanDerWaalsContact C-N 3.34Å; L141-R143 VanDerWaalsContact C-N 3.32Å; L141-R143 PolarHBondContact O-N 3.39Å; L141-I144 PolarHBondContact O-N 2.93Å; L141-L145 HydrophobicContact CD1-CD1 3.81Å; L141-L145 HydrophobicContact CD1-CG 4.17Å; L141-L145 HydrophobicContact CG-CD1 3.98Å; L141-L145 WeakPolarHBondContact O-CB 3.35Å; L141-L145 WeakPolarHBondContact O-CG 3.31Å; L141-L145 PolarHBondContact O-N 3.47Å
142	L	96.3	Very high	95.2	Very high	52 Å²	52	40.6 Å²	40.6	27%	0.272	19%	0.188	S	C	.	.	H	α-helix	trans	-58.2	-44	173.9	-179.6	62.2	0	0	0	111.9	P138 F139 I144 L145 Y149 W151 L153	P138-L142 PolarHBondContact O-N 2.8Å; P138-L142 VanDerWaalsContact O-N 3.15Å; F139-L142 PolarHBondContact O-N 3.35Å; L142-I144 PolarHBondContact O-N 3.02Å; L142-L145 PolarHBondContact O-N 2.81Å; L142-Y149 HydrophobicContact CD1-CD2 4.48Å; L142-Y149 HydrophobicContact CD1-CG 4.33Å; L142-W151 HydrophobicContact CD2-CE3 4.14Å; L142-W151 HydrophobicContact CD2-CZ3 4.11Å; L142-W151 HydrophobicContact CG-CE3 4.27Å; L142-W151 HydrophobicContact CG-CZ3 4.34Å; L142-L153 HydrophobicContact CD2-CD1 3.86Å
143	R	95.7	Very high	95.2	Very high	38 Å²	38	44.2 Å²	44.2	14%	0.143	21%	0.207	C	C	.	.	H	α-helix	trans	-62	-38.9	178	-172	-173.9	56.5	66.1	-0.4	112.7	F139 N140 L141 Y146 W151 C236 H489	F139-R143 WeakPolarHBondContact O-CB 3.38Å; F139-R143 PolarHBondContact O-N 2.95Å; N140-R143 WeakPolarHBondContact O-CB 3.39Å; N140-R143 PolarHBondContact O-N 2.99Å; N140-R143 PolarHBondContact OD1-NE 3.45Å; N140-R143 PolarHBondContact OD1-NH2 3.44Å; L141-R143 VanDerWaalsContact C-N 3.32Å; L141-R143 PolarHBondContact O-N 3.39Å; R143-Y146 WeakPolarHBondContact O-CD1 3.38Å; R143-W151 HydrophobicContact CB-CZ3 4.32Å; R143-C236 HydrophobicContact CG-CB 4.2Å; R143-C236 WeakPolarHBondContact CG-O 3.47Å; R143-H489 PolarHBondContact NH1-CE1 2.89Å; R143-H489 PolarHBondContact NH2-CE1 2.83Å; R143-H489 PolarHBondContact NH2-NE2 3.3Å
144	I	94.9	Very high	95.1	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-75	-34.2	179.4	-77.1	176.2	0	0	0	111.7	N140 L141 L142 Y146 T486 H489 S490 L493	N140-I144 WeakPolarHBondContact O-CB 3.29Å; N140-I144 WeakPolarHBondContact O-CG1 3.39Å; N140-I144 PolarHBondContact O-N 3.45Å; L141-I144 PolarHBondContact O-N 2.93Å; L142-I144 PolarHBondContact O-N 3.02Å; I144-Y146 WeakPolarHBondContact O-CD1 3.28Å; I144-Y146 PolarHBondContact O-N 3.1Å; I144-T486 HydrophobicContact CG2-CG2 3.59Å; I144-H489 HydrophobicContact CD1-CB 4.15Å; I144-H489 VanDerWaalsContact CD1-CD2 3.41Å; I144-H489 WeakPolarHBondContact CD1-CD2 3.33Å; I144-S490 WeakPolarHBondContact CG2-OG 3.37Å; I144-L493 HydrophobicContact CD1-CD1 3.28Å; I144-L493 HydrophobicContact CD1-CG 4Å; I144-L493 HydrophobicContact CG1-CD1 4.49Å
145	L	95	Very high	95.1	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	30.3	177.5	-65	176.1	0	0	0	112.9	L78 L83 L86 I87 L141 L142 W147 H148 Y149	L78-L145 HydrophobicContact CD2-CD2 4.44Å; L83-L145 HydrophobicContact CD1-CD1 3.93Å; L83-L145 HydrophobicContact CD1-CD2 3.71Å; L83-L145 HydrophobicContact CD1-CG 4.46Å; L86-L145 HydrophobicContact CD2-CD2 3.98Å; I87-L145 HydrophobicContact CG1-CD1 4.42Å; L141-L145 HydrophobicContact CD1-CD1 3.81Å; L141-L145 HydrophobicContact CD1-CG 4.17Å; L141-L145 HydrophobicContact CG-CD1 3.98Å; L141-L145 WeakPolarHBondContact O-CB 3.35Å; L141-L145 WeakPolarHBondContact O-CG 3.31Å; L141-L145 PolarHBondContact O-N 3.47Å; L142-L145 PolarHBondContact O-N 2.81Å; L145-W147 PolarHBondContact O-N 3.36Å; L145-W147 VanDerWaalsContact O-N 3.11Å; L145-H148 PolarHBondContact O-N 2.98Å; L145-Y149 HydrophobicContact CB-CD2 3.85Å; L145-Y149 HydrophobicContact CB-CE2 4.34Å; L145-Y149 HydrophobicContact CD1-CD2 4.36Å; L145-Y149 HydrophobicContact CD1-CE2 4.13Å; L145-Y149 PolarHBondContact O-N 3.01Å
146	Y	92.3	Very high	95.1	Very high	54 Å²	54	46.8 Å²	46.8	21%	0.212	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-19	-178	71.2	-92.2	0	0	0	113.6	R143 I144 H148 Y149 I229 R230 I235	R143-Y146 WeakPolarHBondContact O-CD1 3.38Å; I144-Y146 WeakPolarHBondContact O-CD1 3.28Å; I144-Y146 PolarHBondContact O-N 3.1Å; Y146-H148 VanDerWaalsContact C-N 3.31Å; Y146-Y149 WeakPolarHBondContact CA-O 3.13Å; Y146-I229 HydrophobicContact CD2-CD1 4.37Å; Y146-I229 HydrophobicContact CE2-CD1 3.78Å; Y146-R230 VanDerWaalsContact O-CZ 3.24Å; Y146-R230 PolarHBondContact O-NH1 3.27Å; Y146-R230 PolarHBondContact O-NH2 3.46Å; Y146-I235 HydrophobicContact CD2-CD1 3.92Å; Y146-I235 HydrophobicContact CD2-CG1 4.37Å; Y146-I235 HydrophobicContact CD2-CG2 4.13Å; Y146-I235 HydrophobicContact CG-CG2 4.07Å
147	W	91.7	Very high	95.1	Very high	13 Å²	13	50 Å²	50	5%	0.049	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-28.9	170.3	-70.9	107.5	0	0	0	112.9	L72 N73 N76 L77 L145 I229 R230	L72-W147 HydrophobicContact CG-CH2 4.28Å; N73-W147 HydrophobicContact CB-CZ3 4.49Å; N76-W147 HydrophobicContact CB-CD2 3.42Å; N76-W147 VanDerWaalsContact CB-CD2 3.42Å; N76-W147 HydrophobicContact CB-CE3 3.59Å; N76-W147 HydrophobicContact CB-CG 4.11Å; N76-W147 HydrophobicContact CB-CH2 3.6Å; N76-W147 HydrophobicContact CB-CZ2 3.43Å; N76-W147 VanDerWaalsContact CB-CZ2 3.43Å; N76-W147 HydrophobicContact CB-CZ3 3.67Å; N76-W147 VanDerWaalsContact ND2-CH2 3.31Å; N76-W147 WeakPolarHBondContact ND2-CH2 3.49Å; L77-W147 HydrophobicContact CD2-CB 4.41Å; L77-W147 WeakPolarHBondContact CD2-O 3.14Å; L145-W147 PolarHBondContact O-N 3.36Å; L145-W147 VanDerWaalsContact O-N 3.11Å; W147-I229 HydrophobicContact CE3-CG2 4.22Å; W147-I229 HydrophobicContact CH2-CD1 4.47Å; W147-I229 HydrophobicContact CH2-CG2 3.52Å; W147-I229 HydrophobicContact CZ3-CG2 3.34Å; W147-R230 PolarHBondContact O-NH1 3.08Å
148	H	92.6	Very high	95.2	Very high	52 Å²	52	50 Å²	50	24%	0.241	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-34.7	-178.4	-66.3	-88.4	0	0	0	112.9	L77 L78 L145 Y146	L77-H148 VanDerWaalsContact CD2-CE1 3.45Å; L77-H148 WeakPolarHBondContact CD2-CE1 3.44Å; L77-H148 WeakPolarHBondContact CD2-ND1 3.2Å; L78-H148 PolarHBondContact N-NE2 3.34Å; L78-H148 VanDerWaalsContact N-NE2 3.17Å; L78-H148 PolarHBondContact O-CE1 3.05Å; L145-H148 PolarHBondContact O-N 2.98Å; Y146-H148 VanDerWaalsContact C-N 3.31Å
149	Y	93.7	Very high	95.2	Very high	106 Å²	106	49.3 Å²	49.3	42%	0.416	24%	0.237	S	C	.	.			trans	-132.5	140.6	-169.5	-55.4	-66.6	0	0	0	112.2	L142 L145 Y146	L142-Y149 HydrophobicContact CD1-CD2 4.48Å; L142-Y149 HydrophobicContact CD1-CG 4.33Å; L145-Y149 HydrophobicContact CB-CD2 3.85Å; L145-Y149 HydrophobicContact CB-CE2 4.34Å; L145-Y149 HydrophobicContact CD1-CD2 4.36Å; L145-Y149 HydrophobicContact CD1-CE2 4.13Å; L145-Y149 PolarHBondContact O-N 3.01Å; Y146-Y149 WeakPolarHBondContact CA-O 3.13Å
150	D	93.4	Very high	95.2	Very high	51 Å²	51	48.6 Å²	48.6	27%	0.273	24%	0.238	S	C	.	.			trans	-81.8	145.6	172.1	-60.5	-52.4	0	0	0	112	K152 R230 G233 H234	D150-K152 HydrophobicContact CB-CG 4.34Å; D150-K152 PolarHBondContact O-N 3.35Å; D150-K152 VanDerWaalsContact O-N 3.15Å; D150-R230 IonicContact OD1-CZ 3.59Å; D150-R230 IonicContact OD1-NE 3.65Å; D150-R230 IonicContact OD1-NH2 2.59Å; D150-R230 PolarHBondContact OD1-NH2 3.32Å; D150-G233 WeakPolarHBondContact OD1-CA 3.43Å; D150-H234 CarbonylContact C-O 3.56Å; D150-H234 WeakPolarHBondContact CA-O 3.28Å; D150-H234 HydrophobicContact CB-CB 4.43Å; D150-H234 PolarHBondContact OD1-N 2.91Å
151	W	95.3	Very high	95.2	Very high	7 Å²	7	48.6 Å²	48.6	3%	0.027	24%	0.238	C	C	.	.			trans	-77.1	95.2	171.5	-173.9	-88.9	0	0	0	111.3	F139 L142 R143 L153 G154 M157 C158 V161 V224 H234 C236	F139-W151 HydrophobicContact CB-CH2 4.43Å; F139-W151 HydrophobicContact CD1-CH2 4.25Å; L142-W151 HydrophobicContact CD2-CE3 4.14Å; L142-W151 HydrophobicContact CD2-CZ3 4.11Å; L142-W151 HydrophobicContact CG-CE3 4.27Å; L142-W151 HydrophobicContact CG-CZ3 4.34Å; R143-W151 HydrophobicContact CB-CZ3 4.32Å; W151-L153 HydrophobicContact CH2-CD1 3.81Å; W151-L153 HydrophobicContact CZ2-CB 3.79Å; W151-L153 HydrophobicContact CZ2-CD1 3.85Å; W151-L153 HydrophobicContact CZ2-CG 4.45Å; W151-L153 HydrophobicContact CZ3-CD1 4.24Å; W151-G154 PolarHBondContact NE1-O 2.86Å; W151-M157 HydrophobicContact CZ2-CB 3.79Å; W151-C158 VanDerWaalsContact CZ2-CA 3.45Å; W151-C158 HydrophobicContact CZ2-CB 3.97Å; W151-C158 VanDerWaalsContact CZ2-N 3.32Å; W151-V161 HydrophobicContact CH2-CG2 4.18Å; W151-V224 VanDerWaalsContact CD1-CG2 3.46Å; W151-V224 HydrophobicContact CG-CG2 4.4Å; W151-H234 HydrophobicContact CB-CB 4.48Å; W151-H234 PolarHBondContact N-O 3.46Å; W151-H234 WeakPolarHBondContact O-CB 3.37Å; W151-C236 HydrophobicContact CB-CB 4.11Å; W151-C236 HydrophobicContact CD2-CB 3.46Å; W151-C236 VanDerWaalsContact CD2-CB 3.46Å; W151-C236 HydrophobicContact CE3-CB 3.66Å; W151-C236 HydrophobicContact CG-CB 3.65Å; W151-C236 HydrophobicContact CZ3-CB 4.3Å
152	K	95	Very high	95.2	Very high	178 Å²	178	48 Å²	48	77%	0.774	24%	0.236	S	C	*	.			trans	-95.9	1.3	-179.4	-61.4	-174.2	179.8	-176.8	0	114.9	D150 G154	D150-K152 HydrophobicContact CB-CG 4.34Å; D150-K152 PolarHBondContact O-N 3.35Å; D150-K152 VanDerWaalsContact O-N 3.15Å; K152-G154 VanDerWaalsContact C-N 3.27Å; K152-G154 PolarHBondContact O-N 2.88Å
153	L	96	Very high	95.1	Very high	76 Å²	76	47.4 Å²	47.4	40%	0.398	23%	0.232	S	C	.	.	S	Bend	trans	-85.8	3.4	-174.8	-62.5	165.7	0	0	0	113.8	F139 L142 W151 M157	F139-L153 HydrophobicContact CD1-CD1 3.41Å; F139-L153 VanDerWaalsContact CD1-CD1 3.41Å; F139-L153 HydrophobicContact CE1-CD1 3.48Å; F139-L153 VanDerWaalsContact CE1-CD1 3.48Å; L142-L153 HydrophobicContact CD2-CD1 3.86Å; W151-L153 HydrophobicContact CH2-CD1 3.81Å; W151-L153 HydrophobicContact CZ2-CB 3.79Å; W151-L153 HydrophobicContact CZ2-CD1 3.85Å; W151-L153 HydrophobicContact CZ2-CG 4.45Å; W151-L153 HydrophobicContact CZ3-CD1 4.24Å; L153-M157 HydrophobicContact CB-CB 3.75Å; L153-M157 HydrophobicContact CB-CG 4.11Å; L153-M157 WeakPolarHBondContact O-CB 3.3Å; L153-M157 WeakPolarHBondContact O-CG 3.33Å
154	G	95.4	Very high	95.1	Very high	35 Å²	35	46.4 Å²	46.4	36%	0.361	23%	0.233	S	C	.	.	H	α-helix	trans	74.9	178.5	177.8	0	0	0	0	0	114.9	W151 K152 C158	W151-G154 PolarHBondContact NE1-O 2.86Å; K152-G154 VanDerWaalsContact C-N 3.27Å; K152-G154 PolarHBondContact O-N 2.88Å; G154-C158 PolarHBondContact O-N 3.29Å
155	Q	95.5	Very high	95.1	Very high	81 Å²	81	47.4 Å²	47.4	38%	0.379	24%	0.238	S	C	.	.	H	α-helix	trans	-65.8	-41.4	-171.2	-173.7	72.9	-18.8	0	0	113.3	C158 K159	Q155-C158 PolarHBondContact O-N 2.85Å; Q155-K159 HydrophobicContact CG-CD 4.19Å; Q155-K159 WeakPolarHBondContact O-CG 3.31Å; Q155-K159 PolarHBondContact O-N 2.95Å; Q155-K159 VanDerWaalsContact O-N 3.15Å
156	I	96.9	Very high	95.1	Very high	116 Å²	116	47.7 Å²	47.7	60%	0.595	24%	0.241	S	C	*	.	H	α-helix	trans	-64.6	-48.4	-175.9	-62.4	171.3	0	0	0	109.9	C158 K159 S160	I156-C158 VanDerWaalsContact C-N 3.31Å; I156-C158 PolarHBondContact O-N 2.74Å; I156-K159 PolarHBondContact O-N 3.13Å; I156-S160 WeakPolarHBondContact O-CB 3.47Å; I156-S160 PolarHBondContact O-N 3.33Å; I156-S160 PolarHBondContact O-OG 2.88Å
157	M	96.5	Very high	95.3	Very high	67 Å²	67	45.4 Å²	45.4	33%	0.33	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-37.5	178.9	-72.3	-65	120.8	0	0	112.1	W151 L153 K159 S160 V161	W151-M157 HydrophobicContact CZ2-CB 3.79Å; L153-M157 HydrophobicContact CB-CB 3.75Å; L153-M157 HydrophobicContact CB-CG 4.11Å; L153-M157 WeakPolarHBondContact O-CB 3.3Å; L153-M157 WeakPolarHBondContact O-CG 3.33Å; M157-K159 VanDerWaalsContact C-N 3.33Å; M157-K159 PolarHBondContact O-N 2.94Å; M157-S160 PolarHBondContact O-N 2.91Å; M157-V161 WeakPolarHBondContact O-CB 3.39Å; M157-V161 WeakPolarHBondContact O-CG2 3.32Å; M157-V161 PolarHBondContact O-N 3.22Å
158	C	97.2	Very high	95.5	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.4	-47	178.1	176.9	0	0	0	0	111.2	W151 G154 Q155 I156 A162 T222 S223 V224 C236	W151-C158 VanDerWaalsContact CZ2-CA 3.45Å; W151-C158 HydrophobicContact CZ2-CB 3.97Å; W151-C158 VanDerWaalsContact CZ2-N 3.32Å; G154-C158 PolarHBondContact O-N 3.29Å; Q155-C158 PolarHBondContact O-N 2.85Å; I156-C158 VanDerWaalsContact C-N 3.31Å; I156-C158 PolarHBondContact O-N 2.74Å; C158-A162 PolarHBondContact O-N 3.12Å; C158-T222 VanDerWaalsContact SG-CG2 3.53Å; C158-S223 VanDerWaalsContact SG-C 3.57Å; C158-V224 HydrophobicContact CB-CG2 3.79Å; C158-C236 WeakPolarHBondContact CA-SG 3.08Å; C158-C236 HydrophobicContact CB-CB 3.86Å; C158-C236 WeakPolarHBondContact CB-SG 3.47Å; C158-C236 WeakPolarHBondContact SG-CA 3.39Å; C158-C236 WeakPolarHBondContact SG-CB 3.47Å; C158-C236 CovalentContact SG-SG 2.03Å; C158-C236 PolarHBondContact SG-SG 3.09Å
159	K	97.2	Very high	95.6	Very high	32 Å²	32	42.9 Å²	42.9	14%	0.139	22%	0.222	C	C	.	.	H	α-helix	trans	-68.2	-43.2	177	-68.4	173.1	177.7	-105	0	112.4	Q155 I156 M157 V161 A162 M163 F219 T222	Q155-K159 HydrophobicContact CG-CD 4.19Å; Q155-K159 WeakPolarHBondContact O-CG 3.31Å; Q155-K159 PolarHBondContact O-N 2.95Å; Q155-K159 VanDerWaalsContact O-N 3.15Å; I156-K159 PolarHBondContact O-N 3.13Å; M157-K159 VanDerWaalsContact C-N 3.33Å; M157-K159 PolarHBondContact O-N 2.94Å; K159-V161 VanDerWaalsContact C-N 3.34Å; K159-V161 PolarHBondContact O-N 3.48Å; K159-A162 PolarHBondContact O-N 3.36Å; K159-M163 WeakPolarHBondContact O-CB 3.3Å; K159-M163 PolarHBondContact O-N 3.41Å; K159-F219 HydrophobicContact CB-CD2 3.51Å; K159-F219 HydrophobicContact CB-CE2 3.58Å; K159-F219 HydrophobicContact CB-CG 4.04Å; K159-F219 HydrophobicContact CB-CZ 4.18Å; K159-F219 HydrophobicContact CD-CD1 3.86Å; K159-F219 HydrophobicContact CD-CD2 4.2Å; K159-F219 HydrophobicContact CD-CE1 3.62Å; K159-F219 HydrophobicContact CD-CE2 3.97Å; K159-F219 HydrophobicContact CD-CG 4.14Å; K159-F219 HydrophobicContact CD-CZ 3.66Å; K159-F219 WeakPolarHBondContact CD-O 3.29Å; K159-F219 HydrophobicContact CG-CD2 4.36Å; K159-F219 HydrophobicContact CG-CE2 4.39Å; K159-F219 HydrophobicContact CG-CG 4.47Å; K159-F219 PolarHBondContact NZ-O 3.48Å; K159-T222 WeakPolarHBondContact CE-O 3.25Å; K159-T222 VanDerWaalsContact CG-O 3.26Å; K159-T222 WeakPolarHBondContact CG-O 3.39Å; K159-T222 PolarHBondContact NZ-O 3Å
160	S	95.9	Very high	95.7	Very high	35 Å²	35	38 Å²	38	25%	0.245	20%	0.203	C	C	.	.	H	α-helix	trans	-64.7	-34.9	-179.7	-66.7	0	0	0	0	113	I156 M157 G164	I156-S160 WeakPolarHBondContact O-CB 3.47Å; I156-S160 PolarHBondContact O-N 3.33Å; I156-S160 PolarHBondContact O-OG 2.88Å; M157-S160 PolarHBondContact O-N 2.91Å; S160-G164 WeakPolarHBondContact O-CA 3.41Å; S160-G164 PolarHBondContact O-N 3.18Å
161	V	96.5	Very high	95.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.9	-43.7	177.4	169.7	0	0	0	0	110.7	F135 F139 W151 M157 K159 G164 Q165	F135-V161 HydrophobicContact CE1-CG2 4.45Å; F135-V161 HydrophobicContact CZ-CG2 4.3Å; F139-V161 HydrophobicContact CB-CB 4.29Å; F139-V161 HydrophobicContact CB-CG1 3.79Å; F139-V161 HydrophobicContact CB-CG2 3.48Å; F139-V161 VanDerWaalsContact CB-CG2 3.48Å; F139-V161 HydrophobicContact CD1-CG2 4.07Å; F139-V161 HydrophobicContact CG-CG2 3.87Å; W151-V161 HydrophobicContact CH2-CG2 4.18Å; M157-V161 WeakPolarHBondContact O-CB 3.39Å; M157-V161 WeakPolarHBondContact O-CG2 3.32Å; M157-V161 PolarHBondContact O-N 3.22Å; K159-V161 VanDerWaalsContact C-N 3.34Å; K159-V161 PolarHBondContact O-N 3.48Å; V161-G164 PolarHBondContact O-N 3.37Å; V161-Q165 PolarHBondContact O-N 3.18Å
162	A	95.7	Very high	95.7	Very high	7 Å²	7	35.2 Å²	35.2	6%	0.058	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-44.9	175.8	0	0	0	0	0	112.2	C158 K159 A166 M218 T222	C158-A162 PolarHBondContact O-N 3.12Å; K159-A162 PolarHBondContact O-N 3.36Å; A162-A166 PolarHBondContact O-N 3.05Å; A162-M218 HydrophobicContact CB-CB 4.37Å; A162-M218 HydrophobicContact CB-CE 3.96Å; A162-T222 HydrophobicContact CB-CG2 3.94Å; A162-T222 WeakPolarHBondContact CB-OG1 3.47Å
163	M	96	Very high	95.6	Very high	41 Å²	41	27 Å²	27	20%	0.202	15%	0.153	C	C	.	.	H	α-helix	trans	-64.5	-42.8	174.4	-177.1	-176.8	172.8	0	0	111.8	K159 Q165 A166 A167 L212 A215 M218	K159-M163 WeakPolarHBondContact O-CB 3.3Å; K159-M163 PolarHBondContact O-N 3.41Å; M163-Q165 VanDerWaalsContact C-N 3.34Å; M163-Q165 PolarHBondContact O-N 2.96Å; M163-A166 PolarHBondContact O-N 3.04Å; M163-A167 WeakPolarHBondContact O-CB 2.86Å; M163-A167 PolarHBondContact O-N 3.19Å; M163-L212 HydrophobicContact CE-CB 4.21Å; M163-L212 HydrophobicContact CE-CD2 3.8Å; M163-L212 WeakPolarHBondContact CE-O 3.48Å; M163-A215 HydrophobicContact CG-CB 4.04Å; M163-M218 HydrophobicContact CB-CB 4.41Å
164	G	95.1	Very high	95.6	Very high	16 Å²	16	25.3 Å²	25.3	17%	0.165	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-39.7	179.3	0	0	0	0	0	112.6	S160 V161 A167 N168	S160-G164 WeakPolarHBondContact O-CA 3.41Å; S160-G164 PolarHBondContact O-N 3.18Å; V161-G164 PolarHBondContact O-N 3.37Å; G164-A167 PolarHBondContact O-N 2.95Å; G164-N168 WeakPolarHBondContact O-CB 3.47Å; G164-N168 PolarHBondContact O-N 3.06Å
165	Q	95	Very high	95.5	Very high	25 Å²	25	23.7 Å²	23.7	12%	0.117	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-47.2	172.9	-175.7	174.2	4	0	0	112.2	T136 N140 V161 M163 N168 I169 L493	T136-Q165 HydrophobicContact CG2-CB 3.59Å; T136-Q165 HydrophobicContact CG2-CG 4.08Å; N140-Q165 PolarHBondContact ND2-OE1 3.44Å; N140-Q165 PolarHBondContact OD1-OE1 3.01Å; V161-Q165 PolarHBondContact O-N 3.18Å; M163-Q165 VanDerWaalsContact C-N 3.34Å; M163-Q165 PolarHBondContact O-N 2.96Å; Q165-N168 PolarHBondContact O-N 3.28Å; Q165-I169 PolarHBondContact O-N 3.16Å; Q165-L493 VanDerWaalsContact NE2-CD2 3.33Å
166	A	95.4	Very high	95.3	Very high	10 Å²	10	20.2 Å²	20.2	8%	0.083	11%	0.112	C	C	.	.	H	α-helix	trans	-65.9	-41	178	0	0	0	0	0	112	A162 M163 N168 I169 F170 A215 M218	A162-A166 PolarHBondContact O-N 3.05Å; M163-A166 PolarHBondContact O-N 3.04Å; A166-N168 VanDerWaalsContact C-N 3.35Å; A166-N168 PolarHBondContact O-N 2.94Å; A166-I169 WeakPolarHBondContact O-CG2 3.42Å; A166-I169 PolarHBondContact O-N 2.83Å; A166-F170 WeakPolarHBondContact O-CD2 2.97Å; A166-F170 PolarHBondContact O-N 3.23Å; A166-A215 HydrophobicContact CB-CB 3.72Å; A166-M218 HydrophobicContact CB-CG 3.73Å
167	A	96.5	Very high	95.1	Very high	5 Å²	5	15.9 Å²	15.9	4%	0.041	9%	0.089	C	C	.	.	H	α-helix	trans	-63.6	-42.7	177.4	0	0	0	0	0	111.1	M163 G164 I169 F170 V171 L212 A215	M163-A167 WeakPolarHBondContact O-CB 2.86Å; M163-A167 PolarHBondContact O-N 3.19Å; G164-A167 PolarHBondContact O-N 2.95Å; A167-I169 PolarHBondContact O-N 3.43Å; A167-F170 PolarHBondContact O-N 2.92Å; A167-V171 WeakPolarHBondContact O-CG2 3.43Å; A167-V171 PolarHBondContact O-N 2.77Å; A167-L212 HydrophobicContact CB-CD2 4.09Å; A167-A215 HydrophobicContact CB-CB 3.85Å
168	N	95.1	Very high	94.9	Very high	4 Å²	4	13.4 Å²	13.4	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-58.9	-46.7	178.9	-176.3	71.5	0	0	0	112.3	S128 G164 Q165 A166 F170 V171 S172	S128-N168 WeakPolarHBondContact CB-OD1 3.05Å; S128-N168 PolarHBondContact O-OD1 3.42Å; S128-N168 PolarHBondContact OG-O 3.33Å; S128-N168 PolarHBondContact OG-OD1 2.84Å; G164-N168 WeakPolarHBondContact O-CB 3.47Å; G164-N168 PolarHBondContact O-N 3.06Å; Q165-N168 PolarHBondContact O-N 3.28Å; A166-N168 VanDerWaalsContact C-N 3.35Å; A166-N168 PolarHBondContact O-N 2.94Å; N168-F170 VanDerWaalsContact C-N 3.31Å; N168-F170 PolarHBondContact O-N 3.46Å; N168-V171 PolarHBondContact O-N 2.92Å; N168-S172 WeakPolarHBondContact O-CB 3.16Å; N168-S172 PolarHBondContact O-N 3.49Å; N168-S172 PolarHBondContact O-OG 2.97Å; N168-S172 VanDerWaalsContact O-OG 3.08Å
169	I	94.1	Very high	94.6	Very high	8 Å²	8	13.8 Å²	13.8	4%	0.041	8%	0.082	C	C	.	.	H	α-helix	trans	-62.5	-39	178.9	-172.4	176	0	0	0	111.8	Q165 A166 A167 T173 Q261 F402 W406 H410	Q165-I169 PolarHBondContact O-N 3.16Å; A166-I169 WeakPolarHBondContact O-CG2 3.42Å; A166-I169 PolarHBondContact O-N 2.83Å; A167-I169 PolarHBondContact O-N 3.43Å; I169-T173 WeakPolarHBondContact O-CB 3.42Å; I169-T173 PolarHBondContact O-N 3.21Å; I169-T173 PolarHBondContact O-OG1 3.49Å; I169-Q261 HydrophobicContact CD1-CB 4.13Å; I169-Q261 HydrophobicContact CD1-CG 4.41Å; I169-Q261 HydrophobicContact CG1-CB 4.43Å; I169-Q261 HydrophobicContact CG1-CG 4.46Å; I169-F402 HydrophobicContact CG1-CZ 4.28Å; I169-W406 HydrophobicContact CB-CE3 4.08Å; I169-W406 HydrophobicContact CB-CH2 3.67Å; I169-W406 HydrophobicContact CB-CZ2 4.25Å; I169-W406 HydrophobicContact CB-CZ3 3.59Å; I169-W406 HydrophobicContact CD1-CD2 3.81Å; I169-W406 HydrophobicContact CD1-CE3 3.23Å; I169-W406 HydrophobicContact CD1-CG 4.41Å; I169-W406 HydrophobicContact CD1-CH2 4.44Å; I169-W406 HydrophobicContact CD1-CZ3 3.61Å; I169-W406 HydrophobicContact CG1-CD2 3.99Å; I169-W406 HydrophobicContact CG1-CE3 3.71Å; I169-W406 HydrophobicContact CG1-CH2 4.12Å; I169-W406 HydrophobicContact CG1-CZ2 4.4Å; I169-W406 HydrophobicContact CG1-CZ3 3.79Å; I169-W406 HydrophobicContact CG2-CZ3 4.45Å; I169-H410 VanDerWaalsContact CD1-NE2 3.31Å; I169-H410 WeakPolarHBondContact CD1-NE2 3.21Å
170	F	95.4	Very high	94.2	Very high	4 Å²	4	12.3 Å²	12.3	2%	0.018	8%	0.075	C	C	.	.	H	α-helix	trans	-65.2	-46.3	175.6	-76.9	-63.7	0	0	0	112	A166 A167 N168 S172 T173 I174 S211 M214 A215 T257 F260 Q261	A166-F170 WeakPolarHBondContact O-CD2 2.97Å; A166-F170 PolarHBondContact O-N 3.23Å; A167-F170 PolarHBondContact O-N 2.92Å; N168-F170 VanDerWaalsContact C-N 3.31Å; N168-F170 PolarHBondContact O-N 3.46Å; F170-S172 PolarHBondContact O-N 3.05Å; F170-T173 PolarHBondContact O-N 3.4Å; F170-I174 VanDerWaalsContact O-CG1 3.29Å; F170-I174 WeakPolarHBondContact O-CG1 3.42Å; F170-I174 PolarHBondContact O-N 2.94Å; F170-S211 VanDerWaalsContact CB-OG 3.26Å; F170-S211 WeakPolarHBondContact CB-OG 3.49Å; F170-M214 HydrophobicContact CD1-CB 4.35Å; F170-M214 HydrophobicContact CD2-CB 3.81Å; F170-M214 HydrophobicContact CE1-CB 3.99Å; F170-M214 HydrophobicContact CE1-CE 4.04Å; F170-M214 HydrophobicContact CE1-CG 4.43Å; F170-M214 HydrophobicContact CE2-CB 3.42Å; F170-M214 VanDerWaalsContact CE2-CB 3.42Å; F170-M214 HydrophobicContact CG-CB 4.27Å; F170-M214 HydrophobicContact CZ-CB 3.52Å; F170-M214 HydrophobicContact CZ-CE 4Å; F170-M214 HydrophobicContact CZ-CG 4.34Å; F170-A215 HydrophobicContact CD2-CB 4.49Å; F170-T257 HydrophobicContact CE2-CG2 4.49Å; F170-T257 HydrophobicContact CZ-CG2 3.95Å; F170-F260 HydrophobicContact CE1-CB 4.14Å; F170-Q261 HydrophobicContact CD1-CG 3.67Å; F170-Q261 VanDerWaalsContact CD2-NE2 3.34Å; F170-Q261 HydrophobicContact CE1-CG 3.42Å; F170-Q261 VanDerWaalsContact CE1-CG 3.42Å; F170-Q261 VanDerWaalsContact CE1-NE2 3.3Å; F170-Q261 HydrophobicContact CG-CG 4.39Å; F170-Q261 HydrophobicContact CZ-CG 3.96Å
171	V	96.3	Very high	94	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-61.9	-46.2	178.6	173.7	0	0	0	0	110.8	A167 N168 T173 I174 S175 W208 S211	A167-V171 WeakPolarHBondContact O-CG2 3.43Å; A167-V171 PolarHBondContact O-N 2.77Å; N168-V171 PolarHBondContact O-N 2.92Å; V171-T173 VanDerWaalsContact C-N 3.35Å; V171-T173 PolarHBondContact O-N 3.28Å; V171-I174 PolarHBondContact O-N 2.68Å; V171-S175 VanDerWaalsContact O-CB 3.3Å; V171-S175 WeakPolarHBondContact O-CB 3.35Å; V171-S175 PolarHBondContact O-N 2.81Å; V171-S175 PolarHBondContact O-OG 3.27Å; V171-W208 HydrophobicContact CG1-CD2 4.37Å; V171-W208 HydrophobicContact CG1-CH2 4.15Å; V171-W208 HydrophobicContact CG1-CZ2 3.78Å; V171-W208 HydrophobicContact CG2-CD2 3.89Å; V171-W208 HydrophobicContact CG2-CE3 3.76Å; V171-W208 HydrophobicContact CG2-CG 4.44Å; V171-W208 HydrophobicContact CG2-CH2 4.25Å; V171-W208 HydrophobicContact CG2-CZ2 4.43Å; V171-W208 HydrophobicContact CG2-CZ3 3.95Å; V171-S211 VanDerWaalsContact CG2-CB 3.47Å; V171-S211 VanDerWaalsContact CG2-OG 3.29Å; V171-S211 WeakPolarHBondContact CG2-OG 3.44Å; V171-S211 PolarHBondContact N-OG 3.04Å
172	S	94	Very high	93.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61	-44.7	177.1	-61.7	0	0	0	0	111.4	S128 N168 F170 S175 I176 F402	S128-S172 PolarHBondContact OG-OG 2.67Å; N168-S172 WeakPolarHBondContact O-CB 3.16Å; N168-S172 PolarHBondContact O-N 3.49Å; N168-S172 PolarHBondContact O-OG 2.97Å; N168-S172 VanDerWaalsContact O-OG 3.08Å; F170-S172 PolarHBondContact O-N 3.05Å; S172-S175 WeakPolarHBondContact O-CB 3.32Å; S172-S175 PolarHBondContact O-N 3.28Å; S172-I176 WeakPolarHBondContact O-CG1 3.39Å; S172-I176 PolarHBondContact O-N 3.33Å; S172-F402 VanDerWaalsContact CB-CE2 3.43Å
173	T	93.1	Very high	93.3	Very high	4 Å²	4	15.3 Å²	15.3	3%	0.025	9%	0.086	C	C	.	.	H	α-helix	trans	-60.4	-50.4	179	-64	0	0	0	0	112	I169 F170 V171 S175 I176 I177 P265	I169-T173 WeakPolarHBondContact O-CB 3.42Å; I169-T173 PolarHBondContact O-N 3.21Å; I169-T173 PolarHBondContact O-OG1 3.49Å; F170-T173 PolarHBondContact O-N 3.4Å; V171-T173 VanDerWaalsContact C-N 3.35Å; V171-T173 PolarHBondContact O-N 3.28Å; T173-S175 VanDerWaalsContact C-N 3.28Å; T173-S175 PolarHBondContact O-N 2.94Å; T173-I176 PolarHBondContact O-N 3.48Å; T173-I177 HydrophobicContact CG2-CD1 4.22Å; T173-I177 WeakPolarHBondContact O-CG1 3.42Å; T173-I177 PolarHBondContact O-N 2.85Å; T173-P265 HydrophobicContact CG2-CB 3.65Å; T173-P265 HydrophobicContact CG2-CG 3.09Å
174	I	94.1	Very high	93	Very high	41 Å²	41	14 Å²	14	21%	0.21	8%	0.08	C	C	.	.	H	α-helix	trans	-64.4	-37.5	179.2	-64.8	163.3	0	0	0	110.3	F170 V171 I176 I177 A178 F210	F170-I174 VanDerWaalsContact O-CG1 3.29Å; F170-I174 WeakPolarHBondContact O-CG1 3.42Å; F170-I174 PolarHBondContact O-N 2.94Å; V171-I174 PolarHBondContact O-N 2.68Å; I174-I176 PolarHBondContact O-N 2.92Å; I174-I177 PolarHBondContact O-N 2.97Å; I174-A178 WeakPolarHBondContact O-CB 3.24Å; I174-A178 PolarHBondContact O-N 2.88Å; I174-F210 HydrophobicContact CD1-CD1 3.58Å; I174-F210 HydrophobicContact CD1-CE1 4.12Å
175	S	93.2	Very high	92.7	Very high	2 Å²	2	16 Å²	16	1%	0.014	9%	0.085	C	C	.	.	H	α-helix	trans	-61.7	-42.7	175.5	-58.6	0	0	0	0	111.8	N124 V171 S172 T173 A178 I179	N124-S175 PolarHBondContact ND2-OG 3Å; V171-S175 VanDerWaalsContact O-CB 3.3Å; V171-S175 WeakPolarHBondContact O-CB 3.35Å; V171-S175 PolarHBondContact O-N 2.81Å; V171-S175 PolarHBondContact O-OG 3.27Å; S172-S175 WeakPolarHBondContact O-CB 3.32Å; S172-S175 PolarHBondContact O-N 3.28Å; T173-S175 VanDerWaalsContact C-N 3.28Å; T173-S175 PolarHBondContact O-N 2.94Å; S175-A178 PolarHBondContact O-N 3.22Å; S175-I179 WeakPolarHBondContact O-CB 3.32Å; S175-I179 WeakPolarHBondContact O-CD1 3.24Å; S175-I179 WeakPolarHBondContact O-CG1 3.45Å; S175-I179 PolarHBondContact O-N 2.93Å
176	I	91.7	Very high	92.4	Very high	8 Å²	8	17.4 Å²	17.4	4%	0.041	10%	0.096	C	C	.	.	H	α-helix	trans	-65	-43.6	177	-70.1	167.8	0	0	0	111	L125 S172 T173 I174 I179 A180 V269 T399 F402	L125-I176 HydrophobicContact CD2-CG1 4.3Å; S172-I176 WeakPolarHBondContact O-CG1 3.39Å; S172-I176 PolarHBondContact O-N 3.33Å; T173-I176 PolarHBondContact O-N 3.48Å; I174-I176 PolarHBondContact O-N 2.92Å; I176-I179 PolarHBondContact O-N 3.35Å; I176-A180 WeakPolarHBondContact O-CB 3.26Å; I176-A180 PolarHBondContact O-N 3.26Å; I176-V269 HydrophobicContact CG2-CG2 4.2Å; I176-T399 HydrophobicContact CG2-CG2 3.88Å; I176-F402 HydrophobicContact CD1-CB 3.56Å; I176-F402 HydrophobicContact CD1-CD1 3.49Å; I176-F402 VanDerWaalsContact CD1-CD1 3.49Å; I176-F402 HydrophobicContact CD1-CD2 3.54Å; I176-F402 HydrophobicContact CD1-CE1 4.02Å; I176-F402 HydrophobicContact CD1-CE2 4.06Å; I176-F402 HydrophobicContact CD1-CG 3.22Å; I176-F402 HydrophobicContact CD1-CZ 4.27Å
177	I	92.9	Very high	92	Very high	24 Å²	24	17 Å²	17	12%	0.123	9%	0.092	C	C	.	.	H	α-helix	trans	-60.3	-47.3	174.8	-66.8	169.6	0	0	0	110.2	T173 I174 I179 A180 L181 L264 P265 V269	T173-I177 HydrophobicContact CG2-CD1 4.22Å; T173-I177 WeakPolarHBondContact O-CG1 3.42Å; T173-I177 PolarHBondContact O-N 2.85Å; I174-I177 PolarHBondContact O-N 2.97Å; I177-I179 VanDerWaalsContact C-N 3.32Å; I177-I179 PolarHBondContact O-N 3.13Å; I177-A180 PolarHBondContact O-N 3.27Å; I177-A180 VanDerWaalsContact O-N 3.16Å; I177-L181 HydrophobicContact CG2-CD1 3.79Å; I177-L181 HydrophobicContact CG2-CG 4.18Å; I177-L181 WeakPolarHBondContact O-CB 3.33Å; I177-L181 WeakPolarHBondContact O-CG 3.27Å; I177-L181 PolarHBondContact O-N 2.97Å; I177-L264 HydrophobicContact CD1-CD2 4.05Å; I177-P265 HydrophobicContact CD1-CB 4.02Å; I177-P265 HydrophobicContact CD1-CG 4.1Å; I177-P265 HydrophobicContact CG1-CB 4.28Å; I177-V269 HydrophobicContact CG1-CG2 4.1Å
178	A	92.3	Very high	91.7	Very high	16 Å²	16	17.6 Å²	17.6	13%	0.132	10%	0.095	C	C	.	.	H	α-helix	trans	-60.5	-42.2	179.1	0	0	0	0	0	111.8	F121 I174 S175 L181 D182	F121-A178 HydrophobicContact CD1-CB 3.85Å; F121-A178 HydrophobicContact CE1-CB 3.8Å; F121-A178 HydrophobicContact CG-CB 4.27Å; F121-A178 HydrophobicContact CZ-CB 4.15Å; I174-A178 WeakPolarHBondContact O-CB 3.24Å; I174-A178 PolarHBondContact O-N 2.88Å; S175-A178 PolarHBondContact O-N 3.22Å; A178-L181 PolarHBondContact O-N 3.04Å; A178-D182 WeakPolarHBondContact O-CB 3.49Å; A178-D182 PolarHBondContact O-N 3.3Å
179	I	90.4	Very high	91.3	Very high	8 Å²	8	22.7 Å²	22.7	4%	0.041	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-47.5	174	-68.7	163.7	0	0	0	110.4	F121 I122 L125 S175 I176 I177 L181 D182 R183 L395	F121-I179 HydrophobicContact CB-CD1 4.31Å; F121-I179 HydrophobicContact CB-CG1 3.68Å; I122-I179 HydrophobicContact CG1-CD1 4.44Å; L125-I179 HydrophobicContact CD2-CD1 4.32Å; S175-I179 WeakPolarHBondContact O-CB 3.32Å; S175-I179 WeakPolarHBondContact O-CD1 3.24Å; S175-I179 WeakPolarHBondContact O-CG1 3.45Å; S175-I179 PolarHBondContact O-N 2.93Å; I176-I179 PolarHBondContact O-N 3.35Å; I177-I179 VanDerWaalsContact C-N 3.32Å; I177-I179 PolarHBondContact O-N 3.13Å; I179-L181 VanDerWaalsContact C-N 3.35Å; I179-L181 PolarHBondContact O-N 3.43Å; I179-D182 PolarHBondContact O-N 3.23Å; I179-R183 VanDerWaalsContact O-CG 3.23Å; I179-R183 WeakPolarHBondContact O-CG 3.41Å; I179-R183 PolarHBondContact O-N 3.36Å; I179-L395 HydrophobicContact CG2-CD1 3.88Å; I179-L395 HydrophobicContact CG2-CD2 3.54Å; I179-L395 HydrophobicContact CG2-CG 4.25Å
180	A	90.5	Very high	90.8	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-61.7	-41.9	179.6	0	0	0	0	0	112.3	I176 I177 R183 L184 V269 A272	I176-A180 WeakPolarHBondContact O-CB 3.26Å; I176-A180 PolarHBondContact O-N 3.26Å; I177-A180 PolarHBondContact O-N 3.27Å; I177-A180 VanDerWaalsContact O-N 3.16Å; A180-R183 PolarHBondContact O-N 3.31Å; A180-L184 WeakPolarHBondContact O-CB 3.4Å; A180-L184 PolarHBondContact O-N 3.48Å; A180-V269 HydrophobicContact CB-CB 4.46Å; A180-V269 HydrophobicContact CB-CG1 3.98Å; A180-V269 HydrophobicContact CB-CG2 4.07Å; A180-A272 HydrophobicContact CB-CB 4.12Å
181	L	90.9	Very high	89.9	Confident	73 Å²	73	29.5 Å²	29.5	38%	0.382	16%	0.158	S	C	.	.	H	α-helix	trans	-69.6	-39	178.4	-67.4	179.2	0	0	0	112.8	I177 A178 I179 R183 L184 Q185	I177-L181 HydrophobicContact CG2-CD1 3.79Å; I177-L181 HydrophobicContact CG2-CG 4.18Å; I177-L181 WeakPolarHBondContact O-CB 3.33Å; I177-L181 WeakPolarHBondContact O-CG 3.27Å; I177-L181 PolarHBondContact O-N 2.97Å; A178-L181 PolarHBondContact O-N 3.04Å; I179-L181 VanDerWaalsContact C-N 3.35Å; I179-L181 PolarHBondContact O-N 3.43Å; L181-R183 VanDerWaalsContact C-N 3.25Å; L181-R183 PolarHBondContact O-N 3.2Å; L181-L184 HydrophobicContact CD2-CD2 4.16Å; L181-L184 PolarHBondContact O-N 3.41Å; L181-Q185 WeakPolarHBondContact O-CB 3.24Å; L181-Q185 PolarHBondContact O-N 3.4Å
182	D	88.5	Confident	88.5	Confident	20 Å²	20	39.6 Å²	39.6	11%	0.107	20%	0.202	C	C	.	.	H	α-helix	trans	-54.3	-45.3	170.8	172.2	78.5	0	0	0	110.7	R118 A178 I179 Q185 V186	R118-D182 IonicContact CZ-OD2 3.66Å; R118-D182 IonicContact NE-OD2 3.75Å; R118-D182 PolarHBondContact NE-OD2 3.2Å; R118-D182 IonicContact NH2-OD2 3.93Å; R118-D182 PolarHBondContact NH2-OD2 3.11Å; R118-D182 VanDerWaalsContact NH2-OD2 3.13Å; A178-D182 WeakPolarHBondContact O-CB 3.49Å; A178-D182 PolarHBondContact O-N 3.3Å; I179-D182 PolarHBondContact O-N 3.23Å; D182-Q185 PolarHBondContact O-N 3.26Å; D182-V186 WeakPolarHBondContact O-CB 3.46Å; D182-V186 VanDerWaalsContact O-CG2 3.31Å; D182-V186 WeakPolarHBondContact O-CG2 3.27Å; D182-V186 PolarHBondContact O-N 2.78Å
183	R	88.1	Confident	87.3	Confident	11 Å²	11	46.3 Å²	46.3	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-69.7	-40.4	-179.5	-58.5	-63.1	-76.5	-170.6	-1.8	112	I179 A180 L181 Q185 V186 I187 I276 T391 N392 L395	I179-R183 VanDerWaalsContact O-CG 3.23Å; I179-R183 WeakPolarHBondContact O-CG 3.41Å; I179-R183 PolarHBondContact O-N 3.36Å; A180-R183 PolarHBondContact O-N 3.31Å; L181-R183 VanDerWaalsContact C-N 3.25Å; L181-R183 PolarHBondContact O-N 3.2Å; R183-Q185 VanDerWaalsContact C-N 3.33Å; R183-V186 PolarHBondContact O-N 3.35Å; R183-I187 WeakPolarHBondContact O-CB 3.48Å; R183-I187 VanDerWaalsContact O-CG1 3.3Å; R183-I187 WeakPolarHBondContact O-CG1 3.45Å; R183-I187 PolarHBondContact O-N 3.21Å; R183-I276 HydrophobicContact CB-CD1 3.88Å; R183-T391 VanDerWaalsContact CZ-CG2 3.47Å; R183-N392 PolarHBondContact NE-OD1 2.64Å; R183-N392 PolarHBondContact NH2-OD1 3.29Å; R183-L395 HydrophobicContact CG-CD1 3.47Å; R183-L395 VanDerWaalsContact CG-CD1 3.47Å
184	L	89.9	Confident	86.3	Confident	13 Å²	13	50.6 Å²	50.6	7%	0.068	27%	0.265	C	S	.	.	H	α-helix	trans	-57.7	-49.4	175	178.7	64.8	0	0	0	110.2	A180 L181 V188 Y271 A272 R275 I276	A180-L184 WeakPolarHBondContact O-CB 3.4Å; A180-L184 PolarHBondContact O-N 3.48Å; L181-L184 HydrophobicContact CD2-CD2 4.16Å; L181-L184 PolarHBondContact O-N 3.41Å; L184-V188 HydrophobicContact CD1-CB 4.05Å; L184-V188 HydrophobicContact CD1-CG2 3.61Å; L184-V188 VanDerWaalsContact O-CB 3.27Å; L184-V188 WeakPolarHBondContact O-CB 3.33Å; L184-V188 PolarHBondContact O-N 3.33Å; L184-Y271 HydrophobicContact CD2-CE1 4.18Å; L184-A272 HydrophobicContact CB-CB 4.29Å; L184-A272 HydrophobicContact CD2-CB 4.27Å; L184-R275 HydrophobicContact CD1-CB 3.59Å; L184-R275 HydrophobicContact CD1-CG 4.45Å; L184-I276 HydrophobicContact CB-CD1 4.47Å; L184-I276 HydrophobicContact CD1-CG1 4.27Å
185	Q	90.5	Very high	85.4	Confident	59 Å²	59	50.9 Å²	50.9	28%	0.276	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-55.9	177.7	-173.9	178	-4.5	0	0	110.8	L181 D182 R183 I187 Y189 T191 N193	L181-Q185 WeakPolarHBondContact O-CB 3.24Å; L181-Q185 PolarHBondContact O-N 3.4Å; D182-Q185 PolarHBondContact O-N 3.26Å; R183-Q185 VanDerWaalsContact C-N 3.33Å; Q185-I187 PolarHBondContact O-N 2.82Å; Q185-I187 VanDerWaalsContact O-N 3.15Å; Q185-Y189 CarbonylContact O-C 3.54Å; Q185-Y189 WeakPolarHBondContact O-CA 3.26Å; Q185-Y189 PolarHBondContact O-N 3Å; Q185-T191 PolarHBondContact NE2-OG1 3.41Å; Q185-T191 VanDerWaalsContact NE2-OG1 3.1Å; Q185-N193 PolarHBondContact NE2-O 3.47Å
186	V	86.9	Confident	85.1	Confident	55 Å²	55	58.6 Å²	58.6	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-31.7	-175.5	170.2	0	0	0	0	113.3	D182 R183	D182-V186 WeakPolarHBondContact O-CB 3.46Å; D182-V186 VanDerWaalsContact O-CG2 3.31Å; D182-V186 WeakPolarHBondContact O-CG2 3.27Å; D182-V186 PolarHBondContact O-N 2.78Å; R183-V186 PolarHBondContact O-N 3.35Å
187	I	87.2	Confident	84.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-95.6	-47.1	-173.9	-62.8	176.3	0	0	0	112.2	R183 Q185 I276 R279 I280 R283 N392	R183-I187 WeakPolarHBondContact O-CB 3.48Å; R183-I187 VanDerWaalsContact O-CG1 3.3Å; R183-I187 WeakPolarHBondContact O-CG1 3.45Å; R183-I187 PolarHBondContact O-N 3.21Å; Q185-I187 PolarHBondContact O-N 2.82Å; Q185-I187 VanDerWaalsContact O-N 3.15Å; I187-I276 HydrophobicContact CD1-CG2 4.02Å; I187-I276 HydrophobicContact CG2-CG2 4.47Å; I187-R279 HydrophobicContact CG2-CG 4.25Å; I187-I280 HydrophobicContact CG2-CG1 4.38Å; I187-R283 PolarHBondContact O-NH2 2.88Å; I187-N392 WeakPolarHBondContact CD1-ND2 3.35Å; I187-N392 WeakPolarHBondContact CD1-OD1 3.29Å
188	V	90.1	Very high	84.7	Confident	16 Å²	16	65.4 Å²	65.4	10%	0.097	34%	0.342	C	S	.	.	H	α-helix	trans	-86.9	-43.7	-173	-176.8	0	0	0	0	111	L184 P190 R275 I276 R279	L184-V188 HydrophobicContact CD1-CB 4.05Å; L184-V188 HydrophobicContact CD1-CG2 3.61Å; L184-V188 VanDerWaalsContact O-CB 3.27Å; L184-V188 WeakPolarHBondContact O-CB 3.33Å; L184-V188 PolarHBondContact O-N 3.33Å; V188-P190 VanDerWaalsContact C-CD 3.43Å; V188-P190 VanDerWaalsContact O-CD 3.24Å; V188-P190 WeakPolarHBondContact O-CD 3.48Å; V188-R275 HydrophobicContact CG2-CB 4.43Å; V188-I276 HydrophobicContact CG2-CG1 4.43Å; V188-R279 HydrophobicContact CG2-CB 3.87Å; V188-R279 HydrophobicContact CG2-CG 4.2Å
189	Y	88.3	Confident	84.7	Confident	112 Å²	112	66 Å²	66	44%	0.439	35%	0.35	S	S	.	.	S	Bend	trans	-120.3	69.6	-176.5	-52.1	-69.6	0	0	0	110.4	Q185 T191 R275	Q185-Y189 CarbonylContact O-C 3.54Å; Q185-Y189 WeakPolarHBondContact O-CA 3.26Å; Q185-Y189 PolarHBondContact O-N 3Å; Y189-T191 VanDerWaalsContact C-N 3.3Å; Y189-T191 PolarHBondContact O-N 3.45Å; Y189-R275 PolarHBondContact OH-NH1 3.24Å; Y189-R275 VanDerWaalsContact OH-NH1 3.16Å; Y189-R275 PolarHBondContact OH-NH2 3.12Å
190	P	82.1	Confident	84.8	Confident	90 Å²	90	65.7 Å²	65.7	58%	0.584	35%	0.348	S	S	*	.			trans	-62.5	92.8	179.9	27.9	-34.7	0	0	0	109.7	V188	V188-P190 VanDerWaalsContact C-CD 3.43Å; V188-P190 VanDerWaalsContact O-CD 3.24Å; V188-P190 WeakPolarHBondContact O-CD 3.48Å
191	T	76.4	Confident	85	Confident	64 Å²	64	68.1 Å²	68.1	39%	0.393	37%	0.365	S	S	.	.			trans	-87.4	144.7	177.7	50.5	0	0	0	0	109.6	Q185 Y189 N193	Q185-T191 PolarHBondContact NE2-OG1 3.41Å; Q185-T191 VanDerWaalsContact NE2-OG1 3.1Å; Y189-T191 VanDerWaalsContact C-N 3.3Å; Y189-T191 PolarHBondContact O-N 3.45Å; T191-N193 PolarHBondContact O-N 3.48Å; T191-N193 PolarHBondContact OG1-O 3.06Å
192	K	68.5	Low	85.2	Confident	213 Å²	213	69.2 Å²	69.2	93%	0.926	38%	0.375	S	S	*	.	S	Bend	trans	-63.2	-26.2	166.2	-66.6	-175.8	179.3	-179	0	111.4	T194	K192-T194 PolarHBondContact O-N 2.81Å
193	N	68.3	Low	85.5	Confident	140 Å²	140	72 Å²	72	75%	0.749	39%	0.389	S	S	*	.			trans	-90.4	86.1	176.7	-64.3	-5.7	0	0	0	109.9	Q185 T191	Q185-N193 PolarHBondContact NE2-O 3.47Å; T191-N193 PolarHBondContact O-N 3.48Å; T191-N193 PolarHBondContact OG1-O 3.06Å
194	T	72.4	Confident	85.9	Confident	95 Å²	95	72.8 Å²	72.8	58%	0.583	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-81.7	146.5	168.9	54.9	0	0	0	0	110.2	K192 K196	K192-T194 PolarHBondContact O-N 2.81Å; T194-K196 PolarHBondContact O-N 3.14Å
195	V	75	Confident	86.3	Confident	47 Å²	47	77.3 Å²	77.3	29%	0.285	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-53	124.2	173.8	179.4	0	0	0	0	109.2	P117 A200	P117-V195 WeakPolarHBondContact CG-O 3.29Å; V195-A200 HydrophobicContact CG1-CB 4.38Å
196	K	86	Confident	86.6	Confident	163 Å²	163	76.1 Å²	76.1	71%	0.709	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-78.2	162.2	174.1	-64.4	-178	-178.9	179.1	0	109.9	T194 T198 G199 A200	T194-K196 PolarHBondContact O-N 3.14Å; K196-T198 PolarHBondContact O-N 3.26Å; K196-G199 PolarHBondContact O-N 2.89Å; K196-A200 PolarHBondContact O-N 3.41Å; K196-A200 VanDerWaalsContact O-N 3.12Å
197	N	86.9	Confident	87.1	Confident	69 Å²	69	73.9 Å²	73.9	37%	0.369	41%	0.407	S	S	.	.	H	α-helix	trans	-53	-39.1	176.4	-75	3	0	0	0	112.4	R115 P117 L120 G199 A200 S201	R115-N197 PolarHBondContact O-ND2 2.91Å; P117-N197 WeakPolarHBondContact CD-OD1 3.42Å; P117-N197 VanDerWaalsContact CG-OD1 3.28Å; P117-N197 WeakPolarHBondContact CG-OD1 3.15Å; L120-N197 HydrophobicContact CD1-CB 4.18Å; N197-G199 VanDerWaalsContact C-N 3.34Å; N197-G199 PolarHBondContact O-N 3.2Å; N197-A200 PolarHBondContact O-N 3.36Å; N197-S201 PolarHBondContact O-N 3.08Å; N197-S201 PolarHBondContact O-OG 3.34Å
198	T	90.1	Very high	87.6	Confident	107 Å²	107	76.7 Å²	76.7	66%	0.656	42%	0.418	S	S	*	.	H	α-helix	trans	-58	-43.9	175.2	-43.9	0	0	0	0	112.5	K196 S201 V202	K196-T198 PolarHBondContact O-N 3.26Å; T198-S201 PolarHBondContact O-N 3.13Å; T198-V202 WeakPolarHBondContact O-CG2 3.3Å; T198-V202 PolarHBondContact O-N 3.15Å
199	G	91.4	Very high	88	Confident	29 Å²	29	80.9 Å²	80.9	30%	0.299	44%	0.439	S	S	.	.	H	α-helix	trans	-65.5	-40.3	177.8	0	0	0	0	0	112.1	K196 N197 V202 I203	K196-G199 PolarHBondContact O-N 2.89Å; N197-G199 VanDerWaalsContact C-N 3.34Å; N197-G199 PolarHBondContact O-N 3.2Å; G199-V202 PolarHBondContact O-N 3.43Å; G199-I203 WeakPolarHBondContact O-CG1 3.5Å; G199-I203 PolarHBondContact O-N 3.12Å; G199-I203 VanDerWaalsContact O-N 3.09Å
200	A	92.3	Very high	88.4	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	44%	0.437	C	S	.	.	H	α-helix	trans	-63.7	-41.5	174.4	0	0	0	0	0	112.1	P117 L120 F121 V195 K196 N197 V202 I203 I204	P117-A200 HydrophobicContact CB-CB 4.01Å; L120-A200 HydrophobicContact CD1-CB 4.14Å; F121-A200 HydrophobicContact CE2-CB 4.24Å; F121-A200 HydrophobicContact CZ-CB 4.03Å; V195-A200 HydrophobicContact CG1-CB 4.38Å; K196-A200 PolarHBondContact O-N 3.41Å; K196-A200 VanDerWaalsContact O-N 3.12Å; N197-A200 PolarHBondContact O-N 3.36Å; A200-V202 PolarHBondContact O-N 3.37Å; A200-I203 PolarHBondContact O-N 3.47Å; A200-I204 VanDerWaalsContact O-CG1 3.31Å; A200-I204 WeakPolarHBondContact O-CG1 3.17Å; A200-I204 PolarHBondContact O-N 3.29Å
201	S	94.7	Very high	89.1	Confident	52 Å²	52	75.5 Å²	75.5	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-61.9	-40.3	175.4	-64.2	0	0	0	0	112.7	N197 T198 I204 I205	N197-S201 PolarHBondContact O-N 3.08Å; N197-S201 PolarHBondContact O-OG 3.34Å; T198-S201 PolarHBondContact O-N 3.13Å; S201-I204 PolarHBondContact O-N 3.42Å; S201-I205 WeakPolarHBondContact O-CG1 3.28Å; S201-I205 PolarHBondContact O-N 3.47Å
202	V	95.5	Very high	90.1	Very high	97 Å²	97	76 Å²	76	59%	0.588	41%	0.409	S	S	*	.	H	α-helix	trans	-62.7	-44.4	175	171	0	0	0	0	111.2	T198 G199 A200 I204 I205 G206	T198-V202 WeakPolarHBondContact O-CG2 3.3Å; T198-V202 PolarHBondContact O-N 3.15Å; G199-V202 PolarHBondContact O-N 3.43Å; A200-V202 PolarHBondContact O-N 3.37Å; V202-I204 VanDerWaalsContact C-N 3.3Å; V202-I204 PolarHBondContact O-N 3.11Å; V202-I205 PolarHBondContact O-N 3.36Å; V202-G206 PolarHBondContact O-N 3.32Å
203	I	94.7	Very high	91.5	Very high	78 Å²	78	71.3 Å²	71.3	40%	0.4	39%	0.393	S	S	.	.	H	α-helix	trans	-62.3	-39.8	176.8	-65.4	164.9	0	0	0	110.8	F121 G199 A200 S207	F121-I203 HydrophobicContact CE1-CB 4.05Å; F121-I203 HydrophobicContact CE1-CG2 3.69Å; F121-I203 HydrophobicContact CZ-CB 4.24Å; F121-I203 HydrophobicContact CZ-CD1 4.06Å; F121-I203 HydrophobicContact CZ-CG2 4.1Å; G199-I203 WeakPolarHBondContact O-CG1 3.5Å; G199-I203 PolarHBondContact O-N 3.12Å; G199-I203 VanDerWaalsContact O-N 3.09Å; A200-I203 PolarHBondContact O-N 3.47Å; I203-S207 WeakPolarHBondContact O-CB 3.43Å; I203-S207 PolarHBondContact O-N 2.92Å
204	I	96.9	Very high	92.8	Very high	28 Å²	28	66.3 Å²	66.3	14%	0.144	37%	0.365	C	S	.	.	H	α-helix	trans	-64.2	-52.5	176.8	-72.7	166	0	0	0	110.8	L120 F121 N124 A200 S201 V202 G206 S207 W208	L120-I204 HydrophobicContact CB-CD1 3.97Å; F121-I204 HydrophobicContact CD1-CD1 4.42Å; F121-I204 HydrophobicContact CD1-CG1 4.1Å; F121-I204 HydrophobicContact CE1-CG1 4.14Å; N124-I204 HydrophobicContact CB-CD1 4.14Å; N124-I204 HydrophobicContact CB-CG1 4.06Å; N124-I204 HydrophobicContact CB-CG2 4.48Å; N124-I204 VanDerWaalsContact OD1-CG2 3.28Å; N124-I204 WeakPolarHBondContact OD1-CG2 3.35Å; A200-I204 VanDerWaalsContact O-CG1 3.31Å; A200-I204 WeakPolarHBondContact O-CG1 3.17Å; A200-I204 PolarHBondContact O-N 3.29Å; S201-I204 PolarHBondContact O-N 3.42Å; V202-I204 VanDerWaalsContact C-N 3.3Å; V202-I204 PolarHBondContact O-N 3.11Å; I204-G206 VanDerWaalsContact C-N 3.29Å; I204-G206 PolarHBondContact O-N 3.41Å; I204-S207 PolarHBondContact O-N 3.43Å; I204-S207 VanDerWaalsContact O-N 3.11Å; I204-S207 PolarHBondContact O-OG 3.17Å; I204-W208 PolarHBondContact O-N 2.61Å; I204-W208 VanDerWaalsContact O-N 3.13Å
205	I	97.6	Very high	93.9	Very high	107 Å²	107	61.8 Å²	61.8	55%	0.549	34%	0.338	S	S	.	.	H	α-helix	trans	-60.4	-43.6	179.9	-66.6	165.3	0	0	0	110.4	S201 V202 S207 W208 L209	S201-I205 WeakPolarHBondContact O-CG1 3.28Å; S201-I205 PolarHBondContact O-N 3.47Å; V202-I205 PolarHBondContact O-N 3.36Å; I205-S207 VanDerWaalsContact C-N 3.32Å; I205-S207 PolarHBondContact O-N 3.3Å; I205-W208 PolarHBondContact O-N 2.89Å; I205-L209 HydrophobicContact CG2-CD1 4.18Å; I205-L209 WeakPolarHBondContact O-CG 3.1Å; I205-L209 PolarHBondContact O-N 3.09Å; I205-L209 VanDerWaalsContact O-N 3.09Å
206	G	97.5	Very high	94.9	Very high	35 Å²	35	62.2 Å²	62.2	36%	0.361	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-38.5	175.7	0	0	0	0	0	113	V202 I204 L209 F210	V202-G206 PolarHBondContact O-N 3.32Å; I204-G206 VanDerWaalsContact C-N 3.29Å; I204-G206 PolarHBondContact O-N 3.41Å; G206-L209 PolarHBondContact O-N 2.91Å; G206-F210 VanDerWaalsContact O-CB 3.24Å; G206-F210 WeakPolarHBondContact O-CB 2.97Å; G206-F210 PolarHBondContact O-N 2.92Å
207	S	96.4	Very high	95.4	Very high	7 Å²	7	56 Å²	56	5%	0.049	32%	0.319	C	S	.	.	H	α-helix	trans	-66.8	-38.7	178.4	75.3	0	0	0	0	112.1	I203 I204 I205 S211	I203-S207 WeakPolarHBondContact O-CB 3.43Å; I203-S207 PolarHBondContact O-N 2.92Å; I204-S207 PolarHBondContact O-N 3.43Å; I204-S207 VanDerWaalsContact O-N 3.11Å; I204-S207 PolarHBondContact O-OG 3.17Å; I205-S207 VanDerWaalsContact C-N 3.32Å; I205-S207 PolarHBondContact O-N 3.3Å; S207-S211 WeakPolarHBondContact O-CB 3.4Å; S207-S211 PolarHBondContact O-N 3.39Å; S207-S211 PolarHBondContact O-OG 2.89Å
208	W	98.2	Very high	95.8	Very high	62 Å²	62	55 Å²	55	24%	0.235	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-50.3	173.7	-78.1	97.4	0	0	0	112	N124 I127 I131 V171 I204 I205 F210 S211 L212	N124-W208 PolarHBondContact OD1-NE1 3.25Å; I127-W208 HydrophobicContact CG2-CZ2 4.1Å; I131-W208 HydrophobicContact CD1-CH2 3.69Å; I131-W208 HydrophobicContact CD1-CZ3 4.14Å; V171-W208 HydrophobicContact CG1-CD2 4.37Å; V171-W208 HydrophobicContact CG1-CH2 4.15Å; V171-W208 HydrophobicContact CG1-CZ2 3.78Å; V171-W208 HydrophobicContact CG2-CD2 3.89Å; V171-W208 HydrophobicContact CG2-CE3 3.76Å; V171-W208 HydrophobicContact CG2-CG 4.44Å; V171-W208 HydrophobicContact CG2-CH2 4.25Å; V171-W208 HydrophobicContact CG2-CZ2 4.43Å; V171-W208 HydrophobicContact CG2-CZ3 3.95Å; I204-W208 PolarHBondContact O-N 2.61Å; I204-W208 VanDerWaalsContact O-N 3.13Å; I205-W208 PolarHBondContact O-N 2.89Å; W208-F210 PolarHBondContact O-N 3.13Å; W208-S211 PolarHBondContact O-N 3.18Å; W208-L212 VanDerWaalsContact O-CG 3.31Å; W208-L212 WeakPolarHBondContact O-CG 3.3Å; W208-L212 PolarHBondContact O-N 3.48Å
209	L	98.1	Very high	96	Very high	104 Å²	104	54 Å²	54	55%	0.545	30%	0.299	S	S	.	.	H	α-helix	trans	-59.9	-48	179.5	-68.4	175.8	0	0	0	111.5	I205 G206 S211 L212 I213	I205-L209 HydrophobicContact CG2-CD1 4.18Å; I205-L209 WeakPolarHBondContact O-CG 3.1Å; I205-L209 PolarHBondContact O-N 3.09Å; I205-L209 VanDerWaalsContact O-N 3.09Å; G206-L209 PolarHBondContact O-N 2.91Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 2.93Å; L209-L212 PolarHBondContact O-N 3.33Å; L209-I213 VanDerWaalsContact O-CG1 3.28Å; L209-I213 WeakPolarHBondContact O-CG1 3.5Å; L209-I213 PolarHBondContact O-N 3.5Å
210	F	97	Very high	96.1	Very high	89 Å²	89	57.7 Å²	57.7	39%	0.39	31%	0.311	S	S	.	.	H	α-helix	trans	-61.2	-42.3	177.3	179	-95	0	0	0	112	I174 G206 W208 L212 I213 M214	I174-F210 HydrophobicContact CD1-CD1 3.58Å; I174-F210 HydrophobicContact CD1-CE1 4.12Å; G206-F210 VanDerWaalsContact O-CB 3.24Å; G206-F210 WeakPolarHBondContact O-CB 2.97Å; G206-F210 PolarHBondContact O-N 2.92Å; W208-F210 PolarHBondContact O-N 3.13Å; F210-L212 PolarHBondContact O-N 2.82Å; F210-I213 PolarHBondContact O-N 2.9Å; F210-M214 HydrophobicContact CD1-CG 4.08Å; F210-M214 HydrophobicContact CD2-CG 4.45Å; F210-M214 HydrophobicContact CE1-CG 3.64Å; F210-M214 HydrophobicContact CE2-CG 4.03Å; F210-M214 HydrophobicContact CE2-SD 4.36Å; F210-M214 HydrophobicContact CG-CG 4.48Å; F210-M214 HydrophobicContact CZ-CE 4.44Å; F210-M214 HydrophobicContact CZ-CG 3.61Å; F210-M214 HydrophobicContact CZ-SD 4.01Å; F210-M214 WeakPolarHBondContact O-CB 3.39Å; F210-M214 WeakPolarHBondContact O-CG 3.2Å; F210-M214 PolarHBondContact O-N 3.48Å
211	S	97.6	Very high	96.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-40.1	178.6	-61.5	0	0	0	0	112.4	F170 V171 S207 W208 L209 M214 A215	F170-S211 VanDerWaalsContact CB-OG 3.26Å; F170-S211 WeakPolarHBondContact CB-OG 3.49Å; V171-S211 VanDerWaalsContact CG2-CB 3.47Å; V171-S211 VanDerWaalsContact CG2-OG 3.29Å; V171-S211 WeakPolarHBondContact CG2-OG 3.44Å; V171-S211 PolarHBondContact N-OG 3.04Å; S207-S211 WeakPolarHBondContact O-CB 3.4Å; S207-S211 PolarHBondContact O-N 3.39Å; S207-S211 PolarHBondContact O-OG 2.89Å; W208-S211 PolarHBondContact O-N 3.18Å; L209-S211 VanDerWaalsContact C-N 3.34Å; L209-S211 PolarHBondContact O-N 2.93Å; S211-M214 PolarHBondContact O-N 3.44Å; S211-A215 WeakPolarHBondContact O-CB 3.33Å; S211-A215 PolarHBondContact O-N 2.85Å
212	L	97.2	Very high	96.2	Very high	74 Å²	74	56.4 Å²	56.4	39%	0.387	30%	0.3	S	S	.	.	H	α-helix	trans	-66.5	-40.2	176	-70.4	169	0	0	0	111.6	M163 A167 W208 L209 F210 A215 S216	M163-L212 HydrophobicContact CE-CB 4.21Å; M163-L212 HydrophobicContact CE-CD2 3.8Å; M163-L212 WeakPolarHBondContact CE-O 3.48Å; A167-L212 HydrophobicContact CB-CD2 4.09Å; W208-L212 VanDerWaalsContact O-CG 3.31Å; W208-L212 WeakPolarHBondContact O-CG 3.3Å; W208-L212 PolarHBondContact O-N 3.48Å; L209-L212 PolarHBondContact O-N 3.33Å; F210-L212 PolarHBondContact O-N 2.82Å; L212-A215 PolarHBondContact O-N 3.09Å; L212-S216 PolarHBondContact O-N 3.36Å
213	I	97.1	Very high	96.1	Very high	115 Å²	115	52.4 Å²	52.4	59%	0.59	28%	0.276	S	S	*	.	H	α-helix	trans	-61.4	-51	174.7	-69.1	164.3	0	0	0	110	L209 F210 A215 S216	L209-I213 VanDerWaalsContact O-CG1 3.28Å; L209-I213 WeakPolarHBondContact O-CG1 3.5Å; L209-I213 PolarHBondContact O-N 3.5Å; F210-I213 PolarHBondContact O-N 2.9Å; I213-A215 VanDerWaalsContact C-N 3.27Å; I213-A215 PolarHBondContact O-N 2.83Å; I213-S216 WeakPolarHBondContact O-CB 3.34Å; I213-S216 PolarHBondContact O-N 2.9Å; I213-S216 PolarHBondContact O-OG 3.28Å
214	M	95.5	Very high	96.2	Very high	35 Å²	35	49.8 Å²	49.8	17%	0.172	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-29.3	-179.8	-69.5	-68.2	-75.5	0	0	112.8	F170 F210 S211 P217 Y253 F260	F170-M214 HydrophobicContact CD1-CB 4.35Å; F170-M214 HydrophobicContact CD2-CB 3.81Å; F170-M214 HydrophobicContact CE1-CB 3.99Å; F170-M214 HydrophobicContact CE1-CE 4.04Å; F170-M214 HydrophobicContact CE1-CG 4.43Å; F170-M214 HydrophobicContact CE2-CB 3.42Å; F170-M214 VanDerWaalsContact CE2-CB 3.42Å; F170-M214 HydrophobicContact CG-CB 4.27Å; F170-M214 HydrophobicContact CZ-CB 3.52Å; F170-M214 HydrophobicContact CZ-CE 4Å; F170-M214 HydrophobicContact CZ-CG 4.34Å; F210-M214 HydrophobicContact CD1-CG 4.08Å; F210-M214 HydrophobicContact CD2-CG 4.45Å; F210-M214 HydrophobicContact CE1-CG 3.64Å; F210-M214 HydrophobicContact CE2-CG 4.03Å; F210-M214 HydrophobicContact CE2-SD 4.36Å; F210-M214 HydrophobicContact CG-CG 4.48Å; F210-M214 HydrophobicContact CZ-CE 4.44Å; F210-M214 HydrophobicContact CZ-CG 3.61Å; F210-M214 HydrophobicContact CZ-SD 4.01Å; F210-M214 WeakPolarHBondContact O-CB 3.39Å; F210-M214 WeakPolarHBondContact O-CG 3.2Å; F210-M214 PolarHBondContact O-N 3.48Å; S211-M214 PolarHBondContact O-N 3.44Å; M214-P217 WeakPolarHBondContact O-CD 3.28Å; M214-Y253 WeakPolarHBondContact O-CE2 3.3Å; M214-Y253 PolarHBondContact O-OH 3.08Å; M214-F260 HydrophobicContact CE-CB 4.4Å; M214-F260 HydrophobicContact CE-CD1 4.17Å; M214-F260 HydrophobicContact CE-CD2 4.04Å; M214-F260 HydrophobicContact CE-CE1 4.46Å; M214-F260 HydrophobicContact CE-CE2 4.33Å; M214-F260 HydrophobicContact CE-CG 3.95Å
215	A	96.9	Very high	95.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-83.1	-17.3	177	0	0	0	0	0	114.1	M163 A166 A167 F170 S211 L212 I213 P217 M218	M163-A215 HydrophobicContact CG-CB 4.04Å; A166-A215 HydrophobicContact CB-CB 3.72Å; A167-A215 HydrophobicContact CB-CB 3.85Å; F170-A215 HydrophobicContact CD2-CB 4.49Å; S211-A215 WeakPolarHBondContact O-CB 3.33Å; S211-A215 PolarHBondContact O-N 2.85Å; L212-A215 PolarHBondContact O-N 3.09Å; I213-A215 VanDerWaalsContact C-N 3.27Å; I213-A215 PolarHBondContact O-N 2.83Å; A215-P217 VanDerWaalsContact C-N 3.33Å; A215-M218 WeakPolarHBondContact O-CB 3.38Å; A215-M218 WeakPolarHBondContact O-CG 3.23Å; A215-M218 PolarHBondContact O-N 3.42Å; A215-M218 VanDerWaalsContact O-N 3.1Å
216	S	96.2	Very high	95.5	Very high	55 Å²	55	45.7 Å²	45.7	39%	0.385	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.7	-174.7	69.1	0	0	0	0	115.5	L212 I213 M218 F219	L212-S216 PolarHBondContact O-N 3.36Å; I213-S216 WeakPolarHBondContact O-CB 3.34Å; I213-S216 PolarHBondContact O-N 2.9Å; I213-S216 PolarHBondContact O-OG 3.28Å; S216-M218 PolarHBondContact O-N 3.48Å; S216-M218 VanDerWaalsContact O-N 3.13Å; S216-F219 WeakPolarHBondContact O-CB 3.46Å; S216-F219 PolarHBondContact O-N 3.46Å
217	P	96.1	Very high	94.7	Very high	33 Å²	33	45.4 Å²	45.4	21%	0.214	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-26.1	177.2	-26	38	0	0	0	113.8	M214 A215 F219 I220 F221 Y253	M214-P217 WeakPolarHBondContact O-CD 3.28Å; A215-P217 VanDerWaalsContact C-N 3.33Å; P217-F219 PolarHBondContact O-N 3.31Å; P217-F219 VanDerWaalsContact O-N 3.16Å; P217-I220 PolarHBondContact O-N 3.22Å; P217-F221 HydrophobicContact CB-CD2 4.23Å; P217-F221 HydrophobicContact CB-CE2 3.62Å; P217-F221 HydrophobicContact CB-CZ 4.24Å; P217-F221 VanDerWaalsContact O-CD2 3.25Å; P217-F221 WeakPolarHBondContact O-CD2 3.45Å; P217-F221 PolarHBondContact O-N 3.43Å; P217-F221 VanDerWaalsContact O-N 3.15Å; P217-Y253 HydrophobicContact CB-CD2 3.93Å; P217-Y253 HydrophobicContact CB-CE2 3.89Å; P217-Y253 HydrophobicContact CB-CG 4.43Å; P217-Y253 HydrophobicContact CG-CD2 3.92Å; P217-Y253 HydrophobicContact CG-CE2 3.72Å
218	M	94.5	Very high	93.8	Very high	47 Å²	47	46.7 Å²	46.7	23%	0.232	24%	0.243	C	C	.	.	H	α-helix	trans	-59.2	-27.2	174.7	-66.2	-60.5	-65.5	0	0	112.7	A162 M163 A166 A215 S216 I220 T222 Y253	A162-M218 HydrophobicContact CB-CB 4.37Å; A162-M218 HydrophobicContact CB-CE 3.96Å; M163-M218 HydrophobicContact CB-CB 4.41Å; A166-M218 HydrophobicContact CB-CG 3.73Å; A215-M218 WeakPolarHBondContact O-CB 3.38Å; A215-M218 WeakPolarHBondContact O-CG 3.23Å; A215-M218 PolarHBondContact O-N 3.42Å; A215-M218 VanDerWaalsContact O-N 3.1Å; S216-M218 PolarHBondContact O-N 3.48Å; S216-M218 VanDerWaalsContact O-N 3.13Å; M218-I220 VanDerWaalsContact C-N 3.25Å; M218-I220 PolarHBondContact O-N 3.39Å; M218-T222 WeakPolarHBondContact O-CB 3.4Å; M218-T222 PolarHBondContact O-N 3.39Å; M218-T222 PolarHBondContact O-OG1 2.93Å; M218-T222 VanDerWaalsContact O-OG1 3.04Å; M218-Y253 HydrophobicContact CG-CE1 4.26Å; M218-Y253 HydrophobicContact SD-CE1 3.65Å
219	F	94.7	Very high	92.8	Very high	88 Å²	88	45.6 Å²	45.6	39%	0.386	24%	0.241	S	C	.	.	H	α-helix	trans	-65.9	-30	176	-161.8	-88.2	0	0	0	111.9	K159 S216 P217	K159-F219 HydrophobicContact CB-CD2 3.51Å; K159-F219 HydrophobicContact CB-CE2 3.58Å; K159-F219 HydrophobicContact CB-CG 4.04Å; K159-F219 HydrophobicContact CB-CZ 4.18Å; K159-F219 HydrophobicContact CD-CD1 3.86Å; K159-F219 HydrophobicContact CD-CD2 4.2Å; K159-F219 HydrophobicContact CD-CE1 3.62Å; K159-F219 HydrophobicContact CD-CE2 3.97Å; K159-F219 HydrophobicContact CD-CG 4.14Å; K159-F219 HydrophobicContact CD-CZ 3.66Å; K159-F219 WeakPolarHBondContact CD-O 3.29Å; K159-F219 HydrophobicContact CG-CD2 4.36Å; K159-F219 HydrophobicContact CG-CE2 4.39Å; K159-F219 HydrophobicContact CG-CG 4.47Å; K159-F219 PolarHBondContact NZ-O 3.48Å; S216-F219 WeakPolarHBondContact O-CB 3.46Å; S216-F219 PolarHBondContact O-N 3.46Å; P217-F219 PolarHBondContact O-N 3.31Å; P217-F219 VanDerWaalsContact O-N 3.16Å
220	I	93.5	Very high	91.9	Very high	106 Å²	106	42.4 Å²	42.4	54%	0.544	22%	0.222	S	C	.	.	H	α-helix	trans	-82.6	-45.6	177.5	-60.7	173.7	0	0	0	110	P217 M218 T222 L246	P217-I220 PolarHBondContact O-N 3.22Å; M218-I220 VanDerWaalsContact C-N 3.25Å; M218-I220 PolarHBondContact O-N 3.39Å; I220-T222 VanDerWaalsContact C-N 3.25Å; I220-T222 PolarHBondContact O-N 3.43Å; I220-L246 HydrophobicContact CG2-CD2 3.94Å
221	F	94.3	Very high	90.9	Very high	15 Å²	15	42.4 Å²	42.4	7%	0.066	23%	0.231	C	C	.	.	H	α-helix	trans	-73.7	-10.3	-172.7	-56.9	-41.2	0	0	0	115.2	P217 A238 S239 T240 L246 K250 Y253	P217-F221 HydrophobicContact CB-CD2 4.23Å; P217-F221 HydrophobicContact CB-CE2 3.62Å; P217-F221 HydrophobicContact CB-CZ 4.24Å; P217-F221 VanDerWaalsContact O-CD2 3.25Å; P217-F221 WeakPolarHBondContact O-CD2 3.45Å; P217-F221 PolarHBondContact O-N 3.43Å; P217-F221 VanDerWaalsContact O-N 3.15Å; F221-A238 CarbonylContact O-C 3.32Å; F221-A238 WeakPolarHBondContact O-CA 3.42Å; F221-S239 PolarHBondContact O-N 2.91Å; F221-T240 HydrophobicContact CB-CG2 4.43Å; F221-T240 HydrophobicContact CD1-CG2 4.2Å; F221-L246 HydrophobicContact CD1-CD2 4.48Å; F221-L246 HydrophobicContact CE1-CD2 4.37Å; F221-K250 HydrophobicContact CB-CG 4.45Å; F221-K250 HydrophobicContact CD1-CB 4Å; F221-K250 HydrophobicContact CD2-CB 4.21Å; F221-K250 HydrophobicContact CD2-CG 4.17Å; F221-K250 HydrophobicContact CE1-CB 4.08Å; F221-K250 HydrophobicContact CE2-CB 4.28Å; F221-K250 HydrophobicContact CG-CB 4.09Å; F221-K250 HydrophobicContact CG-CG 4.16Å; F221-K250 HydrophobicContact CZ-CB 4.22Å; F221-Y253 HydrophobicContact CD2-CD1 4.33Å; F221-Y253 AromaticContact CE2-CD1 3.94Å; F221-Y253 HydrophobicContact CE2-CD1 3.94Å; F221-Y253 AromaticContact CE2-CG 3.9Å; F221-Y253 HydrophobicContact CE2-CG 3.9Å
222	T	94.6	Very high	90.1	Very high	10 Å²	10	48.6 Å²	48.6	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.6	-174.6	-51.9	0	0	0	0	111.3	C158 K159 A162 M218 I220	C158-T222 VanDerWaalsContact SG-CG2 3.53Å; K159-T222 WeakPolarHBondContact CE-O 3.25Å; K159-T222 VanDerWaalsContact CG-O 3.26Å; K159-T222 WeakPolarHBondContact CG-O 3.39Å; K159-T222 PolarHBondContact NZ-O 3Å; A162-T222 HydrophobicContact CB-CG2 3.94Å; A162-T222 WeakPolarHBondContact CB-OG1 3.47Å; M218-T222 WeakPolarHBondContact O-CB 3.4Å; M218-T222 PolarHBondContact O-N 3.39Å; M218-T222 PolarHBondContact O-OG1 2.93Å; M218-T222 VanDerWaalsContact O-OG1 3.04Å; I220-T222 VanDerWaalsContact C-N 3.25Å; I220-T222 PolarHBondContact O-N 3.43Å
223	S	94.8	Very high	89.7	Confident	13 Å²	13	45.1 Å²	45.1	9%	0.091	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	169.2	170.2	69.1	0	0	0	0	113.1	C158 S237 S239	C158-S223 VanDerWaalsContact SG-C 3.57Å; S223-S237 PolarHBondContact N-O 2.9Å; S223-S237 PolarHBondContact O-N 3.33Å; S223-S237 VanDerWaalsContact O-N 3.15Å; S223-S239 WeakPolarHBondContact CB-OG 3.05Å; S223-S239 PolarHBondContact N-OG 3.28Å; S223-S239 WeakPolarHBondContact OG-CB 3.5Å; S223-S239 PolarHBondContact OG-OG 3.28Å
224	V	95.1	Very high	89.5	Confident	23 Å²	23	43 Å²	43	14%	0.139	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	121.9	166.4	-177.4	0	0	0	0	108.7	W151 C158 V226 H234 I235	W151-V224 VanDerWaalsContact CD1-CG2 3.46Å; W151-V224 HydrophobicContact CG-CG2 4.4Å; C158-V224 HydrophobicContact CB-CG2 3.79Å; V224-V226 HydrophobicContact CG1-CG2 4.41Å; V224-H234 HydrophobicContact CG1-CB 4.02Å; V224-I235 CarbonylContact C-O 3.58Å; V224-I235 WeakPolarHBondContact CA-O 3.47Å
225	S	91	Very high	89.3	Confident	4 Å²	4	41.6 Å²	41.6	3%	0.028	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	131.5	172.5	-63.9	0	0	0	0	108.5	S38 H234 I235 S237	S38-S225 WeakPolarHBondContact O-CA 3.47Å; S38-S225 WeakPolarHBondContact O-CB 3.32Å; S38-S225 PolarHBondContact O-OG 3.47Å; S38-S225 VanDerWaalsContact O-OG 3.1Å; S225-H234 WeakPolarHBondContact O-CA 3.31Å; S225-I235 PolarHBondContact N-O 2.83Å; S225-I235 PolarHBondContact O-N 3.19Å; S225-S237 PolarHBondContact OG-OG 3.23Å
226	V	88.7	Confident	89.2	Confident	44 Å²	44	41.8 Å²	41.8	27%	0.267	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.4	-178.5	-168.5	0	0	0	0	108.6	S39 G40 V224 T228 G233	S39-V226 CarbonylContact C-O 3.59Å; S39-V226 WeakPolarHBondContact CA-O 3.43Å; G40-V226 PolarHBondContact N-O 3.06Å; V224-V226 HydrophobicContact CG1-CG2 4.41Å; V226-T228 VanDerWaalsContact C-N 3.35Å; V226-T228 PolarHBondContact O-N 3.33Å; V226-G233 WeakPolarHBondContact CA-O 3.48Å
227	D	81.8	Confident	89	Confident	30 Å²	30	41.3 Å²	41.3	16%	0.16	22%	0.224	C	C	.	.	S	Bend	trans	53	50.2	176.3	-56.7	-37.7	0	0	0	112.9	L42 N232 G233	L42-D227 WeakPolarHBondContact CB-O 3.38Å; L42-D227 PolarHBondContact N-O 2.94Å; D227-N232 WeakPolarHBondContact OD1-CA 3.28Å; D227-N232 PolarHBondContact OD1-N 3.18Å; D227-G233 PolarHBondContact N-O 2.72Å; D227-G233 VanDerWaalsContact N-O 3.15Å
228	T	77	Confident	88.8	Confident	34 Å²	34	41.2 Å²	41.2	21%	0.209	23%	0.227	C	C	.	.	S	Bend	trans	-105.8	-47.7	179.2	46.3	0	0	0	0	112.7	S38 V226	S38-T228 WeakPolarHBondContact O-CG2 3.48Å; V226-T228 VanDerWaalsContact C-N 3.35Å; V226-T228 PolarHBondContact O-N 3.33Å
229	I	76.9	Confident	88.5	Confident	39 Å²	39	39.8 Å²	39.8	20%	0.2	22%	0.221	C	C	.	.	S	Bend	trans	-122	-22.7	-175.5	-51.6	178.7	0	0	0	111.6	L69 Y146 W147 I235	L69-I229 VanDerWaalsContact CD1-O 3.23Å; L69-I229 WeakPolarHBondContact CD1-O 3.45Å; Y146-I229 HydrophobicContact CD2-CD1 4.37Å; Y146-I229 HydrophobicContact CE2-CD1 3.78Å; W147-I229 HydrophobicContact CE3-CG2 4.22Å; W147-I229 HydrophobicContact CH2-CD1 4.47Å; W147-I229 HydrophobicContact CH2-CG2 3.52Å; W147-I229 HydrophobicContact CZ3-CG2 3.34Å; I229-I235 HydrophobicContact CB-CD1 3.98Å; I229-I235 HydrophobicContact CD1-CD1 3.71Å; I229-I235 HydrophobicContact CG1-CD1 3.9Å
230	R	80.5	Confident	88.1	Confident	36 Å²	36	35.6 Å²	35.6	14%	0.136	20%	0.203	C	C	.	.	S	Bend	trans	-135.5	144.9	175.3	-68.9	-169.6	-61.9	-82.1	-1.1	109.8	Y146 W147 D150 N232 G233	Y146-R230 VanDerWaalsContact O-CZ 3.24Å; Y146-R230 PolarHBondContact O-NH1 3.27Å; Y146-R230 PolarHBondContact O-NH2 3.46Å; W147-R230 PolarHBondContact O-NH1 3.08Å; D150-R230 IonicContact OD1-CZ 3.59Å; D150-R230 IonicContact OD1-NE 3.65Å; D150-R230 IonicContact OD1-NH2 2.59Å; D150-R230 PolarHBondContact OD1-NH2 3.32Å; R230-N232 PolarHBondContact O-N 3.34Å; R230-G233 PolarHBondContact O-N 2.65Å
231	P	75.8	Confident	87.6	Confident	89 Å²	89	33 Å²	33	58%	0.578	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	130.5	169	-17.2	29.8	0	0	0	110	L42 L69 G233	L42-P231 HydrophobicContact CD2-CG 4.33Å; L69-P231 HydrophobicContact CD2-CG 4.42Å; P231-G233 PolarHBondContact O-N 3.44Å; P231-G233 VanDerWaalsContact O-N 3.14Å
232	N	80.6	Confident	87	Confident	130 Å²	130	36.5 Å²	36.5	70%	0.695	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	18.6	-173.7	-55.4	-59.6	0	0	0	114.7	D227 R230	D227-N232 WeakPolarHBondContact OD1-CA 3.28Å; D227-N232 PolarHBondContact OD1-N 3.18Å; R230-N232 PolarHBondContact O-N 3.34Å
233	G	87.6	Confident	86.6	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.01	22%	0.216	C	C	.	.			trans	-82.6	132.2	-178.2	0	0	0	0	0	112	D150 V226 D227 R230 P231	D150-G233 WeakPolarHBondContact OD1-CA 3.43Å; V226-G233 WeakPolarHBondContact CA-O 3.48Å; D227-G233 PolarHBondContact N-O 2.72Å; D227-G233 VanDerWaalsContact N-O 3.15Å; R230-G233 PolarHBondContact O-N 2.65Å; P231-G233 PolarHBondContact O-N 3.44Å; P231-G233 VanDerWaalsContact O-N 3.14Å
234	H	93.1	Very high	86.2	Confident	71 Å²	71	41 Å²	41	33%	0.329	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.8	175.9	-65.3	-88.5	0	0	0	110.4	D150 W151 V224 S225	D150-H234 CarbonylContact C-O 3.56Å; D150-H234 WeakPolarHBondContact CA-O 3.28Å; D150-H234 HydrophobicContact CB-CB 4.43Å; D150-H234 PolarHBondContact OD1-N 2.91Å; W151-H234 HydrophobicContact CB-CB 4.48Å; W151-H234 PolarHBondContact N-O 3.46Å; W151-H234 WeakPolarHBondContact O-CB 3.37Å; V224-H234 HydrophobicContact CG1-CB 4.02Å; S225-H234 WeakPolarHBondContact O-CA 3.31Å
235	I	92.7	Very high	86	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.8	-176.1	-61.3	173.1	0	0	0	109.6	Y146 V224 S225 I229	Y146-I235 HydrophobicContact CD2-CD1 3.92Å; Y146-I235 HydrophobicContact CD2-CG1 4.37Å; Y146-I235 HydrophobicContact CD2-CG2 4.13Å; Y146-I235 HydrophobicContact CG-CG2 4.07Å; V224-I235 CarbonylContact C-O 3.58Å; V224-I235 WeakPolarHBondContact CA-O 3.47Å; S225-I235 PolarHBondContact N-O 2.83Å; S225-I235 PolarHBondContact O-N 3.19Å; I229-I235 HydrophobicContact CB-CD1 3.98Å; I229-I235 HydrophobicContact CD1-CD1 3.71Å; I229-I235 HydrophobicContact CG1-CD1 3.9Å
236	C	94.9	Very high	86	Confident	4 Å²	4	50 Å²	50	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	109.1	172.2	177	0	0	0	0	110.2	R143 W151 C158	R143-C236 HydrophobicContact CG-CB 4.2Å; R143-C236 WeakPolarHBondContact CG-O 3.47Å; W151-C236 HydrophobicContact CB-CB 4.11Å; W151-C236 HydrophobicContact CD2-CB 3.46Å; W151-C236 VanDerWaalsContact CD2-CB 3.46Å; W151-C236 HydrophobicContact CE3-CB 3.66Å; W151-C236 HydrophobicContact CG-CB 3.65Å; W151-C236 HydrophobicContact CZ3-CB 4.3Å; C158-C236 WeakPolarHBondContact CA-SG 3.08Å; C158-C236 HydrophobicContact CB-CB 3.86Å; C158-C236 WeakPolarHBondContact CB-SG 3.47Å; C158-C236 WeakPolarHBondContact SG-CA 3.39Å; C158-C236 WeakPolarHBondContact SG-CB 3.47Å; C158-C236 CovalentContact SG-SG 2.03Å; C158-C236 PolarHBondContact SG-SG 3.09Å
237	S	91.8	Very high	86	Confident	44 Å²	44	48.7 Å²	48.7	31%	0.308	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	177	-176.1	59.4	0	0	0	0	111.6	S223 S225	S223-S237 PolarHBondContact N-O 2.9Å; S223-S237 PolarHBondContact O-N 3.33Å; S223-S237 VanDerWaalsContact O-N 3.15Å; S225-S237 PolarHBondContact OG-OG 3.23Å
238	A	90.8	Very high	86.4	Confident	32 Å²	32	50 Å²	50	26%	0.264	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	134.8	171.6	0	0	0	0	0	110.4	F221 K250	F221-A238 CarbonylContact O-C 3.32Å; F221-A238 WeakPolarHBondContact O-CA 3.42Å; A238-K250 HydrophobicContact CB-CD 4.48Å
239	S	88.5	Confident	87.2	Confident	16 Å²	16	49.7 Å²	49.7	11%	0.112	26%	0.257	C	S	.	.			trans	-117	61.1	-179.2	48	0	0	0	0	111.7	F221 S223	F221-S239 PolarHBondContact O-N 2.91Å; S223-S239 WeakPolarHBondContact CB-OG 3.05Å; S223-S239 PolarHBondContact N-OG 3.28Å; S223-S239 WeakPolarHBondContact OG-CB 3.5Å; S223-S239 PolarHBondContact OG-OG 3.28Å
240	T	87.2	Confident	88	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.254	C	S	.	.			trans	-111.3	7.4	-177.4	44.9	0	0	0	0	113.4	F221 L246 R247 K250 E420	F221-T240 HydrophobicContact CB-CG2 4.43Å; F221-T240 HydrophobicContact CD1-CG2 4.2Å; T240-L246 HydrophobicContact CG2-CB 4.06Å; T240-R247 PolarHBondContact O-NH1 3.23Å; T240-K250 HydrophobicContact CG2-CB 4.2Å; T240-K250 HydrophobicContact CG2-CD 3.79Å; T240-E420 PolarHBondContact OG1-OE1 3.05Å
241	I	82.6	Confident	88.5	Confident	51 Å²	51	51.4 Å²	51.4	26%	0.262	26%	0.263	S	S	.	.	S	Bend	trans	-70.1	-43.8	-171.5	-61.8	170.6	0	0	0	111.1	L36 S243 R247 L424	L36-I241 HydrophobicContact CB-CG2 4.25Å; L36-I241 HydrophobicContact CD2-CG2 3.73Å; L36-I241 HydrophobicContact CG-CG2 3.78Å; I241-S243 VanDerWaalsContact C-N 3.32Å; I241-S243 PolarHBondContact O-N 3.34Å; I241-R247 PolarHBondContact O-NH1 2.9Å; I241-R247 VanDerWaalsContact O-NH1 3.14Å; I241-L424 HydrophobicContact CG2-CD2 4.45Å
242	Q	81.9	Confident	89.4	Confident	90 Å²	90	51.6 Å²	51.6	42%	0.421	26%	0.258	S	S	.	.	S	Bend	trans	-71.7	-22.8	-173.6	-57.4	92.5	-29.7	0	0	114.1	T37 S38	T37-Q242 HydrophobicContact CG2-CG 3.88Å; S38-Q242 PolarHBondContact OG-NE2 3.44Å
243	S	85.7	Confident	90	Very high	38 Å²	38	47 Å²	47	27%	0.266	23%	0.231	S	C	.	.			trans	-126.6	112.5	-172	176.4	0	0	0	0	110.6	I241 W245 L246 R247	I241-S243 VanDerWaalsContact C-N 3.32Å; I241-S243 PolarHBondContact O-N 3.34Å; S243-W245 PolarHBondContact O-N 2.86Å; S243-W245 PolarHBondContact OG-N 2.97Å; S243-L246 PolarHBondContact O-N 3.46Å; S243-L246 PolarHBondContact OG-N 2.94Å; S243-R247 PolarHBondContact O-N 3.43Å
244	E	86.8	Confident	90.3	Very high	78 Å²	78	47.5 Å²	47.5	36%	0.364	24%	0.237	S	C	.	.	H	α-helix	trans	-55.5	-39.7	172	-178.7	66.5	-118	0	0	110.9	L246 R247 Q248	E244-L246 PolarHBondContact O-N 3.02Å; E244-R247 VanDerWaalsContact CD-NH2 3.29Å; E244-R247 PolarHBondContact O-N 2.83Å; E244-R247 IonicContact OE1-CZ 3.64Å; E244-R247 IonicContact OE1-NE 2.88Å; E244-R247 PolarHBondContact OE1-NE 3.08Å; E244-R247 IonicContact OE1-NH2 3.16Å; E244-R247 IonicContact OE2-CZ 2.88Å; E244-R247 IonicContact OE2-NE 3.53Å; E244-R247 IonicContact OE2-NH2 2.62Å; E244-R247 PolarHBondContact OE2-NH2 3.17Å; E244-Q248 HydrophobicContact CG-CG 4.3Å; E244-Q248 WeakPolarHBondContact O-CG 3.28Å; E244-Q248 PolarHBondContact O-N 3.33Å; E244-Q248 WeakPolarHBondContact OE1-CG 3.27Å; E244-Q248 PolarHBondContact OE1-NE2 3.43Å
245	W	90.3	Very high	90.3	Very high	180 Å²	180	47.8 Å²	47.8	68%	0.682	24%	0.24	S	C	*	.	H	α-helix	trans	-61.2	-45.5	178	178.6	86.6	0	0	0	112.2	S243 R247 S249	S243-W245 PolarHBondContact O-N 2.86Å; S243-W245 PolarHBondContact OG-N 2.97Å; W245-R247 VanDerWaalsContact C-N 3.34Å; W245-R247 PolarHBondContact O-N 2.85Å; W245-S249 VanDerWaalsContact O-CB 3.27Å; W245-S249 WeakPolarHBondContact O-CB 3.35Å; W245-S249 PolarHBondContact O-N 3.3Å; W245-S249 PolarHBondContact O-OG 3.49Å
246	L	90.7	Very high	90.3	Very high	38 Å²	38	51.1 Å²	51.1	20%	0.199	26%	0.257	C	S	.	.	H	α-helix	trans	-64.1	-40.6	176.6	-77.3	174.7	0	0	0	111.7	I220 F221 T240 S243 E244 S249 K250	I220-L246 HydrophobicContact CG2-CD2 3.94Å; F221-L246 HydrophobicContact CD1-CD2 4.48Å; F221-L246 HydrophobicContact CE1-CD2 4.37Å; T240-L246 HydrophobicContact CG2-CB 4.06Å; S243-L246 PolarHBondContact O-N 3.46Å; S243-L246 PolarHBondContact OG-N 2.94Å; E244-L246 PolarHBondContact O-N 3.02Å; L246-S249 PolarHBondContact O-N 3.36Å; L246-K250 WeakPolarHBondContact O-CB 3.39Å; L246-K250 PolarHBondContact O-N 3.32Å
247	R	89	Confident	90.2	Very high	15 Å²	15	51.5 Å²	51.5	6%	0.057	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-48.2	177.4	178	168.3	57	-116.3	15.6	112.4	T240 I241 S243 E244 W245 S249 K250 Y251	T240-R247 PolarHBondContact O-NH1 3.23Å; I241-R247 PolarHBondContact O-NH1 2.9Å; I241-R247 VanDerWaalsContact O-NH1 3.14Å; S243-R247 PolarHBondContact O-N 3.43Å; E244-R247 VanDerWaalsContact CD-NH2 3.29Å; E244-R247 PolarHBondContact O-N 2.83Å; E244-R247 IonicContact OE1-CZ 3.64Å; E244-R247 IonicContact OE1-NE 2.88Å; E244-R247 PolarHBondContact OE1-NE 3.08Å; E244-R247 IonicContact OE1-NH2 3.16Å; E244-R247 IonicContact OE2-CZ 2.88Å; E244-R247 IonicContact OE2-NE 3.53Å; E244-R247 IonicContact OE2-NH2 2.62Å; E244-R247 PolarHBondContact OE2-NH2 3.17Å; W245-R247 VanDerWaalsContact C-N 3.34Å; W245-R247 PolarHBondContact O-N 2.85Å; R247-S249 VanDerWaalsContact C-N 3.32Å; R247-S249 PolarHBondContact O-N 2.93Å; R247-K250 PolarHBondContact O-N 3.01Å; R247-Y251 PolarHBondContact O-N 3.45Å
248	Q	91.2	Very high	90.2	Very high	58 Å²	58	51.4 Å²	51.4	27%	0.271	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-41.6	174.9	-68.6	-56.3	-35.8	0	0	111.3	E244 K250 Y251 I252	E244-Q248 HydrophobicContact CG-CG 4.3Å; E244-Q248 WeakPolarHBondContact O-CG 3.28Å; E244-Q248 PolarHBondContact O-N 3.33Å; E244-Q248 WeakPolarHBondContact OE1-CG 3.27Å; E244-Q248 PolarHBondContact OE1-NE2 3.43Å; Q248-K250 PolarHBondContact O-N 2.89Å; Q248-Y251 PolarHBondContact O-N 2.92Å; Q248-I252 VanDerWaalsContact O-CG1 3.29Å; Q248-I252 WeakPolarHBondContact O-CG1 3.38Å; Q248-I252 PolarHBondContact O-N 3.42Å
249	S	93.5	Very high	90.2	Very high	28 Å²	28	53.2 Å²	53.2	20%	0.196	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-42.4	177.6	-60.9	0	0	0	0	112.2	W245 L246 R247 I252 Y253	W245-S249 VanDerWaalsContact O-CB 3.27Å; W245-S249 WeakPolarHBondContact O-CB 3.35Å; W245-S249 PolarHBondContact O-N 3.3Å; W245-S249 PolarHBondContact O-OG 3.49Å; L246-S249 PolarHBondContact O-N 3.36Å; R247-S249 VanDerWaalsContact C-N 3.32Å; R247-S249 PolarHBondContact O-N 2.93Å; S249-I252 PolarHBondContact O-N 3.41Å; S249-Y253 VanDerWaalsContact O-CB 3.29Å; S249-Y253 WeakPolarHBondContact O-CB 3.45Å; S249-Y253 PolarHBondContact O-N 2.87Å
250	K	93.5	Very high	90.2	Very high	28 Å²	28	56.3 Å²	56.3	12%	0.122	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-44.4	174.2	-178.8	-168.8	174.5	-143.1	0	111.3	F221 A238 T240 L246 R247 Q248 Y253 G254 D417 E420	F221-K250 HydrophobicContact CB-CG 4.45Å; F221-K250 HydrophobicContact CD1-CB 4Å; F221-K250 HydrophobicContact CD2-CB 4.21Å; F221-K250 HydrophobicContact CD2-CG 4.17Å; F221-K250 HydrophobicContact CE1-CB 4.08Å; F221-K250 HydrophobicContact CE2-CB 4.28Å; F221-K250 HydrophobicContact CG-CB 4.09Å; F221-K250 HydrophobicContact CG-CG 4.16Å; F221-K250 HydrophobicContact CZ-CB 4.22Å; A238-K250 HydrophobicContact CB-CD 4.48Å; T240-K250 HydrophobicContact CG2-CB 4.2Å; T240-K250 HydrophobicContact CG2-CD 3.79Å; L246-K250 WeakPolarHBondContact O-CB 3.39Å; L246-K250 PolarHBondContact O-N 3.32Å; R247-K250 PolarHBondContact O-N 3.01Å; Q248-K250 PolarHBondContact O-N 2.89Å; K250-Y253 WeakPolarHBondContact O-CB 3.31Å; K250-Y253 PolarHBondContact O-N 3.32Å; K250-G254 PolarHBondContact O-N 3.27Å; K250-D417 WeakPolarHBondContact CE-OD1 3.41Å; K250-D417 IonicContact NZ-OD1 2.78Å; K250-D417 PolarHBondContact NZ-OD1 2.92Å; K250-E420 IonicContact NZ-OE2 2.96Å; K250-E420 PolarHBondContact NZ-OE2 3.44Å
251	Y	91.5	Very high	90.3	Very high	82 Å²	82	57 Å²	57	32%	0.322	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-48.5	177.2	179.7	-102.7	0	0	0	112	R247 Q248 Y253 G254 I255 D417	R247-Y251 PolarHBondContact O-N 3.45Å; Q248-Y251 PolarHBondContact O-N 2.92Å; Y251-Y253 VanDerWaalsContact C-N 3.32Å; Y251-Y253 PolarHBondContact O-N 3.11Å; Y251-G254 WeakPolarHBondContact O-CA 3.34Å; Y251-G254 PolarHBondContact O-N 3.44Å; Y251-G254 VanDerWaalsContact O-N 3.08Å; Y251-I255 HydrophobicContact CE1-CG1 4.2Å; Y251-I255 PolarHBondContact O-N 3.33Å; Y251-D417 HydrophobicContact CD2-CB 4.15Å
252	I	93	Very high	90.5	Very high	94 Å²	94	56.9 Å²	56.9	48%	0.482	27%	0.274	S	S	.	.	H	α-helix	trans	-59.8	-44	176.4	-67.4	165.6	0	0	0	110.6	Q248 S249 G254 I255 I256	Q248-I252 VanDerWaalsContact O-CG1 3.29Å; Q248-I252 WeakPolarHBondContact O-CG1 3.38Å; Q248-I252 PolarHBondContact O-N 3.42Å; S249-I252 PolarHBondContact O-N 3.41Å; I252-G254 VanDerWaalsContact C-N 3.32Å; I252-G254 PolarHBondContact O-N 3.34Å; I252-I255 PolarHBondContact O-N 2.76Å; I252-I256 HydrophobicContact CG2-CD1 3.91Å; I252-I256 HydrophobicContact CG2-CG1 4.47Å; I252-I256 WeakPolarHBondContact O-CG1 3.29Å; I252-I256 PolarHBondContact O-N 3.4Å
253	Y	94.5	Very high	90.9	Very high	32 Å²	32	55.4 Å²	55.4	13%	0.125	27%	0.273	C	S	.	.	H	α-helix	trans	-58.6	-42.9	173.3	170.3	-97.6	0	0	0	111.9	M214 P217 M218 F221 S249 K250 Y251 I255 I256 T257	M214-Y253 WeakPolarHBondContact O-CE2 3.3Å; M214-Y253 PolarHBondContact O-OH 3.08Å; P217-Y253 HydrophobicContact CB-CD2 3.93Å; P217-Y253 HydrophobicContact CB-CE2 3.89Å; P217-Y253 HydrophobicContact CB-CG 4.43Å; P217-Y253 HydrophobicContact CG-CD2 3.92Å; P217-Y253 HydrophobicContact CG-CE2 3.72Å; M218-Y253 HydrophobicContact CG-CE1 4.26Å; M218-Y253 HydrophobicContact SD-CE1 3.65Å; F221-Y253 HydrophobicContact CD2-CD1 4.33Å; F221-Y253 AromaticContact CE2-CD1 3.94Å; F221-Y253 HydrophobicContact CE2-CD1 3.94Å; F221-Y253 AromaticContact CE2-CG 3.9Å; F221-Y253 HydrophobicContact CE2-CG 3.9Å; S249-Y253 VanDerWaalsContact O-CB 3.29Å; S249-Y253 WeakPolarHBondContact O-CB 3.45Å; S249-Y253 PolarHBondContact O-N 2.87Å; K250-Y253 WeakPolarHBondContact O-CB 3.31Å; K250-Y253 PolarHBondContact O-N 3.32Å; Y251-Y253 VanDerWaalsContact C-N 3.32Å; Y251-Y253 PolarHBondContact O-N 3.11Å; Y253-I255 VanDerWaalsContact C-N 3.32Å; Y253-I255 PolarHBondContact O-N 3.48Å; Y253-I256 PolarHBondContact O-N 3.4Å; Y253-T257 HydrophobicContact CD1-CG2 4.15Å; Y253-T257 HydrophobicContact CD2-CG2 4Å; Y253-T257 HydrophobicContact CE1-CG2 3.67Å; Y253-T257 HydrophobicContact CE2-CG2 3.5Å; Y253-T257 VanDerWaalsContact CE2-CG2 3.5Å; Y253-T257 HydrophobicContact CG-CG2 4.3Å; Y253-T257 WeakPolarHBondContact O-CG2 3.14Å; Y253-T257 PolarHBondContact O-N 3.18Å; Y253-T257 PolarHBondContact O-OG1 2.78Å; Y253-T257 VanDerWaalsContact O-OG1 3.09Å
254	G	93.3	Very high	91	Very high	13 Å²	13	56.8 Å²	56.8	13%	0.134	28%	0.277	C	S	.	.	H	α-helix	trans	-54.9	-45.1	173.1	0	0	0	0	0	112.7	K250 Y251 I252 T257 I258	K250-G254 PolarHBondContact O-N 3.27Å; Y251-G254 WeakPolarHBondContact O-CA 3.34Å; Y251-G254 PolarHBondContact O-N 3.44Å; Y251-G254 VanDerWaalsContact O-N 3.08Å; I252-G254 VanDerWaalsContact C-N 3.32Å; I252-G254 PolarHBondContact O-N 3.34Å; G254-T257 WeakPolarHBondContact CA-OG1 3.39Å; G254-T257 PolarHBondContact O-N 2.99Å; G254-T257 PolarHBondContact O-OG1 3.09Å; G254-I258 VanDerWaalsContact O-CG1 3.3Å; G254-I258 WeakPolarHBondContact O-CG1 3.47Å; G254-I258 PolarHBondContact O-N 3.34Å
255	I	92.8	Very high	91.2	Very high	76 Å²	76	53.6 Å²	53.6	39%	0.39	26%	0.263	S	S	.	.	H	α-helix	trans	-64.9	-46.3	175.9	-58.7	-56.1	0	0	0	111.6	Y251 I252 Y253 T257 I258 V259	Y251-I255 HydrophobicContact CE1-CG1 4.2Å; Y251-I255 PolarHBondContact O-N 3.33Å; I252-I255 PolarHBondContact O-N 2.76Å; Y253-I255 VanDerWaalsContact C-N 3.32Å; Y253-I255 PolarHBondContact O-N 3.48Å; I255-T257 VanDerWaalsContact C-N 3.34Å; I255-T257 PolarHBondContact O-N 2.99Å; I255-I258 PolarHBondContact O-N 3.17Å; I255-V259 WeakPolarHBondContact O-CG2 3.39Å; I255-V259 PolarHBondContact O-N 3.02Å
256	I	93.2	Very high	91.1	Very high	76 Å²	76	48.2 Å²	48.2	39%	0.39	25%	0.247	S	C	.	.	H	α-helix	trans	-58.7	-46.9	177.8	-68.8	169	0	0	0	110.4	I252 Y253 I258 V259 F260	I252-I256 HydrophobicContact CG2-CD1 3.91Å; I252-I256 HydrophobicContact CG2-CG1 4.47Å; I252-I256 WeakPolarHBondContact O-CG1 3.29Å; I252-I256 PolarHBondContact O-N 3.4Å; Y253-I256 PolarHBondContact O-N 3.4Å; I256-I258 PolarHBondContact O-N 3.15Å; I256-V259 PolarHBondContact O-N 3.1Å; I256-V259 VanDerWaalsContact O-N 3.16Å; I256-F260 HydrophobicContact CG2-CD2 3.76Å; I256-F260 HydrophobicContact CG2-CE2 3.99Å; I256-F260 WeakPolarHBondContact O-CD2 3.26Å; I256-F260 PolarHBondContact O-N 3.25Å
257	T	92.2	Very high	91.2	Very high	12 Å²	12	50.7 Å²	50.7	7%	0.074	26%	0.264	C	S	.	.	H	α-helix	trans	-64	-39.1	179.6	55.5	0	0	0	0	112.4	F170 Y253 G254 I255 V259 F260 Q261	F170-T257 HydrophobicContact CE2-CG2 4.49Å; F170-T257 HydrophobicContact CZ-CG2 3.95Å; Y253-T257 HydrophobicContact CD1-CG2 4.15Å; Y253-T257 HydrophobicContact CD2-CG2 4Å; Y253-T257 HydrophobicContact CE1-CG2 3.67Å; Y253-T257 HydrophobicContact CE2-CG2 3.5Å; Y253-T257 VanDerWaalsContact CE2-CG2 3.5Å; Y253-T257 HydrophobicContact CG-CG2 4.3Å; Y253-T257 WeakPolarHBondContact O-CG2 3.14Å; Y253-T257 PolarHBondContact O-N 3.18Å; Y253-T257 PolarHBondContact O-OG1 2.78Å; Y253-T257 VanDerWaalsContact O-OG1 3.09Å; G254-T257 WeakPolarHBondContact CA-OG1 3.39Å; G254-T257 PolarHBondContact O-N 2.99Å; G254-T257 PolarHBondContact O-OG1 3.09Å; I255-T257 VanDerWaalsContact C-N 3.34Å; I255-T257 PolarHBondContact O-N 2.99Å; T257-V259 VanDerWaalsContact C-N 3.32Å; T257-V259 PolarHBondContact O-N 2.95Å; T257-F260 PolarHBondContact O-N 2.95Å; T257-Q261 WeakPolarHBondContact O-CA 3.37Å; T257-Q261 WeakPolarHBondContact O-CB 3.25Å; T257-Q261 VanDerWaalsContact O-CG 3.28Å; T257-Q261 WeakPolarHBondContact O-CG 3.5Å; T257-Q261 PolarHBondContact O-N 3.15Å
258	I	91.4	Very high	91.3	Very high	42 Å²	42	54.1 Å²	54.1	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-44	172.4	-70.8	166.6	0	0	0	110.9	G254 I255 I256 Y262 C263 H410 A414	G254-I258 VanDerWaalsContact O-CG1 3.3Å; G254-I258 WeakPolarHBondContact O-CG1 3.47Å; G254-I258 PolarHBondContact O-N 3.34Å; I255-I258 PolarHBondContact O-N 3.17Å; I256-I258 PolarHBondContact O-N 3.15Å; I258-Y262 WeakPolarHBondContact O-CA 3.32Å; I258-Y262 WeakPolarHBondContact O-CB 3.37Å; I258-Y262 PolarHBondContact O-N 3.01Å; I258-C263 PolarHBondContact O-N 2.96Å; I258-H410 HydrophobicContact CG1-CB 4.47Å; I258-A414 HydrophobicContact CD1-CB 4.1Å
259	V	90.5	Very high	91.4	Very high	70 Å²	70	51.5 Å²	51.5	42%	0.424	27%	0.27	S	S	.	.	I	π-helix	trans	-62.4	-47.6	178	173.4	0	0	0	0	111.4	I255 I256 T257 C263 L264	I255-V259 WeakPolarHBondContact O-CG2 3.39Å; I255-V259 PolarHBondContact O-N 3.02Å; I256-V259 PolarHBondContact O-N 3.1Å; I256-V259 VanDerWaalsContact O-N 3.16Å; T257-V259 VanDerWaalsContact C-N 3.32Å; T257-V259 PolarHBondContact O-N 2.95Å; V259-C263 PolarHBondContact O-N 2.93Å; V259-L264 WeakPolarHBondContact O-CB 3.22Å; V259-L264 PolarHBondContact O-N 3.36Å
260	F	90.2	Very high	91.3	Very high	81 Å²	81	52.6 Å²	52.6	36%	0.355	28%	0.277	S	S	.	.	I	π-helix	trans	-75.6	-33.8	-176.8	-87.3	-89.6	0	0	0	114.6	F170 M214 I256 T257 L264 P265	F170-F260 HydrophobicContact CE1-CB 4.14Å; M214-F260 HydrophobicContact CE-CB 4.4Å; M214-F260 HydrophobicContact CE-CD1 4.17Å; M214-F260 HydrophobicContact CE-CD2 4.04Å; M214-F260 HydrophobicContact CE-CE1 4.46Å; M214-F260 HydrophobicContact CE-CE2 4.33Å; M214-F260 HydrophobicContact CE-CG 3.95Å; I256-F260 HydrophobicContact CG2-CD2 3.76Å; I256-F260 HydrophobicContact CG2-CE2 3.99Å; I256-F260 WeakPolarHBondContact O-CD2 3.26Å; I256-F260 PolarHBondContact O-N 3.25Å; T257-F260 PolarHBondContact O-N 2.95Å; F260-L264 HydrophobicContact CD1-CD1 4.45Å; F260-P265 WeakPolarHBondContact O-CD 3.14Å; F260-P265 WeakPolarHBondContact O-CG 3.32Å
261	Q	89.5	Confident	91.3	Very high	14 Å²	14	56.5 Å²	56.5	7%	0.065	29%	0.292	C	S	.	.	I	π-helix	trans	-94.3	-19	-175.5	-62.4	170.1	-16.1	0	0	112.3	I169 F170 T257 P265 H410	I169-Q261 HydrophobicContact CD1-CB 4.13Å; I169-Q261 HydrophobicContact CD1-CG 4.41Å; I169-Q261 HydrophobicContact CG1-CB 4.43Å; I169-Q261 HydrophobicContact CG1-CG 4.46Å; F170-Q261 HydrophobicContact CD1-CG 3.67Å; F170-Q261 VanDerWaalsContact CD2-NE2 3.34Å; F170-Q261 HydrophobicContact CE1-CG 3.42Å; F170-Q261 VanDerWaalsContact CE1-CG 3.42Å; F170-Q261 VanDerWaalsContact CE1-NE2 3.3Å; F170-Q261 HydrophobicContact CG-CG 4.39Å; F170-Q261 HydrophobicContact CZ-CG 3.96Å; T257-Q261 WeakPolarHBondContact O-CA 3.37Å; T257-Q261 WeakPolarHBondContact O-CB 3.25Å; T257-Q261 VanDerWaalsContact O-CG 3.28Å; T257-Q261 WeakPolarHBondContact O-CG 3.5Å; T257-Q261 PolarHBondContact O-N 3.15Å; Q261-P265 WeakPolarHBondContact O-CG 3.49Å; Q261-H410 PolarHBondContact OE1-CE1 3.28Å; Q261-H410 VanDerWaalsContact OE1-CE1 3.26Å
262	Y	86.9	Confident	91.3	Very high	49 Å²	49	52.6 Å²	52.6	19%	0.192	28%	0.277	C	S	.	.	I	π-helix	trans	-123.2	-61.6	-176.6	-161.2	-98.1	0	0	0	113.5	I258 P265 L266 V403 L407	I258-Y262 WeakPolarHBondContact O-CA 3.32Å; I258-Y262 WeakPolarHBondContact O-CB 3.37Å; I258-Y262 PolarHBondContact O-N 3.01Å; Y262-P265 WeakPolarHBondContact O-CD 3.33Å; Y262-L266 HydrophobicContact CE1-CD2 4.37Å; Y262-L266 WeakPolarHBondContact O-CB 3.46Å; Y262-L266 PolarHBondContact O-N 3.28Å; Y262-V403 HydrophobicContact CE2-CB 4.49Å; Y262-V403 HydrophobicContact CE2-CG1 3.54Å; Y262-V403 WeakPolarHBondContact OH-CG1 3.42Å; Y262-L407 HydrophobicContact CE1-CD1 4.28Å; Y262-L407 HydrophobicContact CE2-CB 4.02Å; Y262-L407 HydrophobicContact CE2-CD1 3.96Å
263	C	89.1	Confident	91.3	Very high	60 Å²	60	49.4 Å²	49.4	41%	0.405	26%	0.259	S	S	.	.	I	π-helix	trans	-67.9	-48.9	-173.2	-60.5	0	0	0	0	113.4	I258 V259 L266 T267	I258-C263 PolarHBondContact O-N 2.96Å; V259-C263 PolarHBondContact O-N 2.93Å; C263-L266 PolarHBondContact O-N 3.17Å; C263-T267 VanDerWaalsContact O-CG2 3.31Å; C263-T267 WeakPolarHBondContact O-CG2 3.26Å; C263-T267 PolarHBondContact O-N 3.48Å; C263-T267 PolarHBondContact O-OG1 3.48Å
264	L	88.6	Confident	91.1	Very high	66 Å²	66	52.6 Å²	52.6	35%	0.346	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-45.2	179.2	178.6	158.2	0	0	0	112.3	I177 V259 F260 T267 M268	I177-L264 HydrophobicContact CD1-CD2 4.05Å; V259-L264 WeakPolarHBondContact O-CB 3.22Å; V259-L264 PolarHBondContact O-N 3.36Å; F260-L264 HydrophobicContact CD1-CD1 4.45Å; L264-T267 WeakPolarHBondContact CA-OG1 3.32Å; L264-T267 PolarHBondContact O-N 2.95Å; L264-T267 PolarHBondContact O-OG1 2.67Å; L264-M268 HydrophobicContact CD2-CG 4.26Å; L264-M268 WeakPolarHBondContact O-CB 3.46Å; L264-M268 WeakPolarHBondContact O-CG 3.2Å; L264-M268 PolarHBondContact O-N 3.28Å
265	P	89.7	Confident	91.2	Very high	11 Å²	11	55.3 Å²	55.3	7%	0.071	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-42.7	176.1	-24.7	35.9	0	0	0	112.4	T173 I177 F260 Q261 Y262 T267 M268 V269	T173-P265 HydrophobicContact CG2-CB 3.65Å; T173-P265 HydrophobicContact CG2-CG 3.09Å; I177-P265 HydrophobicContact CD1-CB 4.02Å; I177-P265 HydrophobicContact CD1-CG 4.1Å; I177-P265 HydrophobicContact CG1-CB 4.28Å; F260-P265 WeakPolarHBondContact O-CD 3.14Å; F260-P265 WeakPolarHBondContact O-CG 3.32Å; Q261-P265 WeakPolarHBondContact O-CG 3.49Å; Y262-P265 WeakPolarHBondContact O-CD 3.33Å; P265-T267 VanDerWaalsContact C-N 3.32Å; P265-T267 PolarHBondContact O-N 3.27Å; P265-M268 PolarHBondContact O-N 3Å; P265-V269 VanDerWaalsContact O-CB 3.27Å; P265-V269 WeakPolarHBondContact O-CB 3.4Å; P265-V269 WeakPolarHBondContact O-CG2 3.4Å; P265-V269 PolarHBondContact O-N 3.33Å
266	L	89.8	Confident	91.1	Very high	67 Å²	67	51.7 Å²	51.7	35%	0.351	27%	0.265	S	S	.	.	H	α-helix	trans	-61.3	-42.3	178.9	-175	63.5	0	0	0	111.2	Y262 C263 S270 V403	Y262-L266 HydrophobicContact CE1-CD2 4.37Å; Y262-L266 WeakPolarHBondContact O-CB 3.46Å; Y262-L266 PolarHBondContact O-N 3.28Å; C263-L266 PolarHBondContact O-N 3.17Å; L266-S270 WeakPolarHBondContact O-CB 3.47Å; L266-S270 PolarHBondContact O-N 3.01Å; L266-S270 PolarHBondContact O-OG 3.49Å; L266-V403 HydrophobicContact CD1-CG1 4.23Å; L266-V403 HydrophobicContact CD1-CG2 4.27Å
267	T	91.2	Very high	91	Very high	91 Å²	91	51.6 Å²	51.6	56%	0.558	27%	0.27	S	S	*	.	H	α-helix	trans	-67.9	-49	178.2	51.4	0	0	0	0	112.1	C263 L264 P265 V269 Y271	C263-T267 VanDerWaalsContact O-CG2 3.31Å; C263-T267 WeakPolarHBondContact O-CG2 3.26Å; C263-T267 PolarHBondContact O-N 3.48Å; C263-T267 PolarHBondContact O-OG1 3.48Å; L264-T267 WeakPolarHBondContact CA-OG1 3.32Å; L264-T267 PolarHBondContact O-N 2.95Å; L264-T267 PolarHBondContact O-OG1 2.67Å; P265-T267 VanDerWaalsContact C-N 3.32Å; P265-T267 PolarHBondContact O-N 3.27Å; T267-V269 PolarHBondContact O-N 3.44Å; T267-Y271 VanDerWaalsContact O-CB 3.3Å; T267-Y271 WeakPolarHBondContact O-CB 3.28Å; T267-Y271 PolarHBondContact O-N 2.92Å
268	M	92.7	Very high	91	Very high	86 Å²	86	55.9 Å²	55.9	42%	0.424	29%	0.291	S	S	.	.	H	α-helix	trans	-60.7	-45.7	179.1	-76	-67.6	-136.2	0	0	112.5	L264 P265 A272	L264-M268 HydrophobicContact CD2-CG 4.26Å; L264-M268 WeakPolarHBondContact O-CB 3.46Å; L264-M268 WeakPolarHBondContact O-CG 3.2Å; L264-M268 PolarHBondContact O-N 3.28Å; P265-M268 PolarHBondContact O-N 3Å; M268-A272 WeakPolarHBondContact O-CB 3.24Å; M268-A272 PolarHBondContact O-N 3.39Å
269	V	91.9	Very high	91	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-75.6	-39.1	-177	-178.6	0	0	0	0	111.3	I176 I177 A180 P265 T267 Y271 A272 Y273 T399	I176-V269 HydrophobicContact CG2-CG2 4.2Å; I177-V269 HydrophobicContact CG1-CG2 4.1Å; A180-V269 HydrophobicContact CB-CB 4.46Å; A180-V269 HydrophobicContact CB-CG1 3.98Å; A180-V269 HydrophobicContact CB-CG2 4.07Å; P265-V269 VanDerWaalsContact O-CB 3.27Å; P265-V269 WeakPolarHBondContact O-CB 3.4Å; P265-V269 WeakPolarHBondContact O-CG2 3.4Å; P265-V269 PolarHBondContact O-N 3.33Å; T267-V269 PolarHBondContact O-N 3.44Å; V269-Y271 VanDerWaalsContact C-N 3.32Å; V269-Y271 PolarHBondContact O-N 2.69Å; V269-A272 PolarHBondContact O-N 2.89Å; V269-Y273 HydrophobicContact CG1-CD2 3.37Å; V269-Y273 HydrophobicContact CG1-CE2 3.09Å; V269-Y273 VanDerWaalsContact O-CD2 3.29Å; V269-Y273 WeakPolarHBondContact O-CD2 3.44Å; V269-Y273 PolarHBondContact O-N 3.47Å; V269-T399 HydrophobicContact CB-CG2 3.99Å; V269-T399 HydrophobicContact CG1-CG2 3.31Å; V269-T399 HydrophobicContact CG2-CG2 4.3Å
270	S	91.4	Very high	90.9	Very high	51 Å²	51	54.5 Å²	54.5	36%	0.357	28%	0.277	S	S	.	.	H	α-helix	trans	-57.6	-47.6	171.6	-64.2	0	0	0	0	111	L266 A272 Y273 I274	L266-S270 WeakPolarHBondContact O-CB 3.47Å; L266-S270 PolarHBondContact O-N 3.01Å; L266-S270 PolarHBondContact O-OG 3.49Å; S270-A272 PolarHBondContact O-N 3.3Å; S270-Y273 PolarHBondContact O-N 2.74Å; S270-I274 WeakPolarHBondContact O-CB 3.41Å; S270-I274 WeakPolarHBondContact O-CD1 3.42Å; S270-I274 WeakPolarHBondContact O-CG1 3.46Å; S270-I274 PolarHBondContact O-N 3.5Å
271	Y	93.5	Very high	90.8	Very high	111 Å²	111	57.9 Å²	57.9	44%	0.435	29%	0.287	S	S	.	.	H	α-helix	trans	-57.1	-49	175.6	169.8	-102.7	0	0	0	111.8	L184 T267 V269 Y273 I274 R275	L184-Y271 HydrophobicContact CD2-CE1 4.18Å; T267-Y271 VanDerWaalsContact O-CB 3.3Å; T267-Y271 WeakPolarHBondContact O-CB 3.28Å; T267-Y271 PolarHBondContact O-N 2.92Å; V269-Y271 VanDerWaalsContact C-N 3.32Å; V269-Y271 PolarHBondContact O-N 2.69Å; Y271-Y273 PolarHBondContact O-N 3.2Å; Y271-I274 PolarHBondContact O-N 2.98Å; Y271-R275 HydrophobicContact CD2-CG 4.17Å; Y271-R275 HydrophobicContact CE1-CG 4.4Å; Y271-R275 HydrophobicContact CE2-CG 3.76Å; Y271-R275 VanDerWaalsContact O-CG 3.32Å; Y271-R275 WeakPolarHBondContact O-CG 3Å; Y271-R275 PolarHBondContact O-N 2.59Å; Y271-R275 PolarHBondContact OH-NH1 3.34Å
272	A	92.7	Very high	90.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.1	-48.5	178.9	0	0	0	0	0	111.8	A180 L184 M268 V269 S270 R275 I276	A180-A272 HydrophobicContact CB-CB 4.12Å; L184-A272 HydrophobicContact CB-CB 4.29Å; L184-A272 HydrophobicContact CD2-CB 4.27Å; M268-A272 WeakPolarHBondContact O-CB 3.24Å; M268-A272 PolarHBondContact O-N 3.39Å; V269-A272 PolarHBondContact O-N 2.89Å; S270-A272 PolarHBondContact O-N 3.3Å; A272-R275 PolarHBondContact O-N 2.74Å; A272-I276 WeakPolarHBondContact O-CD1 3.26Å; A272-I276 WeakPolarHBondContact O-CG1 3.37Å; A272-I276 PolarHBondContact O-N 3.27Å
273	Y	91.1	Very high	90.7	Very high	27 Å²	27	61.5 Å²	61.5	11%	0.106	30%	0.304	C	S	.	.	H	α-helix	trans	-70.2	-37.4	-179.8	-73.4	-54.7	0	0	0	113.6	V269 S270 Y271 R275 I276 C277 L395 A396 T399	V269-Y273 HydrophobicContact CG1-CD2 3.37Å; V269-Y273 HydrophobicContact CG1-CE2 3.09Å; V269-Y273 VanDerWaalsContact O-CD2 3.29Å; V269-Y273 WeakPolarHBondContact O-CD2 3.44Å; V269-Y273 PolarHBondContact O-N 3.47Å; S270-Y273 PolarHBondContact O-N 2.74Å; Y271-Y273 PolarHBondContact O-N 3.2Å; Y273-R275 VanDerWaalsContact C-N 3.32Å; Y273-R275 PolarHBondContact O-N 3.45Å; Y273-I276 HydrophobicContact CD1-CD1 4.02Å; Y273-I276 HydrophobicContact CE1-CD1 4.38Å; Y273-I276 PolarHBondContact O-N 2.86Å; Y273-C277 WeakPolarHBondContact O-CB 3.3Å; Y273-C277 PolarHBondContact O-N 2.98Å; Y273-C277 PolarHBondContact O-SG 3.48Å; Y273-L395 HydrophobicContact CE1-CB 4.28Å; Y273-L395 WeakPolarHBondContact OH-CB 3.45Å; Y273-L395 PolarHBondContact OH-O 2.92Å; Y273-A396 HydrophobicContact CD1-CB 4.26Å; Y273-A396 HydrophobicContact CD2-CB 4.34Å; Y273-A396 HydrophobicContact CE1-CB 4.16Å; Y273-A396 HydrophobicContact CE2-CB 4.19Å; Y273-A396 HydrophobicContact CG-CB 4.4Å; Y273-A396 PolarHBondContact OH-N 2.92Å; Y273-T399 HydrophobicContact CE2-CG2 4.35Å; Y273-T399 WeakPolarHBondContact CE2-OG1 3.33Å; Y273-T399 PolarHBondContact OH-OG1 2.86Å
274	I	92	Very high	90.4	Very high	98 Å²	98	62.9 Å²	62.9	50%	0.503	31%	0.305	S	S	.	.	H	α-helix	trans	-57.3	-49	173.6	-71.5	164.3	0	0	0	109.5	S270 Y271 I276 C277 L278	S270-I274 WeakPolarHBondContact O-CB 3.41Å; S270-I274 WeakPolarHBondContact O-CD1 3.42Å; S270-I274 WeakPolarHBondContact O-CG1 3.46Å; S270-I274 PolarHBondContact O-N 3.5Å; Y271-I274 PolarHBondContact O-N 2.98Å; I274-I276 PolarHBondContact O-N 3.26Å; I274-C277 PolarHBondContact O-N 2.85Å; I274-L278 HydrophobicContact CG2-CD1 3.91Å; I274-L278 HydrophobicContact CG2-CG 4.38Å; I274-L278 WeakPolarHBondContact O-CB 3.45Å; I274-L278 VanDerWaalsContact O-CG 3.27Å; I274-L278 WeakPolarHBondContact O-CG 3.22Å; I274-L278 PolarHBondContact O-N 3.35Å
275	R	94.3	Very high	90.2	Very high	71 Å²	71	65.2 Å²	65.2	27%	0.268	31%	0.312	S	S	.	.	H	α-helix	trans	-63.6	-39.7	178.5	-67.9	-61.7	-57.2	-78.7	-0.4	112.6	L184 V188 Y189 Y271 A272 Y273 R279	L184-R275 HydrophobicContact CD1-CB 3.59Å; L184-R275 HydrophobicContact CD1-CG 4.45Å; V188-R275 HydrophobicContact CG2-CB 4.43Å; Y189-R275 PolarHBondContact OH-NH1 3.24Å; Y189-R275 VanDerWaalsContact OH-NH1 3.16Å; Y189-R275 PolarHBondContact OH-NH2 3.12Å; Y271-R275 HydrophobicContact CD2-CG 4.17Å; Y271-R275 HydrophobicContact CE1-CG 4.4Å; Y271-R275 HydrophobicContact CE2-CG 3.76Å; Y271-R275 VanDerWaalsContact O-CG 3.32Å; Y271-R275 WeakPolarHBondContact O-CG 3Å; Y271-R275 PolarHBondContact O-N 2.59Å; Y271-R275 PolarHBondContact OH-NH1 3.34Å; A272-R275 PolarHBondContact O-N 2.74Å; Y273-R275 VanDerWaalsContact C-N 3.32Å; Y273-R275 PolarHBondContact O-N 3.45Å; R275-R279 WeakPolarHBondContact O-CB 3.29Å; R275-R279 PolarHBondContact O-N 3.47Å
276	I	91.9	Very high	89.9	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-48.7	174.2	-71.5	164.1	0	0	0	110.6	R183 L184 I187 V188 A272 Y273 I274 R279 I280 N392	R183-I276 HydrophobicContact CB-CD1 3.88Å; L184-I276 HydrophobicContact CB-CD1 4.47Å; L184-I276 HydrophobicContact CD1-CG1 4.27Å; I187-I276 HydrophobicContact CD1-CG2 4.02Å; I187-I276 HydrophobicContact CG2-CG2 4.47Å; V188-I276 HydrophobicContact CG2-CG1 4.43Å; A272-I276 WeakPolarHBondContact O-CD1 3.26Å; A272-I276 WeakPolarHBondContact O-CG1 3.37Å; A272-I276 PolarHBondContact O-N 3.27Å; Y273-I276 HydrophobicContact CD1-CD1 4.02Å; Y273-I276 HydrophobicContact CE1-CD1 4.38Å; Y273-I276 PolarHBondContact O-N 2.86Å; I274-I276 PolarHBondContact O-N 3.26Å; I276-R279 PolarHBondContact O-N 3.37Å; I276-I280 HydrophobicContact CG2-CD1 3.8Å; I276-I280 WeakPolarHBondContact O-CG1 3.48Å; I276-I280 PolarHBondContact O-N 3.44Å; I276-N392 HydrophobicContact CG2-CB 4.36Å; I276-N392 WeakPolarHBondContact CG2-ND2 3.24Å
277	C	90.5	Very high	89.2	Confident	73 Å²	73	67.4 Å²	67.4	49%	0.493	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-47	179.6	-74.7	0	0	0	0	111.6	Y273 I274 R279 I280 R281	Y273-C277 WeakPolarHBondContact O-CB 3.3Å; Y273-C277 PolarHBondContact O-N 2.98Å; Y273-C277 PolarHBondContact O-SG 3.48Å; I274-C277 PolarHBondContact O-N 2.85Å; C277-R279 VanDerWaalsContact C-N 3.33Å; C277-R279 PolarHBondContact O-N 3.1Å; C277-I280 PolarHBondContact O-N 2.79Å; C277-R281 WeakPolarHBondContact O-CG 3.3Å; C277-R281 PolarHBondContact O-N 2.92Å
278	L	92.3	Very high	88.4	Confident	102 Å²	102	69.5 Å²	69.5	53%	0.534	33%	0.332	S	S	.	.	H	α-helix	trans	-59.4	-43.6	176.1	-69.6	174.5	0	0	0	111.5	I274 R281 Q282	I274-L278 HydrophobicContact CG2-CD1 3.91Å; I274-L278 HydrophobicContact CG2-CG 4.38Å; I274-L278 WeakPolarHBondContact O-CB 3.45Å; I274-L278 VanDerWaalsContact O-CG 3.27Å; I274-L278 WeakPolarHBondContact O-CG 3.22Å; I274-L278 PolarHBondContact O-N 3.35Å; L278-R281 PolarHBondContact O-N 2.86Å; L278-Q282 WeakPolarHBondContact O-CB 3.45Å; L278-Q282 PolarHBondContact O-N 3.29Å
279	R	91.4	Very high	87.4	Confident	69 Å²	69	75.1 Å²	75.1	26%	0.26	35%	0.348	S	S	.	.	H	α-helix	trans	-65.2	-41.2	178.1	-175.9	62.4	170.2	144.8	-1.9	112.6	I187 V188 R275 I276 C277 Q282 R283	I187-R279 HydrophobicContact CG2-CG 4.25Å; V188-R279 HydrophobicContact CG2-CB 3.87Å; V188-R279 HydrophobicContact CG2-CG 4.2Å; R275-R279 WeakPolarHBondContact O-CB 3.29Å; R275-R279 PolarHBondContact O-N 3.47Å; I276-R279 PolarHBondContact O-N 3.37Å; C277-R279 VanDerWaalsContact C-N 3.33Å; C277-R279 PolarHBondContact O-N 3.1Å; R279-Q282 PolarHBondContact O-N 2.94Å; R279-R283 WeakPolarHBondContact O-CG 3.29Å; R279-R283 PolarHBondContact O-N 3.21Å
280	I	87.7	Confident	85.9	Confident	14 Å²	14	82 Å²	82	7%	0.072	38%	0.378	C	S	.	.	H	α-helix	trans	-63.8	-46.3	176.9	-70.5	171.2	0	0	0	110.2	I187 I276 C277 Q282 R283 Q284 N392	I187-I280 HydrophobicContact CG2-CG1 4.38Å; I276-I280 HydrophobicContact CG2-CD1 3.8Å; I276-I280 WeakPolarHBondContact O-CG1 3.48Å; I276-I280 PolarHBondContact O-N 3.44Å; C277-I280 PolarHBondContact O-N 2.79Å; I280-Q282 PolarHBondContact O-N 3.46Å; I280-R283 PolarHBondContact O-N 3.06Å; I280-Q284 WeakPolarHBondContact O-CG 3.37Å; I280-Q284 PolarHBondContact O-N 3.45Å; I280-N392 WeakPolarHBondContact CD1-ND2 3.31Å
281	R	88.2	Confident	83.9	Confident	152 Å²	152	84.4 Å²	84.4	57%	0.574	39%	0.392	S	S	*	.	H	α-helix	trans	-59.2	-46.1	176.7	-72	179.1	73.9	148.4	2	111.4	C277 L278 R283 Q284 F285	C277-R281 WeakPolarHBondContact O-CG 3.3Å; C277-R281 PolarHBondContact O-N 2.92Å; L278-R281 PolarHBondContact O-N 2.86Å; R281-R283 VanDerWaalsContact C-N 3.31Å; R281-R283 PolarHBondContact O-N 2.7Å; R281-Q284 WeakPolarHBondContact O-CB 3.44Å; R281-Q284 PolarHBondContact O-N 3.44Å; R281-Q284 VanDerWaalsContact O-N 3.07Å; R281-F285 HydrophobicContact CB-CD2 4.49Å; R281-F285 HydrophobicContact CB-CE2 4.38Å; R281-F285 WeakPolarHBondContact O-CD2 3.48Å; R281-F285 PolarHBondContact O-N 3.09Å
282	Q	89.1	Confident	81.8	Confident	96 Å²	96	84.4 Å²	84.4	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-57.6	-42.1	176.4	-168.9	-170.6	26.3	0	0	112.2	L278 R279 I280 F285 N286	L278-Q282 WeakPolarHBondContact O-CB 3.45Å; L278-Q282 PolarHBondContact O-N 3.29Å; R279-Q282 PolarHBondContact O-N 2.94Å; I280-Q282 PolarHBondContact O-N 3.46Å; Q282-F285 PolarHBondContact O-N 3.35Å; Q282-N286 WeakPolarHBondContact O-CB 3.2Å; Q282-N286 VanDerWaalsContact O-CG 3.25Å; Q282-N286 PolarHBondContact O-N 3.25Å; Q282-N286 PolarHBondContact O-OD1 3.5Å
283	R	86.4	Confident	79.5	Confident	44 Å²	44	86.7 Å²	86.7	17%	0.166	42%	0.418	C	S	.	.	H	α-helix	trans	-63.9	-39.3	175	-73.5	178.9	177.5	163.6	5.3	112.2	I187 R279 I280 R281 N286 V287 F381	I187-R283 PolarHBondContact O-NH2 2.88Å; R279-R283 WeakPolarHBondContact O-CG 3.29Å; R279-R283 PolarHBondContact O-N 3.21Å; I280-R283 PolarHBondContact O-N 3.06Å; R281-R283 VanDerWaalsContact C-N 3.31Å; R281-R283 PolarHBondContact O-N 2.7Å; R283-N286 PolarHBondContact O-N 2.98Å; R283-V287 WeakPolarHBondContact O-CG2 3.27Å; R283-V287 PolarHBondContact O-N 3.44Å; R283-V287 VanDerWaalsContact O-N 3.09Å; R283-F381 HydrophobicContact CB-CZ 4.5Å
284	Q	82.8	Confident	77.3	Confident	88 Å²	88	90.2 Å²	90.2	41%	0.411	44%	0.443	S	S	.	.	H	α-helix	trans	-62.7	-47.4	175.2	-66.2	176.3	-33.9	0	0	111.4	I280 R281 N286 V287 I288	I280-Q284 WeakPolarHBondContact O-CG 3.37Å; I280-Q284 PolarHBondContact O-N 3.45Å; R281-Q284 WeakPolarHBondContact O-CB 3.44Å; R281-Q284 PolarHBondContact O-N 3.44Å; R281-Q284 VanDerWaalsContact O-N 3.07Å; Q284-N286 PolarHBondContact O-N 2.81Å; Q284-V287 PolarHBondContact O-N 3.08Å; Q284-I288 WeakPolarHBondContact O-CG1 3.48Å; Q284-I288 PolarHBondContact O-N 3.04Å; Q284-I288 VanDerWaalsContact O-N 3.1Å
285	F	83	Confident	74.9	Confident	116 Å²	116	89.7 Å²	89.7	51%	0.509	44%	0.444	S	S	.	.	H	α-helix	trans	-60.3	-42.7	176.7	-76.9	-65.7	0	0	0	112.5	R281 Q282 V287 I288 R289	R281-F285 HydrophobicContact CB-CD2 4.49Å; R281-F285 HydrophobicContact CB-CE2 4.38Å; R281-F285 WeakPolarHBondContact O-CD2 3.48Å; R281-F285 PolarHBondContact O-N 3.09Å; Q282-F285 PolarHBondContact O-N 3.35Å; F285-V287 VanDerWaalsContact C-N 3.31Å; F285-V287 PolarHBondContact O-N 3.29Å; F285-I288 PolarHBondContact O-N 3.28Å; F285-R289 PolarHBondContact O-N 3.06Å
286	N	83	Confident	72.4	Confident	80 Å²	80	89.2 Å²	89.2	43%	0.428	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-31	178.7	-70.5	-3.2	0	0	0	112.8	Q282 R283 Q284 K290	Q282-N286 WeakPolarHBondContact O-CB 3.2Å; Q282-N286 VanDerWaalsContact O-CG 3.25Å; Q282-N286 PolarHBondContact O-N 3.25Å; Q282-N286 PolarHBondContact O-OD1 3.5Å; R283-N286 PolarHBondContact O-N 2.98Å; Q284-N286 PolarHBondContact O-N 2.81Å; N286-K290 PolarHBondContact O-N 2.87Å
287	V	76.5	Confident	70	Confident	44 Å²	44	91.7 Å²	91.7	27%	0.267	47%	0.467	S	S	.	.	H	α-helix	trans	-69.9	-39.6	173.3	170.5	0	0	0	0	111.4	R283 Q284 F285 R289 F381	R283-V287 WeakPolarHBondContact O-CG2 3.27Å; R283-V287 PolarHBondContact O-N 3.44Å; R283-V287 VanDerWaalsContact O-N 3.09Å; Q284-V287 PolarHBondContact O-N 3.08Å; F285-V287 VanDerWaalsContact C-N 3.31Å; F285-V287 PolarHBondContact O-N 3.29Å; V287-R289 VanDerWaalsContact C-N 3.32Å; V287-F381 HydrophobicContact CG2-CD1 4.01Å; V287-F381 HydrophobicContact CG2-CE1 3.52Å; V287-F381 HydrophobicContact CG2-CZ 4.33Å
288	I	74.4	Confident	67.6	Low	135 Å²	135	91.9 Å²	91.9	69%	0.692	47%	0.469	S	S	*	.	H	α-helix	trans	-66.1	-36.3	176.7	-64.8	165.9	0	0	0	110.9	Q284 F285	Q284-I288 WeakPolarHBondContact O-CG1 3.48Å; Q284-I288 PolarHBondContact O-N 3.04Å; Q284-I288 VanDerWaalsContact O-N 3.1Å; F285-I288 PolarHBondContact O-N 3.28Å
289	R	72	Confident	65	Low	204 Å²	204	93.4 Å²	93.4	77%	0.77	47%	0.474	S	S	*	.	H	α-helix	trans	-77.7	-24.5	-180	-79.2	-171.8	177.9	177.3	-0.8	115.2	F285 V287 P291	F285-R289 PolarHBondContact O-N 3.06Å; V287-R289 VanDerWaalsContact C-N 3.32Å; R289-P291 WeakPolarHBondContact O-CD 3.28Å
290	K	60.6	Low	62.6	Low	148 Å²	148	95.9 Å²	95.9	64%	0.643	49%	0.491	S	S	*	.	S	Bend	trans	-61.8	113.1	175.2	-81.5	-173	179.3	-168.8	0	107.1	N286 T292	N286-K290 PolarHBondContact O-N 2.87Å; K290-T292 PolarHBondContact O-N 3.29Å; K290-T292 VanDerWaalsContact O-N 3.14Å
291	P	47.9	Very low	60.4	Low	101 Å²	101	102.3 Å²	102.3	66%	0.656	52%	0.524	S	S	*	.			trans	-58.1	125.9	178	23.3	-30.8	0	0	0	107.5	R289	R289-P291 WeakPolarHBondContact O-CD 3.28Å
292	T	49.2	Very low	58.1	Low	111 Å²	111	100 Å²	100	68%	0.681	53%	0.531	S	S	*	.			trans	-46.5	132.8	150.4	-34.7	0	0	0	0	105.4	K290 T294	K290-T292 PolarHBondContact O-N 3.29Å; K290-T292 VanDerWaalsContact O-N 3.14Å; T292-T294 PolarHBondContact O-N 3.16Å; T292-T294 PolarHBondContact O-OG1 3.03Å
293	P	45.5	Very low	55.6	Low	47 Å²	47	98 Å²	98	31%	0.305	54%	0.537	S	S	.	.	S	Bend	trans	-66.5	76.6	178	26.7	-32.6	0	0	0	109.9	N371	P293-N371 WeakPolarHBondContact CG-OD1 3.38Å
294	T	45.5	Very low	53.1	Low	102 Å²	102	103.3 Å²	103.3	63%	0.626	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	2.7	159	25	0	0	0	0	111	T292 I296 A297	T292-T294 PolarHBondContact O-N 3.16Å; T292-T294 PolarHBondContact O-OG1 3.03Å; T294-I296 PolarHBondContact O-N 2.88Å; T294-A297 WeakPolarHBondContact O-CB 3.36Å; T294-A297 PolarHBondContact O-N 3.41Å
295	V	41.1	Very low	50.6	Low	87 Å²	87	106.8 Å²	106.8	53%	0.527	58%	0.584	S	S	.	*	H	α-helix	trans	-62.1	-21.2	169.1	-179.2	0	0	0	0	111.6	A297 S298 E299	V295-A297 VanDerWaalsContact C-N 3.28Å; V295-A297 PolarHBondContact O-N 3.38Å; V295-S298 PolarHBondContact O-N 3.26Å; V295-S298 PolarHBondContact O-OG 3.29Å; V295-E299 PolarHBondContact O-N 2.86Å
296	I	41.9	Very low	48.3	Very low	60 Å²	60	106.5 Å²	106.5	31%	0.308	59%	0.588	S	S	.	*	H	α-helix	trans	-71.8	-24.1	172.6	-48.2	-179.4	0	0	0	111.3	T294 L300	T294-I296 PolarHBondContact O-N 2.88Å; I296-L300 HydrophobicContact CG2-CD1 3.64Å; I296-L300 HydrophobicContact CG2-CG 3.94Å; I296-L300 WeakPolarHBondContact O-CB 3.17Å; I296-L300 WeakPolarHBondContact O-CD1 3.16Å; I296-L300 WeakPolarHBondContact O-CG 3.33Å; I296-L300 PolarHBondContact O-N 3.36Å
297	A	41.5	Very low	45.7	Very low	53 Å²	53	108.6 Å²	108.6	44%	0.438	60%	0.599	S	S	.	*	H	α-helix	trans	-72.4	-35.3	176.8	0	0	0	0	0	112.3	T294 V295 I301	T294-A297 WeakPolarHBondContact O-CB 3.36Å; T294-A297 PolarHBondContact O-N 3.41Å; V295-A297 VanDerWaalsContact C-N 3.28Å; V295-A297 PolarHBondContact O-N 3.38Å; A297-I301 WeakPolarHBondContact O-CD1 3.43Å; A297-I301 VanDerWaalsContact O-CG1 3.28Å; A297-I301 WeakPolarHBondContact O-CG1 3.37Å; A297-I301 PolarHBondContact O-N 2.92Å
298	S	40.4	Very low	43.3	Very low	77 Å²	77	113.1 Å²	113.1	54%	0.538	62%	0.615	S	S	.	*	H	α-helix	trans	-72.6	-36.4	174.8	47	0	0	0	0	112.3	V295	V295-S298 PolarHBondContact O-N 3.26Å; V295-S298 PolarHBondContact O-OG 3.29Å
299	E	38.1	Very low	41.1	Very low	134 Å²	134	111.9 Å²	111.9	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-71.6	-37.5	175.1	-124.6	95.5	-153.8	0	0	112.1	V295 I301 S302 G303	V295-E299 PolarHBondContact O-N 2.86Å; E299-I301 VanDerWaalsContact C-N 3.28Å; E299-I301 PolarHBondContact O-N 3.32Å; E299-S302 PolarHBondContact O-N 3.15Å; E299-G303 PolarHBondContact O-N 2.83Å; E299-G303 VanDerWaalsContact O-N 3.1Å
300	L	40.3	Very low	38.8	Very low	121 Å²	121	110.7 Å²	110.7	63%	0.634	62%	0.617	S	S	*	*	H	α-helix	trans	-66.6	-26.8	178.2	-82.3	164.9	0	0	0	113.1	I296 S302	I296-L300 HydrophobicContact CG2-CD1 3.64Å; I296-L300 HydrophobicContact CG2-CG 3.94Å; I296-L300 WeakPolarHBondContact O-CB 3.17Å; I296-L300 WeakPolarHBondContact O-CD1 3.16Å; I296-L300 WeakPolarHBondContact O-CG 3.33Å; I296-L300 PolarHBondContact O-N 3.36Å; L300-S302 VanDerWaalsContact C-N 3.3Å
301	I	40.3	Very low	37.1	Very low	148 Å²	148	110.4 Å²	110.4	76%	0.759	62%	0.621	S	S	*	*	H	α-helix	trans	-74.5	-24.7	173.8	-65.5	165.9	0	0	0	110.9	A297 E299	A297-I301 WeakPolarHBondContact O-CD1 3.43Å; A297-I301 VanDerWaalsContact O-CG1 3.28Å; A297-I301 WeakPolarHBondContact O-CG1 3.37Å; A297-I301 PolarHBondContact O-N 2.92Å; E299-I301 VanDerWaalsContact C-N 3.28Å; E299-I301 PolarHBondContact O-N 3.32Å
302	S	40.4	Very low	35.9	Very low	104 Å²	104	114 Å²	114	73%	0.727	63%	0.629	S	S	*	*	H	α-helix	trans	-91.1	-21.6	-179.2	-160.7	0	0	0	0	114	E299 L300 N304	E299-S302 PolarHBondContact O-N 3.15Å; L300-S302 VanDerWaalsContact C-N 3.3Å; S302-N304 PolarHBondContact O-N 2.84Å
303	G	37	Very low	34.9	Very low	54 Å²	54	113.5 Å²	113.5	56%	0.557	63%	0.627	S	S	*	*			trans	-94	71.4	-177.3	0	0	0	0	0	113.2	E299 Q305	E299-G303 PolarHBondContact O-N 2.83Å; E299-G303 VanDerWaalsContact O-N 3.1Å; G303-Q305 PolarHBondContact O-N 2.87Å
304	N	33	Very low	33.8	Very low	155 Å²	155	119 Å²	119	83%	0.829	66%	0.655	S	S	*	*			trans	-73.4	74.6	174.6	-135.6	12.4	0	0	0	110.2	S302	S302-N304 PolarHBondContact O-N 2.84Å
305	Q	31.9	Very low	32.8	Very low	161 Å²	161	119.6 Å²	119.6	75%	0.752	66%	0.661	S	S	*	*			trans	-143.6	93.1	167.5	-103.4	-179.3	-12.1	0	0	109.3	G303 D307	G303-Q305 PolarHBondContact O-N 2.87Å; Q305-D307 PolarHBondContact O-N 3.49Å
306	L	34.8	Very low	32.1	Very low	110 Å²	110	122.9 Å²	122.9	58%	0.576	68%	0.676	S	S	*	*			trans	-87.4	88.5	174.6	-83.2	153.4	0	0	0	108.9	F308 A359	L306-F308 HydrophobicContact CB-CE2 4.36Å; L306-A359 HydrophobicContact CD2-CB 3.73Å
307	D	27.9	Very low	31.3	Very low	124 Å²	124	126.2 Å²	126.2	66%	0.663	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-87	124.6	166.5	-74.1	-25.6	0	0	0	109.8	Q305	Q305-D307 PolarHBondContact O-N 3.49Å
308	F	26.7	Very low	30.5	Very low	139 Å²	139	132.3 Å²	132.3	61%	0.61	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-90.5	119.4	-178.8	-62.3	-91.2	0	0	0	109.5	L306 K357	L306-F308 HydrophobicContact CB-CE2 4.36Å; F308-K357 HydrophobicContact CD1-CD 4.09Å
309	V	26.8	Very low	30	Very low	109 Å²	109	136.2 Å²	136.2	66%	0.661	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-103.7	123.1	168.9	-179.7	0	0	0	0	109	I311	V309-I311 PolarHBondContact O-N 3.42Å
310	E	23.4	Very low	29.5	Very low	179 Å²	179	137.4 Å²	137.4	84%	0.836	75%	0.75	S	S	*	*			trans	-77.8	108.4	174.4	-169	163.5	-150.8	0	0	108.3
311	I	25.2	Very low	28.8	Very low	142 Å²	142	141.1 Å²	141.1	73%	0.728	76%	0.761	S	S	*	*			trans	-91.8	106.4	175.2	-57.7	175.3	0	0	0	107.1	V309	V309-I311 PolarHBondContact O-N 3.42Å
312	E	23.5	Very low	28.2	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	77%	0.769	S	S	*	*			trans	-67	123.8	165.8	-151.2	169.7	-163.5	0	0	107.6	D314	E312-D314 PolarHBondContact O-N 3.39Å; E312-D314 VanDerWaalsContact O-N 3.15Å
313	P	27	Very low	27.5	Very low	99 Å²	99	146.7 Å²	146.7	64%	0.643	77%	0.774	S	S	*	*			trans	-73.7	112.7	-173.3	27.9	-31.1	0	0	0	109.5	C315	P313-C315 PolarHBondContact O-N 3.23Å
314	D	24.1	Very low	27.1	Very low	164 Å²	164	149.8 Å²	149.8	88%	0.877	78%	0.784	S	S	*	*			trans	-61.9	101.7	162.9	-102.1	-28.9	0	0	0	108.2	E312 N316	E312-D314 PolarHBondContact O-N 3.39Å; E312-D314 VanDerWaalsContact O-N 3.15Å; D314-N316 PolarHBondContact O-N 2.99Å
315	C	24.7	Very low	26.7	Very low	114 Å²	114	149.9 Å²	149.9	77%	0.77	79%	0.785	S	S	*	*			trans	-64.7	77.9	173.7	-71.8	0	0	0	0	110	P313	P313-C315 PolarHBondContact O-N 3.23Å
316	N	25	Very low	26.5	Very low	155 Å²	155	147.3 Å²	147.3	83%	0.829	79%	0.785	S	S	*	*			trans	-153.1	60.1	163.1	-91.8	-26.7	0	0	0	110.3	D314	D314-N316 PolarHBondContact O-N 2.99Å
317	C	25.5	Very low	26	Very low	130 Å²	130	153.2 Å²	153.2	88%	0.878	80%	0.8	S	S	*	*			trans	-132	79	160.6	-82.3	0	0	0	0	107.9	D319	C317-D319 VanDerWaalsContact C-N 3.25Å; C317-D319 PolarHBondContact O-N 2.85Å; C317-D319 VanDerWaalsContact O-N 3.1Å
318	M	25.7	Very low	25.8	Very low	182 Å²	182	154.6 Å²	154.6	90%	0.897	81%	0.806	S	S	*	*			trans	-65	93.3	152.2	-77.3	-93.2	175.5	0	0	106.4
319	D	28.7	Very low	25.5	Very low	159 Å²	159	153.8 Å²	153.8	85%	0.85	81%	0.813	S	S	*	*			trans	-168.2	101.7	141.5	-97.2	-27.1	0	0	0	109.7	C317	C317-D319 VanDerWaalsContact C-N 3.25Å; C317-D319 PolarHBondContact O-N 2.85Å; C317-D319 VanDerWaalsContact O-N 3.1Å
320	D	27.5	Very low	25.5	Very low	158 Å²	158	155.2 Å²	155.2	85%	0.845	82%	0.816	S	S	*	*			trans	-57	143.6	166.5	-87	-45.5	0	0	0	110.9
321	K	25.5	Very low	25.4	Very low	199 Å²	199	152.8 Å²	152.8	87%	0.865	81%	0.813	S	S	*	*			trans	97.2	59.6	168.6	-54	174.9	-178.3	171.9	0	116.6	K323	K321-K323 PolarHBondContact O-N 3.4Å
322	L	28.1	Very low	25.7	Very low	176 Å²	176	153.6 Å²	153.6	92%	0.921	82%	0.818	S	S	*	*			trans	-83	102.4	143	-146.7	77	0	0	0	108.8
323	K	24.8	Very low	25.8	Very low	194 Å²	194	150.7 Å²	150.7	84%	0.843	82%	0.815	S	S	*	*			trans	-58.3	132.8	171.3	-97.5	-178.6	173.7	-178.6	0	109.9	K321 D325	K321-K323 PolarHBondContact O-N 3.4Å; K323-D325 PolarHBondContact O-N 3.04Å
324	P	30.2	Very low	25.7	Very low	118 Å²	118	151.5 Å²	151.5	77%	0.766	82%	0.823	S	S	*	*			trans	-84	112.5	176.9	32.5	-27.6	0	0	0	108.3
325	D	24.6	Very low	26	Very low	157 Å²	157	150.3 Å²	150.3	84%	0.84	82%	0.817	S	S	*	*			trans	-158.8	107.1	155	-112.3	-24.4	0	0	0	111.8	K323	K323-D325 PolarHBondContact O-N 3.04Å
326	S	27.7	Very low	26.2	Very low	107 Å²	107	152.3 Å²	152.3	75%	0.748	82%	0.82	S	S	*	*				149	91.1	126.6	55.7	0	0	0	0	111.7
327	R	23	Very low	26.5	Very low	235 Å²	235	152.6 Å²	152.6	89%	0.887	82%	0.819	S	S	*	*			trans	39.7	87.4	143	-61.9	-178	175	-167.4	-2.7	116.8
328	L	25	Very low	26.5	Very low	153 Å²	153	152 Å²	152	80%	0.801	81%	0.814	S	S	*	*			trans	-112.5	92.8	147.2	-132.6	87.8	0	0	0	108.1	L330	L328-L330 HydrophobicContact CD2-CD1 4.06Å; L328-L330 HydrophobicContact CD2-CG 4.47Å; L328-L330 PolarHBondContact O-N 2.7Å
329	T	20.7	Very low	26.5	Very low	122 Å²	122	151.2 Å²	151.2	75%	0.748	81%	0.814	S	S	*	*			trans	-78.9	94.5	172.7	-51.4	0	0	0	0	107.8	T331	T329-T331 HydrophobicContact CG2-CG2 4.49Å
330	L	25	Very low	26.4	Very low	139 Å²	139	148.9 Å²	148.9	73%	0.728	81%	0.809	S	S	*	*			trans	-91.4	98.4	167.1	-84.2	157.3	0	0	0	108	L328 L332	L328-L330 HydrophobicContact CD2-CD1 4.06Å; L328-L330 HydrophobicContact CD2-CG 4.47Å; L328-L330 PolarHBondContact O-N 2.7Å; L330-L332 PolarHBondContact O-N 2.94Å; L330-L332 VanDerWaalsContact O-N 3.15Å
331	T	22.2	Very low	26.4	Very low	128 Å²	128	147 Å²	147	79%	0.785	81%	0.809	S	S	*	*			trans	-67.9	100.6	164.3	42.2	0	0	0	0	108.6	T329	T329-T331 HydrophobicContact CG2-CG2 4.49Å
332	L	30.7	Very low	26.3	Very low	158 Å²	158	144.6 Å²	144.6	83%	0.827	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-74	132.5	167.1	-89.9	135	0	0	0	109.6	L330 S334	L330-L332 PolarHBondContact O-N 2.94Å; L330-L332 VanDerWaalsContact O-N 3.15Å; L332-S334 PolarHBondContact O-N 3.21Å
333	P	25.7	Very low	26.2	Very low	117 Å²	117	139.7 Å²	139.7	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68	126.5	170.4	-11.9	26.7	0	0	0	109.7	N335	P333-N335 PolarHBondContact O-N 2.83Å
334	S	26.6	Very low	26.2	Very low	117 Å²	117	134.8 Å²	134.8	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-58.7	116.5	165.1	-80.5	0	0	0	0	108.9	L332	L332-S334 PolarHBondContact O-N 3.21Å
335	N	29.4	Very low	26	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	80%	0.801	S	S	*	*			trans	-158.4	105.8	150.5	-95.3	-18.2	0	0	0	109.2	P333	P333-N335 PolarHBondContact O-N 2.83Å
336	N	28.3	Very low	26.1	Very low	155 Å²	155	136.4 Å²	136.4	83%	0.829	80%	0.797	S	S	*	*			trans	34.6	92.2	150.3	-59.5	-11.8	0	0	0	117.4
337	I	30.9	Very low	26	Very low	161 Å²	161	138.4 Å²	138.4	83%	0.826	80%	0.799	S	S	*	*			trans	-96.4	123.1	159.2	-61.4	175	0	0	0	107.3
338	P	27.2	Very low	26.2	Very low	117 Å²	117	138.7 Å²	138.7	76%	0.76	80%	0.8	S	S	*	*			trans	-73	137.8	177.6	-10.5	25.7	0	0	0	112.1	S340	P338-S340 PolarHBondContact O-N 2.96Å
339	D	23.9	Very low	26.3	Very low	167 Å²	167	135.7 Å²	135.7	89%	0.893	81%	0.805	S	S	*	*			trans	-62.7	111.4	168.3	-67	-48	0	0	0	111.2
340	S	27.2	Very low	26.8	Very low	109 Å²	109	138.8 Å²	138.8	76%	0.762	81%	0.809	S	S	*	*			trans	-173.8	102.8	147.4	60.2	0	0	0	0	111.8	P338	P338-S340 PolarHBondContact O-N 2.96Å
341	S	27.3	Very low	27	Very low	119 Å²	119	137.5 Å²	137.5	83%	0.832	81%	0.809	S	S	*	*				167.5	109.2	114.4	62.5	0	0	0	0	109.3	G343	S341-G343 PolarHBondContact O-N 3.5Å
342	T	24.6	Very low	27.3	Very low	148 Å²	148	137.3 Å²	137.3	91%	0.908	81%	0.81	S	S	*	*			trans	-62.3	99.8	173.4	44.2	0	0	0	0	111.7
343	G	26	Very low	27.2	Very low	73 Å²	73	134 Å²	134	75%	0.753	81%	0.805	S	S	*	*			trans	-87.2	105.3	161.2	0	0	0	0	0	109.9	S341 C345	S341-G343 PolarHBondContact O-N 3.5Å; G343-C345 PolarHBondContact O-N 2.97Å
344	S	24.4	Very low	27.3	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	81%	0.806	S	S	*	*			trans	-69.9	86.5	-175.8	169	0	0	0	0	112.6	K346	S344-K346 PolarHBondContact O-N 3.49Å; S344-K346 VanDerWaalsContact O-N 3.14Å
345	C	26.1	Very low	27.3	Very low	138 Å²	138	138.6 Å²	138.6	93%	0.932	81%	0.807	S	S	*	*			trans	-82	75.1	156.9	-80.7	0	0	0	0	109.6	G343	G343-C345 PolarHBondContact O-N 2.97Å
346	K	25.5	Very low	27.2	Very low	171 Å²	171	140.8 Å²	140.8	74%	0.743	81%	0.806	S	S	*	*			trans	-74.6	134.8	165.1	-83.5	178.1	177.1	177.1	0	109	S344	S344-K346 PolarHBondContact O-N 3.49Å; S344-K346 VanDerWaalsContact O-N 3.14Å
347	N	27.1	Very low	27	Very low	149 Å²	149	141 Å²	141	80%	0.797	80%	0.8	S	S	*	*	S	Bend	trans	75.6	80.2	162.1	-60.2	-13.1	0	0	0	117.9
348	R	27.4	Very low	26.8	Very low	241 Å²	241	140 Å²	140	91%	0.909	80%	0.796	S	S	*	*				-169.7	123	122.5	-97.8	165.6	-154.6	-163.9	6.9	107.6	F350	R348-F350 VanDerWaalsContact C-N 3.32Å; R348-F350 PolarHBondContact O-N 3.36Å
349	G	27.2	Very low	26.9	Very low	89 Å²	89	137.4 Å²	137.4	92%	0.918	78%	0.784	S	S	*	*			trans	-69.4	72.5	-167.3	0	0	0	0	0	115.6
350	F	29.5	Very low	27.2	Very low	188 Å²	188	132.9 Å²	132.9	83%	0.825	76%	0.762	S	S	*	*			trans	-120.1	139.4	162.4	-84	-88.5	0	0	0	109.8	R348	R348-F350 VanDerWaalsContact C-N 3.32Å; R348-F350 PolarHBondContact O-N 3.36Å
351	P	29.5	Very low	27.4	Very low	111 Å²	111	130.5 Å²	130.5	72%	0.721	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-63.7	143.5	-177.8	27	-32.7	0	0	0	110.3	A353	P351-A353 PolarHBondContact O-N 3.42Å; P351-A353 VanDerWaalsContact O-N 3.16Å
352	P	28.4	Very low	27.9	Very low	125 Å²	125	130.1 Å²	130.1	81%	0.812	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-62.9	119.8	-174.3	24.6	-32.3	0	0	0	110.3	R354	P352-R354 PolarHBondContact O-N 2.86Å
353	A	29.8	Very low	28.7	Very low	88 Å²	88	128 Å²	128	73%	0.727	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-58.1	125.1	167.1	0	0	0	0	0	108.4	P351 C355	P351-A353 PolarHBondContact O-N 3.42Å; P351-A353 VanDerWaalsContact O-N 3.16Å; A353-C355 PolarHBondContact O-N 3.25Å
354	R	28	Very low	29.6	Very low	206 Å²	206	126.2 Å²	126.2	78%	0.777	70%	0.703	S	S	*	*			trans	-68	97.4	-179.5	-144.7	178.4	-164.1	-180	4.3	108.2	P352 Y356	P352-R354 PolarHBondContact O-N 2.86Å; R354-Y356 HydrophobicContact CB-CE2 4.48Å; R354-Y356 WeakPolarHBondContact O-CD2 3.4Å; R354-Y356 PolarHBondContact O-N 2.94Å
355	C	24.8	Very low	30.5	Very low	124 Å²	124	126.6 Å²	126.6	84%	0.838	70%	0.701	S	S	*	*			trans	-62.5	117.6	173.5	-74.7	0	0	0	0	109.8	A353	A353-C355 PolarHBondContact O-N 3.25Å
356	Y	27.5	Very low	31.7	Very low	185 Å²	185	123.1 Å²	123.1	73%	0.725	68%	0.679	S	S	*	*			trans	-91.4	118.8	167.1	-65.5	-84.5	0	0	0	108.5	R354 L358	R354-Y356 HydrophobicContact CB-CE2 4.48Å; R354-Y356 WeakPolarHBondContact O-CD2 3.4Å; R354-Y356 PolarHBondContact O-N 2.94Å; Y356-L358 PolarHBondContact O-N 3.37Å
357	K	24.4	Very low	33.2	Very low	161 Å²	161	116.5 Å²	116.5	70%	0.7	65%	0.654	S	S	*	*			trans	-75.3	108.5	165.8	-75.5	-177	176	-177.6	0	107.9	F308	F308-K357 HydrophobicContact CD1-CD 4.09Å
358	L	27.1	Very low	34.6	Very low	140 Å²	140	113.4 Å²	113.4	73%	0.733	64%	0.643	S	S	*	*			trans	-95.3	120	171.7	-144.3	85.1	0	0	0	108.6	Y356 V360	Y356-L358 PolarHBondContact O-N 3.37Å; L358-V360 HydrophobicContact CD2-CG2 4.38Å; L358-V360 PolarHBondContact O-N 2.96Å
359	A	28.8	Very low	36.5	Very low	62 Å²	62	106.8 Å²	106.8	51%	0.512	62%	0.622	S	S	.	*			trans	-67.4	115.4	173	0	0	0	0	0	109.2	L306	L306-A359 HydrophobicContact CD2-CB 3.73Å
360	V	30.3	Very low	38.6	Very low	71 Å²	71	107.1 Å²	107.1	43%	0.43	60%	0.603	S	S	.	*			trans	-124.8	101.8	172.6	-173.9	0	0	0	0	107.2	L358 S364	L358-V360 HydrophobicContact CD2-CG2 4.38Å; L358-V360 PolarHBondContact O-N 2.96Å; V360-S364 WeakPolarHBondContact CG1-OG 3.46Å
361	S	32.6	Very low	40.8	Very low	59 Å²	59	101.1 Å²	101.1	41%	0.413	58%	0.58	S	S	.	*			trans	-63.4	136.2	172.7	-159.3	0	0	0	0	109	T363 S364	S361-T363 PolarHBondContact O-N 3.29Å; S361-S364 WeakPolarHBondContact O-CB 3.21Å; S361-S364 PolarHBondContact O-N 3.36Å; S361-S364 PolarHBondContact O-OG 3.29Å
362	P	37.8	Very low	43.1	Very low	112 Å²	112	101.9 Å²	101.9	73%	0.727	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-7.8	-174.1	20.3	-29.2	0	0	0	114.8	S364	P362-S364 VanDerWaalsContact C-N 3.33Å
363	T	39.7	Very low	45.5	Very low	103 Å²	103	101 Å²	101	63%	0.632	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	0.5	168.7	49.7	0	0	0	0	113.8	S361 S367	S361-T363 PolarHBondContact O-N 3.29Å; T363-S367 PolarHBondContact O-OG 2.85Å; T363-S367 VanDerWaalsContact O-OG 3.05Å
364	S	46.3	Very low	47.8	Very low	35 Å²	35	100.3 Å²	100.3	25%	0.245	54%	0.537	C	S	.	.	H	α-helix	trans	-79.2	-24.2	-177.5	78.8	0	0	0	0	114.2	V360 S361 P362 S367 C368	V360-S364 WeakPolarHBondContact CG1-OG 3.46Å; S361-S364 WeakPolarHBondContact O-CB 3.21Å; S361-S364 PolarHBondContact O-N 3.36Å; S361-S364 PolarHBondContact O-OG 3.29Å; P362-S364 VanDerWaalsContact C-N 3.33Å; S364-S367 VanDerWaalsContact CA-OG 3.27Å; S364-S367 WeakPolarHBondContact CA-OG 3.47Å; S364-S367 PolarHBondContact O-OG 3.49Å; S364-S367 VanDerWaalsContact O-OG 3.07Å; S364-C368 WeakPolarHBondContact O-CB 3.39Å; S364-C368 PolarHBondContact O-N 2.99Å
365	T	42.5	Very low	50.2	Low	100 Å²	100	97.4 Å²	97.4	61%	0.613	53%	0.53	S	S	*	.	H	α-helix	trans	-71.6	-46.3	-173.8	54.3	0	0	0	0	111.6	C368 E369	T365-C368 PolarHBondContact O-N 2.71Å; T365-E369 WeakPolarHBondContact O-CB 2.87Å; T365-E369 PolarHBondContact O-N 2.9Å
366	S	52.3	Low	52.9	Low	66 Å²	66	94.5 Å²	94.5	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-67.2	-39.2	175.8	66.6	0	0	0	0	112	N370	S366-N370 WeakPolarHBondContact O-CB 3.49Å; S366-N370 PolarHBondContact O-N 3.45Å; S366-N370 PolarHBondContact O-ND2 2.97Å
367	S	56	Low	55.5	Low	32 Å²	32	91.8 Å²	91.8	22%	0.224	50%	0.499	C	S	.	.	H	α-helix	trans	-70.1	-39.1	176.8	57.3	0	0	0	0	112.1	T363 S364 N371	T363-S367 PolarHBondContact O-OG 2.85Å; T363-S367 VanDerWaalsContact O-OG 3.05Å; S364-S367 VanDerWaalsContact CA-OG 3.27Å; S364-S367 WeakPolarHBondContact CA-OG 3.47Å; S364-S367 PolarHBondContact O-OG 3.49Å; S364-S367 VanDerWaalsContact O-OG 3.07Å; S367-N371 VanDerWaalsContact O-CB 3.22Å; S367-N371 WeakPolarHBondContact O-CB 3.47Å; S367-N371 PolarHBondContact O-N 2.94Å; S367-N371 PolarHBondContact O-ND2 3.39Å
368	C	57	Low	58.2	Low	83 Å²	83	87.3 Å²	87.3	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-66.2	-45	174.7	-168.6	0	0	0	0	111.7	S364 T365 N370 N371 F372	S364-C368 WeakPolarHBondContact O-CB 3.39Å; S364-C368 PolarHBondContact O-N 2.99Å; T365-C368 PolarHBondContact O-N 2.71Å; C368-N370 PolarHBondContact O-N 3.5Å; C368-N371 PolarHBondContact O-N 3.42Å; C368-F372 WeakPolarHBondContact O-CB 3.27Å; C368-F372 PolarHBondContact O-N 3.42Å
369	E	67	Low	60.8	Low	102 Å²	102	83.9 Å²	83.9	48%	0.477	47%	0.471	S	S	.	.	H	α-helix	trans	-63.3	-42.4	176.9	-163.7	-171.1	155.7	0	0	111.5	T365 F372 K373	T365-E369 WeakPolarHBondContact O-CB 2.87Å; T365-E369 PolarHBondContact O-N 2.9Å; E369-F372 PolarHBondContact O-N 3.32Å; E369-K373 HydrophobicContact CG-CD 4.4Å; E369-K373 WeakPolarHBondContact O-CB 3.27Å; E369-K373 WeakPolarHBondContact O-CG 3.2Å; E369-K373 PolarHBondContact O-N 2.95Å; E369-K373 VanDerWaalsContact OE1-CE 3.29Å; E369-K373 WeakPolarHBondContact OE1-CE 3.48Å; E369-K373 IonicContact OE1-NZ 2.66Å; E369-K373 PolarHBondContact OE1-NZ 3.05Å
370	N	71.4	Confident	63.4	Low	97 Å²	97	89.3 Å²	89.3	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-43.2	175	-74.1	-26.9	0	0	0	111.9	S366 C368 F372 K373 Q374	S366-N370 WeakPolarHBondContact O-CB 3.49Å; S366-N370 PolarHBondContact O-N 3.45Å; S366-N370 PolarHBondContact O-ND2 2.97Å; C368-N370 PolarHBondContact O-N 3.5Å; N370-F372 VanDerWaalsContact C-N 3.32Å; N370-F372 PolarHBondContact O-N 3.39Å; N370-K373 PolarHBondContact O-N 2.95Å; N370-Q374 VanDerWaalsContact O-CB 3.23Å; N370-Q374 WeakPolarHBondContact O-CB 3.25Å; N370-Q374 PolarHBondContact O-N 3.48Å
371	N	74.9	Confident	65.9	Low	61 Å²	61	90 Å²	90	33%	0.326	48%	0.476	S	S	.	.	H	α-helix	trans	-62.2	-40.1	175	-76.3	-30.2	0	0	0	111.6	P293 S367 C368 K375	P293-N371 WeakPolarHBondContact CG-OD1 3.38Å; S367-N371 VanDerWaalsContact O-CB 3.22Å; S367-N371 WeakPolarHBondContact O-CB 3.47Å; S367-N371 PolarHBondContact O-N 2.94Å; S367-N371 PolarHBondContact O-ND2 3.39Å; C368-N371 PolarHBondContact O-N 3.42Å; N371-K375 VanDerWaalsContact O-CB 3.28Å; N371-K375 WeakPolarHBondContact O-CB 3.43Å; N371-K375 PolarHBondContact O-N 2.92Å
372	F	79.4	Confident	68.2	Low	128 Å²	128	92.4 Å²	92.4	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-68	-48.1	177.7	-175.5	-107	0	0	0	112	C368 E369 N370 Q374 K375 I376	C368-F372 WeakPolarHBondContact O-CB 3.27Å; C368-F372 PolarHBondContact O-N 3.42Å; E369-F372 PolarHBondContact O-N 3.32Å; N370-F372 VanDerWaalsContact C-N 3.32Å; N370-F372 PolarHBondContact O-N 3.39Å; F372-Q374 VanDerWaalsContact C-N 3.34Å; F372-Q374 PolarHBondContact O-N 2.75Å; F372-K375 WeakPolarHBondContact O-CB 3.36Å; F372-K375 PolarHBondContact O-N 3.2Å; F372-K375 VanDerWaalsContact O-N 3.17Å; F372-I376 HydrophobicContact CD1-CD1 3.75Å; F372-I376 HydrophobicContact CE1-CD1 3.28Å; F372-I376 HydrophobicContact CE1-CG1 4.31Å; F372-I376 HydrophobicContact CE2-CD1 4.38Å; F372-I376 HydrophobicContact CG-CD1 4.49Å; F372-I376 HydrophobicContact CZ-CD1 3.64Å; F372-I376 HydrophobicContact CZ-CG1 4.35Å; F372-I376 WeakPolarHBondContact O-CG1 3.48Å; F372-I376 PolarHBondContact O-N 2.62Å
373	K	77.1	Confident	70.4	Confident	107 Å²	107	91 Å²	91	47%	0.465	47%	0.465	S	S	.	.	H	α-helix	trans	-55.7	-48.2	173	-80.3	171.8	169.8	162.4	0	111	E369 N370 K375 I376 E377	E369-K373 HydrophobicContact CG-CD 4.4Å; E369-K373 WeakPolarHBondContact O-CB 3.27Å; E369-K373 WeakPolarHBondContact O-CG 3.2Å; E369-K373 PolarHBondContact O-N 2.95Å; E369-K373 VanDerWaalsContact OE1-CE 3.29Å; E369-K373 WeakPolarHBondContact OE1-CE 3.48Å; E369-K373 IonicContact OE1-NZ 2.66Å; E369-K373 PolarHBondContact OE1-NZ 3.05Å; N370-K373 PolarHBondContact O-N 2.95Å; K373-K375 VanDerWaalsContact C-N 3.34Å; K373-K375 PolarHBondContact O-N 3.39Å; K373-I376 PolarHBondContact O-N 2.95Å; K373-E377 WeakPolarHBondContact O-CG 3.47Å; K373-E377 PolarHBondContact O-N 3.35Å
374	Q	78.1	Confident	72.3	Confident	72 Å²	72	90.2 Å²	90.2	34%	0.336	46%	0.456	S	S	.	.	H	α-helix	trans	-61.9	-39.2	177.3	-169	-178.2	19.7	0	0	112.2	N370 F372 E377 N378	N370-Q374 VanDerWaalsContact O-CB 3.23Å; N370-Q374 WeakPolarHBondContact O-CB 3.25Å; N370-Q374 PolarHBondContact O-N 3.48Å; F372-Q374 VanDerWaalsContact C-N 3.34Å; F372-Q374 PolarHBondContact O-N 2.75Å; Q374-E377 PolarHBondContact O-N 3.25Å; Q374-N378 VanDerWaalsContact O-CB 3.3Å; Q374-N378 WeakPolarHBondContact O-CB 3Å; Q374-N378 VanDerWaalsContact O-CG 3.23Å; Q374-N378 PolarHBondContact O-N 3.18Å; Q374-N378 PolarHBondContact O-ND2 2.96Å
375	K	79.2	Confident	74	Confident	145 Å²	145	89.4 Å²	89.4	63%	0.63	45%	0.448	S	S	*	.	H	α-helix	trans	-64.9	-40.5	176	-171.5	176.8	-178.2	179.6	0	111.9	N371 F372 K373 S379	N371-K375 VanDerWaalsContact O-CB 3.28Å; N371-K375 WeakPolarHBondContact O-CB 3.43Å; N371-K375 PolarHBondContact O-N 2.92Å; F372-K375 WeakPolarHBondContact O-CB 3.36Å; F372-K375 PolarHBondContact O-N 3.2Å; F372-K375 VanDerWaalsContact O-N 3.17Å; K373-K375 VanDerWaalsContact C-N 3.34Å; K373-K375 PolarHBondContact O-N 3.39Å; K375-S379 WeakPolarHBondContact O-CB 3.43Å; K375-S379 PolarHBondContact O-N 3.37Å; K375-S379 PolarHBondContact O-OG 2.9Å
376	I	82.6	Confident	75.8	Confident	63 Å²	63	93.1 Å²	93.1	32%	0.323	45%	0.451	S	S	.	.	H	α-helix	trans	-63.5	-47.6	174.2	-70.4	172.6	0	0	0	110.4	F372 K373 N378 S379 R380	F372-I376 HydrophobicContact CD1-CD1 3.75Å; F372-I376 HydrophobicContact CE1-CD1 3.28Å; F372-I376 HydrophobicContact CE1-CG1 4.31Å; F372-I376 HydrophobicContact CE2-CD1 4.38Å; F372-I376 HydrophobicContact CG-CD1 4.49Å; F372-I376 HydrophobicContact CZ-CD1 3.64Å; F372-I376 HydrophobicContact CZ-CG1 4.35Å; F372-I376 WeakPolarHBondContact O-CG1 3.48Å; F372-I376 PolarHBondContact O-N 2.62Å; K373-I376 PolarHBondContact O-N 2.95Å; I376-N378 PolarHBondContact O-N 3.47Å; I376-S379 WeakPolarHBondContact O-CB 3.31Å; I376-S379 PolarHBondContact O-N 3.13Å; I376-R380 HydrophobicContact CG2-CG 4.36Å; I376-R380 WeakPolarHBondContact O-CG 3.37Å; I376-R380 PolarHBondContact O-N 3.15Å
377	E	81	Confident	77.2	Confident	128 Å²	128	96.8 Å²	96.8	60%	0.598	46%	0.455	S	S	*	.	H	α-helix	trans	-61.4	-44.4	178.7	-73.6	-177.3	172.1	0	0	112.3	K373 Q374 S379 R380 F381	K373-E377 WeakPolarHBondContact O-CG 3.47Å; K373-E377 PolarHBondContact O-N 3.35Å; Q374-E377 PolarHBondContact O-N 3.25Å; E377-S379 VanDerWaalsContact C-N 3.29Å; E377-S379 PolarHBondContact O-N 3.49Å; E377-R380 PolarHBondContact O-N 3.3Å; E377-F381 WeakPolarHBondContact O-CB 3.44Å; E377-F381 PolarHBondContact O-N 3.26Å
378	N	81.2	Confident	78.5	Confident	67 Å²	67	97.5 Å²	97.5	36%	0.358	45%	0.454	S	S	.	.	H	α-helix	trans	-61	-38.8	174.8	-77.5	-23.2	0	0	0	111.9	Q374 I376 K382	Q374-N378 VanDerWaalsContact O-CB 3.3Å; Q374-N378 WeakPolarHBondContact O-CB 3Å; Q374-N378 VanDerWaalsContact O-CG 3.23Å; Q374-N378 PolarHBondContact O-N 3.18Å; Q374-N378 PolarHBondContact O-ND2 2.96Å; I376-N378 PolarHBondContact O-N 3.47Å; N378-K382 WeakPolarHBondContact O-CB 3.46Å; N378-K382 VanDerWaalsContact O-CG 3.29Å; N378-K382 WeakPolarHBondContact O-CG 3.41Å; N378-K382 PolarHBondContact O-N 2.96Å
379	S	80.9	Confident	79.7	Confident	69 Å²	69	96 Å²	96	48%	0.483	44%	0.442	S	S	.	.	H	α-helix	trans	-68.3	-43.9	176.9	-58.7	0	0	0	0	111.7	K375 I376 E377 K382 L383	K375-S379 WeakPolarHBondContact O-CB 3.43Å; K375-S379 PolarHBondContact O-N 3.37Å; K375-S379 PolarHBondContact O-OG 2.9Å; I376-S379 WeakPolarHBondContact O-CB 3.31Å; I376-S379 PolarHBondContact O-N 3.13Å; E377-S379 VanDerWaalsContact C-N 3.29Å; E377-S379 PolarHBondContact O-N 3.49Å; S379-K382 PolarHBondContact O-N 3.16Å; S379-L383 WeakPolarHBondContact O-CB 3.26Å; S379-L383 PolarHBondContact O-N 3.02Å
380	R	83.7	Confident	80.4	Confident	175 Å²	175	97.8 Å²	97.8	66%	0.66	45%	0.445	S	S	*	.	H	α-helix	trans	-60	-45.6	173.3	-73.8	179.3	176.2	-173.7	-0.1	111	I376 E377 L383 I384	I376-R380 HydrophobicContact CG2-CG 4.36Å; I376-R380 WeakPolarHBondContact O-CG 3.37Å; I376-R380 PolarHBondContact O-N 3.15Å; E377-R380 PolarHBondContact O-N 3.3Å; R380-L383 PolarHBondContact O-N 3.04Å; R380-I384 VanDerWaalsContact O-CG1 3.31Å; R380-I384 WeakPolarHBondContact O-CG1 3.35Å; R380-I384 PolarHBondContact O-N 2.76Å
381	F	82.4	Confident	80.8	Confident	85 Å²	85	94.2 Å²	94.2	37%	0.373	43%	0.427	S	S	.	.	H	α-helix	trans	-60.7	-49.2	177	-178.4	-91.2	0	0	0	112	R283 V287 E377 L383 I384 Q385	R283-F381 HydrophobicContact CB-CZ 4.5Å; V287-F381 HydrophobicContact CG2-CD1 4.01Å; V287-F381 HydrophobicContact CG2-CE1 3.52Å; V287-F381 HydrophobicContact CG2-CZ 4.33Å; E377-F381 WeakPolarHBondContact O-CB 3.44Å; E377-F381 PolarHBondContact O-N 3.26Å; F381-L383 VanDerWaalsContact C-N 3.28Å; F381-L383 PolarHBondContact O-N 3.29Å; F381-I384 PolarHBondContact O-N 3.24Å; F381-Q385 WeakPolarHBondContact O-CB 3.43Å; F381-Q385 PolarHBondContact O-N 3.43Å
382	K	82.5	Confident	81.2	Confident	110 Å²	110	91.8 Å²	91.8	48%	0.478	41%	0.413	S	S	.	.	H	α-helix	trans	-58.5	-40.2	176.2	-76.9	176.9	-179.2	-179.9	0	111.7	N378 S379 Q385 R386	N378-K382 WeakPolarHBondContact O-CB 3.46Å; N378-K382 VanDerWaalsContact O-CG 3.29Å; N378-K382 WeakPolarHBondContact O-CG 3.41Å; N378-K382 PolarHBondContact O-N 2.96Å; S379-K382 PolarHBondContact O-N 3.16Å; K382-Q385 PolarHBondContact O-N 3.38Å; K382-R386 WeakPolarHBondContact O-CB 3.38Å; K382-R386 VanDerWaalsContact O-CG 3.28Å; K382-R386 WeakPolarHBondContact O-CG 3.12Å; K382-R386 PolarHBondContact O-N 3.42Å
383	L	82.4	Confident	81.4	Confident	84 Å²	84	89.4 Å²	89.4	44%	0.44	41%	0.41	S	S	.	.	H	α-helix	trans	-67.3	-43.3	178.2	-172.3	142.7	0	0	0	112.1	S379 R380 F381 Q385 R386 R387	S379-L383 WeakPolarHBondContact O-CB 3.26Å; S379-L383 PolarHBondContact O-N 3.02Å; R380-L383 PolarHBondContact O-N 3.04Å; F381-L383 VanDerWaalsContact C-N 3.28Å; F381-L383 PolarHBondContact O-N 3.29Å; L383-Q385 VanDerWaalsContact C-N 3.34Å; L383-Q385 PolarHBondContact O-N 2.63Å; L383-R386 PolarHBondContact O-N 2.92Å; L383-R387 VanDerWaalsContact CD2-CZ 3.45Å; L383-R387 WeakPolarHBondContact O-CG 3.31Å; L383-R387 PolarHBondContact O-N 2.92Å
384	I	81.1	Confident	81.6	Confident	85 Å²	85	84.3 Å²	84.3	44%	0.436	39%	0.388	S	S	.	.	H	α-helix	trans	-61.2	-43.8	173.7	-68.2	165.1	0	0	0	110.6	R380 F381 R387 Q388	R380-I384 VanDerWaalsContact O-CG1 3.31Å; R380-I384 WeakPolarHBondContact O-CG1 3.35Å; R380-I384 PolarHBondContact O-N 2.76Å; F381-I384 PolarHBondContact O-N 3.24Å; I384-R387 WeakPolarHBondContact O-CB 3.37Å; I384-R387 PolarHBondContact O-N 3.37Å; I384-Q388 HydrophobicContact CG2-CG 4.49Å; I384-Q388 WeakPolarHBondContact O-CG 3.17Å; I384-Q388 PolarHBondContact O-N 3.14Å
385	Q	81	Confident	81.8	Confident	18 Å²	18	81.3 Å²	81.3	8%	0.084	37%	0.374	C	S	.	.	H	α-helix	trans	-64.7	-40.7	179	-174.6	172	16.4	0	0	112.5	F381 K382 L383 Q388 T389	F381-Q385 WeakPolarHBondContact O-CB 3.43Å; F381-Q385 PolarHBondContact O-N 3.43Å; K382-Q385 PolarHBondContact O-N 3.38Å; L383-Q385 VanDerWaalsContact C-N 3.34Å; L383-Q385 PolarHBondContact O-N 2.63Å; Q385-Q388 PolarHBondContact O-N 2.96Å; Q385-T389 WeakPolarHBondContact O-CB 3.15Å; Q385-T389 PolarHBondContact O-N 3.38Å; Q385-T389 PolarHBondContact O-OG1 3.46Å
386	R	81.5	Confident	82	Confident	179 Å²	179	76.1 Å²	76.1	68%	0.675	36%	0.358	S	S	*	.	H	α-helix	trans	-60.5	-45.2	173.4	-76.4	173.8	177.9	-176.8	-0.9	111.3	K382 L383 T389 R390	K382-R386 WeakPolarHBondContact O-CB 3.38Å; K382-R386 VanDerWaalsContact O-CG 3.28Å; K382-R386 WeakPolarHBondContact O-CG 3.12Å; K382-R386 PolarHBondContact O-N 3.42Å; L383-R386 PolarHBondContact O-N 2.92Å; R386-T389 PolarHBondContact O-N 3.17Å; R386-R390 WeakPolarHBondContact O-CG 3.44Å; R386-R390 PolarHBondContact O-N 3.07Å
387	R	81.7	Confident	82.2	Confident	143 Å²	143	75.4 Å²	75.4	54%	0.54	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-46.8	175	-72.5	177.1	176.7	178.1	0.6	111.6	L383 I384 T389 R390 T391	L383-R387 VanDerWaalsContact CD2-CZ 3.45Å; L383-R387 WeakPolarHBondContact O-CG 3.31Å; L383-R387 PolarHBondContact O-N 2.92Å; I384-R387 WeakPolarHBondContact O-CB 3.37Å; I384-R387 PolarHBondContact O-N 3.37Å; R387-T389 VanDerWaalsContact C-N 3.35Å; R387-T389 PolarHBondContact O-N 3.12Å; R387-R390 PolarHBondContact O-N 3.01Å; R387-T391 PolarHBondContact O-N 2.9Å; R387-T391 PolarHBondContact O-OG1 2.66Å; R387-T391 VanDerWaalsContact O-OG1 3.07Å
388	Q	81.4	Confident	82.4	Confident	47 Å²	47	69.5 Å²	69.5	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-60.3	-44.1	176.9	-73.7	176.3	-5.1	0	0	112.1	I384 Q385 T391 N392	I384-Q388 HydrophobicContact CG2-CG 4.49Å; I384-Q388 WeakPolarHBondContact O-CG 3.17Å; I384-Q388 PolarHBondContact O-N 3.14Å; Q385-Q388 PolarHBondContact O-N 2.96Å; Q388-T391 PolarHBondContact O-N 3.21Å; Q388-N392 WeakPolarHBondContact O-CB 3.39Å; Q388-N392 PolarHBondContact O-N 2.92Å; Q388-N392 PolarHBondContact O-ND2 3.26Å
389	T	82.7	Confident	82.6	Confident	50 Å²	50	67 Å²	67	31%	0.307	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-50.9	179	-53.2	0	0	0	0	110.5	Q385 R386 R387 T391 N392 T393	Q385-T389 WeakPolarHBondContact O-CB 3.15Å; Q385-T389 PolarHBondContact O-N 3.38Å; Q385-T389 PolarHBondContact O-OG1 3.46Å; R386-T389 PolarHBondContact O-N 3.17Å; R387-T389 VanDerWaalsContact C-N 3.35Å; R387-T389 PolarHBondContact O-N 3.12Å; T389-T391 PolarHBondContact O-N 3.46Å; T389-N392 PolarHBondContact O-N 3.28Å; T389-N392 VanDerWaalsContact O-N 3.13Å; T389-T393 PolarHBondContact O-N 2.87Å; T389-T393 PolarHBondContact O-OG1 2.71Å
390	R	82.7	Confident	82.9	Confident	141 Å²	141	68.8 Å²	68.8	53%	0.532	32%	0.322	S	S	.	.	H	α-helix	trans	-55.2	-49.5	176.9	-74.2	179.5	174.7	-176.6	-4.3	112.4	R386 R387 N392 T393 L394 E512	R386-R390 WeakPolarHBondContact O-CG 3.44Å; R386-R390 PolarHBondContact O-N 3.07Å; R387-R390 PolarHBondContact O-N 3.01Å; R390-N392 VanDerWaalsContact C-N 3.3Å; R390-N392 PolarHBondContact O-N 3.33Å; R390-T393 PolarHBondContact O-N 3.44Å; R390-L394 WeakPolarHBondContact O-CB 3.32Å; R390-L394 PolarHBondContact O-N 3.39Å; R390-E512 IonicContact NH1-OE1 3.45Å; R390-E512 PolarHBondContact NH1-OE1 2.98Å
391	T	79.4	Confident	83.3	Confident	22 Å²	22	62.7 Å²	62.7	14%	0.135	30%	0.302	C	S	.	.	H	α-helix	trans	-68.9	-27.7	-179.5	-51.4	0	0	0	0	112.4	R183 R387 Q388 T389 L394 L395	R183-T391 VanDerWaalsContact CZ-CG2 3.47Å; R387-T391 PolarHBondContact O-N 2.9Å; R387-T391 PolarHBondContact O-OG1 2.66Å; R387-T391 VanDerWaalsContact O-OG1 3.07Å; Q388-T391 PolarHBondContact O-N 3.21Å; T389-T391 PolarHBondContact O-N 3.46Å; T391-L394 WeakPolarHBondContact O-CB 3.44Å; T391-L395 HydrophobicContact CG2-CD1 4.37Å; T391-L395 VanDerWaalsContact O-CG 3.24Å; T391-L395 WeakPolarHBondContact O-CG 3.35Å; T391-L395 PolarHBondContact O-N 2.96Å; T391-L395 VanDerWaalsContact O-N 3.15Å
392	N	83	Confident	83.6	Confident	9 Å²	9	59.3 Å²	59.3	5%	0.048	29%	0.287	C	S	.	.	H	α-helix	trans	-78.3	-37.2	173.8	-66.9	-18.4	0	0	0	112.6	R183 I187 I276 I280 Q388 T389 R390 L394 L395 A396	R183-N392 PolarHBondContact NE-OD1 2.64Å; R183-N392 PolarHBondContact NH2-OD1 3.29Å; I187-N392 WeakPolarHBondContact CD1-ND2 3.35Å; I187-N392 WeakPolarHBondContact CD1-OD1 3.29Å; I276-N392 HydrophobicContact CG2-CB 4.36Å; I276-N392 WeakPolarHBondContact CG2-ND2 3.24Å; I280-N392 WeakPolarHBondContact CD1-ND2 3.31Å; Q388-N392 WeakPolarHBondContact O-CB 3.39Å; Q388-N392 PolarHBondContact O-N 2.92Å; Q388-N392 PolarHBondContact O-ND2 3.26Å; T389-N392 PolarHBondContact O-N 3.28Å; T389-N392 VanDerWaalsContact O-N 3.13Å; R390-N392 VanDerWaalsContact C-N 3.3Å; R390-N392 PolarHBondContact O-N 3.33Å; N392-L394 VanDerWaalsContact C-N 3.28Å; N392-L394 PolarHBondContact O-N 3.07Å; N392-L395 PolarHBondContact O-N 2.91Å; N392-A396 WeakPolarHBondContact O-CB 3.46Å; N392-A396 PolarHBondContact O-N 3.46Å
393	T	84.4	Confident	83.9	Confident	78 Å²	78	55 Å²	55	48%	0.479	27%	0.27	S	S	.	.	H	α-helix	trans	-57.4	-45.9	170.3	-58.3	0	0	0	0	109.8	T389 R390 L395 A396 S397	T389-T393 PolarHBondContact O-N 2.87Å; T389-T393 PolarHBondContact O-OG1 2.71Å; R390-T393 PolarHBondContact O-N 3.44Å; T393-L395 PolarHBondContact O-N 2.72Å; T393-A396 PolarHBondContact O-N 3.08Å; T393-S397 PolarHBondContact O-N 3.4Å; T393-S397 PolarHBondContact O-OG 2.95Å
394	L	81.3	Confident	84.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-51.4	-55.4	171.7	166.4	56.4	0	0	0	113	R390 T391 N392 A396 S397 I398 L506 L510 N511	R390-L394 WeakPolarHBondContact O-CB 3.32Å; R390-L394 PolarHBondContact O-N 3.39Å; T391-L394 WeakPolarHBondContact O-CB 3.44Å; N392-L394 VanDerWaalsContact C-N 3.28Å; N392-L394 PolarHBondContact O-N 3.07Å; L394-A396 VanDerWaalsContact C-N 3.31Å; L394-A396 PolarHBondContact O-N 3.01Å; L394-S397 WeakPolarHBondContact O-CB 3.26Å; L394-S397 PolarHBondContact O-N 3.25Å; L394-S397 VanDerWaalsContact O-N 3.14Å; L394-I398 HydrophobicContact CD1-CD1 3.59Å; L394-I398 HydrophobicContact CD1-CG1 4.01Å; L394-I398 HydrophobicContact CG-CD1 4.04Å; L394-I398 PolarHBondContact O-N 2.72Å; L394-L506 VanDerWaalsContact CD1-C 3.43Å; L394-L506 HydrophobicContact CD1-CB 3.51Å; L394-L506 HydrophobicContact CD1-CD2 4.3Å; L394-L506 HydrophobicContact CD1-CG 4.44Å; L394-L506 WeakPolarHBondContact CD1-O 3.46Å; L394-L510 HydrophobicContact CB-CB 3.57Å; L394-L510 HydrophobicContact CB-CD1 3.68Å; L394-L510 HydrophobicContact CB-CG 4.25Å; L394-L510 HydrophobicContact CD1-CB 3.84Å; L394-L510 HydrophobicContact CD1-CD1 3.76Å; L394-L510 HydrophobicContact CD1-CG 4.28Å; L394-L510 HydrophobicContact CD2-CB 3.76Å; L394-L510 HydrophobicContact CG-CB 3.88Å; L394-L510 HydrophobicContact CG-CD1 4.27Å; L394-N511 HydrophobicContact CD2-CB 3.88Å
395	L	80.8	Confident	85	Confident	8 Å²	8	52 Å²	52	4%	0.042	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-35.2	-173.9	-68.8	173	0	0	0	111.6	I179 R183 Y273 T391 N392 T393 I398 T399	I179-L395 HydrophobicContact CG2-CD1 3.88Å; I179-L395 HydrophobicContact CG2-CD2 3.54Å; I179-L395 HydrophobicContact CG2-CG 4.25Å; R183-L395 HydrophobicContact CG-CD1 3.47Å; R183-L395 VanDerWaalsContact CG-CD1 3.47Å; Y273-L395 HydrophobicContact CE1-CB 4.28Å; Y273-L395 WeakPolarHBondContact OH-CB 3.45Å; Y273-L395 PolarHBondContact OH-O 2.92Å; T391-L395 HydrophobicContact CG2-CD1 4.37Å; T391-L395 VanDerWaalsContact O-CG 3.24Å; T391-L395 WeakPolarHBondContact O-CG 3.35Å; T391-L395 PolarHBondContact O-N 2.96Å; T391-L395 VanDerWaalsContact O-N 3.15Å; N392-L395 PolarHBondContact O-N 2.91Å; T393-L395 PolarHBondContact O-N 2.72Å; L395-I398 HydrophobicContact CD2-CD1 4.16Å; L395-I398 PolarHBondContact O-N 3.33Å; L395-T399 PolarHBondContact O-N 2.74Å; L395-T399 PolarHBondContact O-OG1 3.04Å
396	A	85.2	Confident	85.6	Confident	36 Å²	36	51.3 Å²	51.3	30%	0.298	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-42.5	171.1	0	0	0	0	0	111.3	Y273 N392 T393 L394 T399 L400	Y273-A396 HydrophobicContact CD1-CB 4.26Å; Y273-A396 HydrophobicContact CD2-CB 4.34Å; Y273-A396 HydrophobicContact CE1-CB 4.16Å; Y273-A396 HydrophobicContact CE2-CB 4.19Å; Y273-A396 HydrophobicContact CG-CB 4.4Å; Y273-A396 PolarHBondContact OH-N 2.92Å; N392-A396 WeakPolarHBondContact O-CB 3.46Å; N392-A396 PolarHBondContact O-N 3.46Å; T393-A396 PolarHBondContact O-N 3.08Å; L394-A396 VanDerWaalsContact C-N 3.31Å; L394-A396 PolarHBondContact O-N 3.01Å; A396-T399 PolarHBondContact O-N 3.11Å; A396-L400 WeakPolarHBondContact O-CB 3.34Å; A396-L400 PolarHBondContact O-N 3.31Å
397	S	86.5	Confident	86.1	Confident	49 Å²	49	45.2 Å²	45.2	34%	0.343	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-44.4	174.4	-60.6	0	0	0	0	112.6	T393 L394 T399 L400 L401	T393-S397 PolarHBondContact O-N 3.4Å; T393-S397 PolarHBondContact O-OG 2.95Å; L394-S397 WeakPolarHBondContact O-CB 3.26Å; L394-S397 PolarHBondContact O-N 3.25Å; L394-S397 VanDerWaalsContact O-N 3.14Å; S397-T399 VanDerWaalsContact C-N 3.3Å; S397-T399 PolarHBondContact O-N 3.19Å; S397-L400 PolarHBondContact O-N 2.92Å; S397-L401 VanDerWaalsContact O-CB 3.25Å; S397-L401 WeakPolarHBondContact O-CB 3.39Å; S397-L401 PolarHBondContact O-N 2.95Å
398	I	85	Confident	86.8	Confident	4 Å²	4	40 Å²	40	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-45.8	175.1	-71.4	166.9	0	0	0	110.3	L394 L395 L401 F402 L506 Y507	L394-I398 HydrophobicContact CD1-CD1 3.59Å; L394-I398 HydrophobicContact CD1-CG1 4.01Å; L394-I398 HydrophobicContact CG-CD1 4.04Å; L394-I398 PolarHBondContact O-N 2.72Å; L395-I398 HydrophobicContact CD2-CD1 4.16Å; L395-I398 PolarHBondContact O-N 3.33Å; I398-L401 PolarHBondContact O-N 3.3Å; I398-F402 WeakPolarHBondContact O-CB 3.46Å; I398-F402 PolarHBondContact O-N 3.37Å; I398-L506 HydrophobicContact CB-CD1 4.42Å; I398-L506 HydrophobicContact CD1-CB 4.18Å; I398-L506 HydrophobicContact CG1-CB 3.92Å; I398-L506 HydrophobicContact CG1-CD1 3.5Å; I398-L506 HydrophobicContact CG1-CG 4.3Å; I398-Y507 HydrophobicContact CD1-CD1 4.01Å; I398-Y507 HydrophobicContact CD1-CE1 3.41Å; I398-Y507 VanDerWaalsContact CD1-CE1 3.41Å
399	T	84.1	Confident	87.4	Confident	14 Å²	14	38 Å²	38	9%	0.086	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-50.2	-179.7	-52.3	0	0	0	0	110.9	I176 V269 Y273 L395 A396 S397 L401 F402 V403	I176-T399 HydrophobicContact CG2-CG2 3.88Å; V269-T399 HydrophobicContact CB-CG2 3.99Å; V269-T399 HydrophobicContact CG1-CG2 3.31Å; V269-T399 HydrophobicContact CG2-CG2 4.3Å; Y273-T399 HydrophobicContact CE2-CG2 4.35Å; Y273-T399 WeakPolarHBondContact CE2-OG1 3.33Å; Y273-T399 PolarHBondContact OH-OG1 2.86Å; L395-T399 PolarHBondContact O-N 2.74Å; L395-T399 PolarHBondContact O-OG1 3.04Å; A396-T399 PolarHBondContact O-N 3.11Å; S397-T399 VanDerWaalsContact C-N 3.3Å; S397-T399 PolarHBondContact O-N 3.19Å; T399-L401 VanDerWaalsContact C-N 3.28Å; T399-L401 PolarHBondContact O-N 2.97Å; T399-F402 PolarHBondContact O-N 3.39Å; T399-V403 WeakPolarHBondContact O-CG2 3.03Å; T399-V403 PolarHBondContact O-N 2.91Å
400	L	88.2	Confident	87.8	Confident	107 Å²	107	36.4 Å²	36.4	56%	0.56	20%	0.198	S	C	*	.	H	α-helix	trans	-60.2	-42.7	-179.7	-179.2	63.5	0	0	0	110.8	A396 S397 V403 L404	A396-L400 WeakPolarHBondContact O-CB 3.34Å; A396-L400 PolarHBondContact O-N 3.31Å; S397-L400 PolarHBondContact O-N 2.92Å; L400-V403 PolarHBondContact O-N 2.87Å; L400-L404 HydrophobicContact CD1-CD1 4.09Å; L400-L404 HydrophobicContact CD1-CG 4.25Å; L400-L404 HydrophobicContact CG-CD1 3.94Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 WeakPolarHBondContact O-CB 2.94Å; L400-L404 VanDerWaalsContact O-CG 3.28Å; L400-L404 WeakPolarHBondContact O-CG 3Å; L400-L404 PolarHBondContact O-N 3.42Å
401	L	91.4	Very high	88.3	Confident	47 Å²	47	34.3 Å²	34.3	25%	0.246	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-43.8	177	-176.8	67.3	0	0	0	111.8	S397 I398 T399 L404 A405 V498 A502 L506	S397-L401 VanDerWaalsContact O-CB 3.25Å; S397-L401 WeakPolarHBondContact O-CB 3.39Å; S397-L401 PolarHBondContact O-N 2.95Å; I398-L401 PolarHBondContact O-N 3.3Å; T399-L401 VanDerWaalsContact C-N 3.28Å; T399-L401 PolarHBondContact O-N 2.97Å; L401-L404 PolarHBondContact O-N 3.32Å; L401-A405 WeakPolarHBondContact O-CB 3.46Å; L401-A405 PolarHBondContact O-N 3.46Å; L401-V498 HydrophobicContact CD1-CG1 4.42Å; L401-A502 HydrophobicContact CD2-CB 3.12Å; L401-L506 HydrophobicContact CD2-CD1 4.13Å
402	F	89.6	Confident	89.1	Confident	14 Å²	14	34.3 Å²	34.3	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-59.2	-48.2	176	-177.9	-93.6	0	0	0	111.3	I169 S172 I176 I398 T399 L404 A405 W406	I169-F402 HydrophobicContact CG1-CZ 4.28Å; S172-F402 VanDerWaalsContact CB-CE2 3.43Å; I176-F402 HydrophobicContact CD1-CB 3.56Å; I176-F402 HydrophobicContact CD1-CD1 3.49Å; I176-F402 VanDerWaalsContact CD1-CD1 3.49Å; I176-F402 HydrophobicContact CD1-CD2 3.54Å; I176-F402 HydrophobicContact CD1-CE1 4.02Å; I176-F402 HydrophobicContact CD1-CE2 4.06Å; I176-F402 HydrophobicContact CD1-CG 3.22Å; I176-F402 HydrophobicContact CD1-CZ 4.27Å; I398-F402 WeakPolarHBondContact O-CB 3.46Å; I398-F402 PolarHBondContact O-N 3.37Å; T399-F402 PolarHBondContact O-N 3.39Å; F402-L404 VanDerWaalsContact C-N 3.34Å; F402-L404 PolarHBondContact O-N 2.87Å; F402-A405 PolarHBondContact O-N 3.28Å; F402-W406 AromaticContact CD2-CD1 3.55Å; F402-W406 AromaticContact CD2-NE1 3.44Å; F402-W406 AromaticContact CE2-CD1 3.48Å; F402-W406 VanDerWaalsContact CE2-CD1 3.48Å; F402-W406 AromaticContact CE2-CE2 3.79Å; F402-W406 HydrophobicContact CE2-CG 4.34Å; F402-W406 HydrophobicContact CE2-CZ2 4.41Å; F402-W406 AromaticContact CE2-NE1 3.11Å; F402-W406 AromaticContact CG-CD1 3.95Å; F402-W406 AromaticContact CZ-CD1 3.83Å; F402-W406 HydrophobicContact CZ-CG 4.3Å; F402-W406 AromaticContact CZ-NE1 3.75Å; F402-W406 VanDerWaalsContact O-CD1 3.23Å; F402-W406 PolarHBondContact O-N 2.78Å; F402-W406 VanDerWaalsContact O-N 3.11Å
403	V	88.8	Confident	89.6	Confident	18 Å²	18	36.9 Å²	36.9	11%	0.109	21%	0.208	C	C	.	.	H	α-helix	trans	-58.1	-46.3	177.8	171.4	0	0	0	0	111.2	Y262 L266 T399 L400 L407	Y262-V403 HydrophobicContact CE2-CB 4.49Å; Y262-V403 HydrophobicContact CE2-CG1 3.54Å; Y262-V403 WeakPolarHBondContact OH-CG1 3.42Å; L266-V403 HydrophobicContact CD1-CG1 4.23Å; L266-V403 HydrophobicContact CD1-CG2 4.27Å; T399-V403 WeakPolarHBondContact O-CG2 3.03Å; T399-V403 PolarHBondContact O-N 2.91Å; L400-V403 PolarHBondContact O-N 2.87Å; V403-L407 WeakPolarHBondContact O-CB 3.36Å; V403-L407 PolarHBondContact O-N 3.47Å
404	L	92.5	Very high	89.9	Confident	99 Å²	99	34.8 Å²	34.8	52%	0.518	20%	0.198	S	C	.	.	H	α-helix	trans	-71.6	-35.4	-179.5	-67.3	175.1	0	0	0	113.1	L400 L401 F402 P408	L400-L404 HydrophobicContact CD1-CD1 4.09Å; L400-L404 HydrophobicContact CD1-CG 4.25Å; L400-L404 HydrophobicContact CG-CD1 3.94Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 WeakPolarHBondContact O-CB 2.94Å; L400-L404 VanDerWaalsContact O-CG 3.28Å; L400-L404 WeakPolarHBondContact O-CG 3Å; L400-L404 PolarHBondContact O-N 3.42Å; L401-L404 PolarHBondContact O-N 3.32Å; F402-L404 VanDerWaalsContact C-N 3.34Å; F402-L404 PolarHBondContact O-N 2.87Å; L404-P408 VanDerWaalsContact O-CD 3.24Å; L404-P408 WeakPolarHBondContact O-CD 3.19Å
405	A	94.2	Very high	90.4	Very high	7 Å²	7	38.4 Å²	38.4	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-69.1	-36.4	-178.8	0	0	0	0	0	112.9	L401 F402 C495 V496	L401-A405 WeakPolarHBondContact O-CB 3.46Å; L401-A405 PolarHBondContact O-N 3.46Å; F402-A405 PolarHBondContact O-N 3.28Å; A405-C495 VanDerWaalsContact CB-O 3.26Å; A405-C495 WeakPolarHBondContact CB-O 3.08Å; A405-C495 CarbonylContact O-C 2.94Å; A405-C495 VanDerWaalsContact O-CB 3.24Å; A405-C495 WeakPolarHBondContact O-CB 3.29Å; A405-V496 PolarHBondContact O-N 2.88Å
406	W	93.2	Very high	90.9	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-90.7	-20.9	-177.7	-73.9	83.8	0	0	0	113.6	L132 I169 F402 L409 H410 V496 S499	L132-W406 HydrophobicContact CD2-CZ2 4.35Å; I169-W406 HydrophobicContact CB-CE3 4.08Å; I169-W406 HydrophobicContact CB-CH2 3.67Å; I169-W406 HydrophobicContact CB-CZ2 4.25Å; I169-W406 HydrophobicContact CB-CZ3 3.59Å; I169-W406 HydrophobicContact CD1-CD2 3.81Å; I169-W406 HydrophobicContact CD1-CE3 3.23Å; I169-W406 HydrophobicContact CD1-CG 4.41Å; I169-W406 HydrophobicContact CD1-CH2 4.44Å; I169-W406 HydrophobicContact CD1-CZ3 3.61Å; I169-W406 HydrophobicContact CG1-CD2 3.99Å; I169-W406 HydrophobicContact CG1-CE3 3.71Å; I169-W406 HydrophobicContact CG1-CH2 4.12Å; I169-W406 HydrophobicContact CG1-CZ2 4.4Å; I169-W406 HydrophobicContact CG1-CZ3 3.79Å; I169-W406 HydrophobicContact CG2-CZ3 4.45Å; F402-W406 AromaticContact CD2-CD1 3.55Å; F402-W406 AromaticContact CD2-NE1 3.44Å; F402-W406 AromaticContact CE2-CD1 3.48Å; F402-W406 VanDerWaalsContact CE2-CD1 3.48Å; F402-W406 AromaticContact CE2-CE2 3.79Å; F402-W406 HydrophobicContact CE2-CG 4.34Å; F402-W406 HydrophobicContact CE2-CZ2 4.41Å; F402-W406 AromaticContact CE2-NE1 3.11Å; F402-W406 AromaticContact CG-CD1 3.95Å; F402-W406 AromaticContact CZ-CD1 3.83Å; F402-W406 HydrophobicContact CZ-CG 4.3Å; F402-W406 AromaticContact CZ-NE1 3.75Å; F402-W406 VanDerWaalsContact O-CD1 3.23Å; F402-W406 PolarHBondContact O-N 2.78Å; F402-W406 VanDerWaalsContact O-N 3.11Å; W406-L409 HydrophobicContact CE3-CD2 4.12Å; W406-L409 HydrophobicContact CZ3-CD2 4.08Å; W406-L409 PolarHBondContact O-N 2.92Å; W406-H410 PolarHBondContact O-CD2 2.93Å; W406-H410 VanDerWaalsContact O-CD2 3.27Å; W406-H410 PolarHBondContact O-N 2.92Å; W406-V496 HydrophobicContact CD2-CB 4.48Å; W406-V496 HydrophobicContact CD2-CG1 4.15Å; W406-V496 HydrophobicContact CD2-CG2 3.72Å; W406-V496 HydrophobicContact CE3-CG1 4.22Å; W406-V496 HydrophobicContact CE3-CG2 3.61Å; W406-V496 HydrophobicContact CG-CG2 4.23Å; W406-V496 HydrophobicContact CH2-CG1 3.55Å; W406-V496 HydrophobicContact CH2-CG2 4.43Å; W406-V496 HydrophobicContact CZ2-CG1 3.42Å; W406-V496 VanDerWaalsContact CZ2-CG1 3.42Å; W406-V496 HydrophobicContact CZ3-CG1 3.94Å; W406-V496 HydrophobicContact CZ3-CG2 3.98Å; W406-S499 PolarHBondContact NE1-OG 3.45Å
407	L	92.9	Very high	91.1	Very high	51 Å²	51	39.6 Å²	39.6	27%	0.267	22%	0.22	S	C	.	.	H	α-helix	trans	-53.7	-46.4	-179.5	175.8	63.8	0	0	0	114	Y262 V403 L409 H410 I411	Y262-L407 HydrophobicContact CE1-CD1 4.28Å; Y262-L407 HydrophobicContact CE2-CB 4.02Å; Y262-L407 HydrophobicContact CE2-CD1 3.96Å; V403-L407 WeakPolarHBondContact O-CB 3.36Å; V403-L407 PolarHBondContact O-N 3.47Å; L407-L409 VanDerWaalsContact C-N 3.28Å; L407-L409 PolarHBondContact O-N 3.01Å; L407-H410 PolarHBondContact O-N 3.16Å; L407-I411 HydrophobicContact CD1-CD1 3.76Å; L407-I411 HydrophobicContact CD1-CG1 3.97Å; L407-I411 HydrophobicContact CD2-CD1 4.44Å; L407-I411 HydrophobicContact CG-CD1 3.8Å; L407-I411 HydrophobicContact CG-CG1 4.41Å; L407-I411 WeakPolarHBondContact O-CG1 3.5Å; L407-I411 PolarHBondContact O-N 2.89Å
408	P	95	Very high	91.2	Very high	33 Å²	33	41.5 Å²	41.5	21%	0.214	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-39.9	179.4	-26.4	35.6	0	0	0	113.1	L404 I411 F412 C492 C495	L404-P408 VanDerWaalsContact O-CD 3.24Å; L404-P408 WeakPolarHBondContact O-CD 3.19Å; P408-I411 PolarHBondContact O-N 3.05Å; P408-F412 VanDerWaalsContact O-CB 3.28Å; P408-F412 WeakPolarHBondContact O-CB 3.38Å; P408-F412 PolarHBondContact O-N 3.37Å; P408-C492 HydrophobicContact CB-CB 4.26Å; P408-C495 HydrophobicContact CG-CB 4.35Å
409	L	93.9	Very high	91.2	Very high	7 Å²	7	45.2 Å²	45.2	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-40.4	179.1	-177.8	65.1	0	0	0	111.9	W406 L407 F412 N413 C492 L493 V496	W406-L409 HydrophobicContact CE3-CD2 4.12Å; W406-L409 HydrophobicContact CZ3-CD2 4.08Å; W406-L409 PolarHBondContact O-N 2.92Å; L407-L409 VanDerWaalsContact C-N 3.28Å; L407-L409 PolarHBondContact O-N 3.01Å; L409-F412 PolarHBondContact O-N 3.49Å; L409-N413 WeakPolarHBondContact O-CB 3.47Å; L409-N413 VanDerWaalsContact O-CG 3.26Å; L409-N413 PolarHBondContact O-N 2.71Å; L409-N413 PolarHBondContact O-ND2 3.37Å; L409-C492 HydrophobicContact CB-CB 4.12Å; L409-C492 HydrophobicContact CD1-CB 4.17Å; L409-L493 HydrophobicContact CD1-CD2 4.02Å; L409-L493 HydrophobicContact CD2-CD2 4.02Å; L409-V496 HydrophobicContact CB-CG2 4.28Å; L409-V496 HydrophobicContact CD2-CG2 3.96Å
410	H	92.4	Very high	91.2	Very high	16 Å²	16	46.2 Å²	46.2	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-45.6	175	-77.3	-69.5	0	0	0	112.2	I169 I258 Q261 W406 L407 N413 A414	I169-H410 VanDerWaalsContact CD1-NE2 3.31Å; I169-H410 WeakPolarHBondContact CD1-NE2 3.21Å; I258-H410 HydrophobicContact CG1-CB 4.47Å; Q261-H410 PolarHBondContact OE1-CE1 3.28Å; Q261-H410 VanDerWaalsContact OE1-CE1 3.26Å; W406-H410 PolarHBondContact O-CD2 2.93Å; W406-H410 VanDerWaalsContact O-CD2 3.27Å; W406-H410 PolarHBondContact O-N 2.92Å; L407-H410 PolarHBondContact O-N 3.16Å; H410-N413 PolarHBondContact O-N 2.84Å; H410-A414 WeakPolarHBondContact O-CB 3.31Å; H410-A414 PolarHBondContact O-N 3.3Å
411	I	93.5	Very high	91	Very high	96 Å²	96	41.8 Å²	41.8	49%	0.492	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-47.5	177.1	-66	170.3	0	0	0	109.9	L407 P408 N413 A414 V415	L407-I411 HydrophobicContact CD1-CD1 3.76Å; L407-I411 HydrophobicContact CD1-CG1 3.97Å; L407-I411 HydrophobicContact CD2-CD1 4.44Å; L407-I411 HydrophobicContact CG-CD1 3.8Å; L407-I411 HydrophobicContact CG-CG1 4.41Å; L407-I411 WeakPolarHBondContact O-CG1 3.5Å; L407-I411 PolarHBondContact O-N 2.89Å; P408-I411 PolarHBondContact O-N 3.05Å; I411-N413 PolarHBondContact O-N 3.35Å; I411-A414 PolarHBondContact O-N 3.38Å; I411-V415 HydrophobicContact CG2-CG2 4.25Å; I411-V415 WeakPolarHBondContact O-CB 3.37Å; I411-V415 VanDerWaalsContact O-CG2 3.29Å; I411-V415 WeakPolarHBondContact O-CG2 3.49Å; I411-V415 PolarHBondContact O-N 2.71Å
412	F	94.5	Very high	90.5	Very high	22 Å²	22	45.9 Å²	45.9	10%	0.096	23%	0.232	C	C	.	.	H	α-helix	trans	-56.8	-49.5	178.5	176	-96.2	0	0	0	111.6	P408 L409 A414 V415 M416 I485 I488 H489	P408-F412 VanDerWaalsContact O-CB 3.28Å; P408-F412 WeakPolarHBondContact O-CB 3.38Å; P408-F412 PolarHBondContact O-N 3.37Å; L409-F412 PolarHBondContact O-N 3.49Å; F412-A414 PolarHBondContact O-N 2.99Å; F412-V415 PolarHBondContact O-N 3.41Å; F412-M416 HydrophobicContact CD1-CG 4.21Å; F412-M416 HydrophobicContact CD2-CG 4.23Å; F412-M416 HydrophobicContact CE1-CG 3.81Å; F412-M416 HydrophobicContact CE2-CG 3.85Å; F412-M416 HydrophobicContact CE2-SD 4.18Å; F412-M416 HydrophobicContact CG-CG 4.41Å; F412-M416 HydrophobicContact CZ-CG 3.61Å; F412-M416 HydrophobicContact CZ-SD 4.17Å; F412-M416 WeakPolarHBondContact O-CB 3.45Å; F412-M416 VanDerWaalsContact O-CG 3.23Å; F412-M416 WeakPolarHBondContact O-CG 3.35Å; F412-M416 PolarHBondContact O-N 3.15Å; F412-I485 HydrophobicContact CE2-CG2 4.2Å; F412-I485 HydrophobicContact CZ-CG2 3.94Å; F412-I488 HydrophobicContact CD2-CG2 3.68Å; F412-I488 HydrophobicContact CE2-CB 4.44Å; F412-I488 HydrophobicContact CE2-CG2 4.02Å; F412-H489 HydrophobicContact CE1-CB 3.83Å; F412-H489 AromaticContact CE1-CD2 3.9Å; F412-H489 AromaticContact CE1-CE1 3.81Å; F412-H489 AromaticContact CE1-CG 3.48Å; F412-H489 VanDerWaalsContact CE1-CG 3.48Å; F412-H489 AromaticContact CE1-ND1 3.45Å; F412-H489 WeakPolarHBondContact CE1-ND1 3.48Å; F412-H489 HydrophobicContact CE2-CB 4.1Å; F412-H489 HydrophobicContact CZ-CB 3.56Å; F412-H489 AromaticContact CZ-CG 3.73Å; F412-H489 AromaticContact CZ-ND1 3.76Å
413	N	93.4	Very high	89.8	Confident	64 Å²	64	49.5 Å²	49.5	34%	0.342	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-45.8	179.1	-70.7	-17.8	0	0	0	111.9	L409 H410 I411 V415 M416 D417	L409-N413 WeakPolarHBondContact O-CB 3.47Å; L409-N413 VanDerWaalsContact O-CG 3.26Å; L409-N413 PolarHBondContact O-N 2.71Å; L409-N413 PolarHBondContact O-ND2 3.37Å; H410-N413 PolarHBondContact O-N 2.84Å; I411-N413 PolarHBondContact O-N 3.35Å; N413-V415 PolarHBondContact O-N 3.02Å; N413-M416 PolarHBondContact O-N 2.03Å; N413-D417 WeakPolarHBondContact O-CB 3.47Å; N413-D417 PolarHBondContact O-N 3.44Å
414	A	91.9	Very high	89.2	Confident	33 Å²	33	51 Å²	51	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-43	178.3	0	0	0	0	0	112.5	I258 H410 I411 F412 Q418	I258-A414 HydrophobicContact CD1-CB 4.1Å; H410-A414 WeakPolarHBondContact O-CB 3.31Å; H410-A414 PolarHBondContact O-N 3.3Å; I411-A414 PolarHBondContact O-N 3.38Å; F412-A414 PolarHBondContact O-N 2.99Å; A414-Q418 WeakPolarHBondContact O-CB 3.26Å; A414-Q418 PolarHBondContact O-N 3.44Å
415	V	92.1	Very high	88.2	Confident	77 Å²	77	52.5 Å²	52.5	47%	0.467	26%	0.26	S	S	.	.	H	α-helix	trans	-65.4	-41.3	176.6	170.4	0	0	0	0	111	I411 F412 N413 Q418 R419	I411-V415 HydrophobicContact CG2-CG2 4.25Å; I411-V415 WeakPolarHBondContact O-CB 3.37Å; I411-V415 VanDerWaalsContact O-CG2 3.29Å; I411-V415 WeakPolarHBondContact O-CG2 3.49Å; I411-V415 PolarHBondContact O-N 2.71Å; F412-V415 PolarHBondContact O-N 3.41Å; N413-V415 PolarHBondContact O-N 3.02Å; V415-Q418 PolarHBondContact O-N 3.31Å; V415-R419 VanDerWaalsContact O-CB 3.28Å; V415-R419 WeakPolarHBondContact O-CB 3.38Å; V415-R419 PolarHBondContact O-N 2.88Å
416	M	91	Very high	86.4	Confident	48 Å²	48	58.8 Å²	58.8	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-42	179.1	-72.1	-56.8	-62.5	0	0	112.2	F412 N413 R419 E420 I485	F412-M416 HydrophobicContact CD1-CG 4.21Å; F412-M416 HydrophobicContact CD2-CG 4.23Å; F412-M416 HydrophobicContact CE1-CG 3.81Å; F412-M416 HydrophobicContact CE2-CG 3.85Å; F412-M416 HydrophobicContact CE2-SD 4.18Å; F412-M416 HydrophobicContact CG-CG 4.41Å; F412-M416 HydrophobicContact CZ-CG 3.61Å; F412-M416 HydrophobicContact CZ-SD 4.17Å; F412-M416 WeakPolarHBondContact O-CB 3.45Å; F412-M416 VanDerWaalsContact O-CG 3.23Å; F412-M416 WeakPolarHBondContact O-CG 3.35Å; F412-M416 PolarHBondContact O-N 3.15Å; N413-M416 PolarHBondContact O-N 2.03Å; M416-R419 PolarHBondContact O-N 3.37Å; M416-E420 WeakPolarHBondContact O-CB 3.37Å; M416-E420 PolarHBondContact O-N 3.35Å; M416-I485 HydrophobicContact CE-CD1 4.27Å; M416-I485 HydrophobicContact CE-CG2 4.22Å; M416-I485 HydrophobicContact SD-CG2 4.41Å
417	D	90.1	Very high	84.2	Confident	21 Å²	21	63.3 Å²	63.3	11%	0.112	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-37.5	176.5	-70	-21.2	0	0	0	111.8	K250 Y251 N413 S421	K250-D417 WeakPolarHBondContact CE-OD1 3.41Å; K250-D417 IonicContact NZ-OD1 2.78Å; K250-D417 PolarHBondContact NZ-OD1 2.92Å; Y251-D417 HydrophobicContact CD2-CB 4.15Å; N413-D417 WeakPolarHBondContact O-CB 3.47Å; N413-D417 PolarHBondContact O-N 3.44Å; D417-S421 WeakPolarHBondContact O-CB 3.24Å; D417-S421 PolarHBondContact O-N 3.36Å; D417-S421 PolarHBondContact O-OG 3.15Å
418	Q	87.7	Confident	82.1	Confident	89 Å²	89	67.8 Å²	67.8	42%	0.416	34%	0.336	S	S	.	.	H	α-helix	trans	-67.9	-40.8	173.7	-168.7	-178.6	8.2	0	0	111.7	A414 V415 S421 R422	A414-Q418 WeakPolarHBondContact O-CB 3.26Å; A414-Q418 PolarHBondContact O-N 3.44Å; V415-Q418 PolarHBondContact O-N 3.31Å; Q418-S421 PolarHBondContact O-N 2.99Å; Q418-R422 VanDerWaalsContact CD-NH1 3.35Å; Q418-R422 VanDerWaalsContact NE2-NH1 3.15Å; Q418-R422 PolarHBondContact O-N 3.44Å
419	R	84.9	Confident	79.2	Confident	83 Å²	83	70 Å²	70	31%	0.313	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-45.9	175.8	177.8	176.3	177.8	-96.9	-2.1	111.1	V415 M416 S421 R422 I423	V415-R419 VanDerWaalsContact O-CB 3.28Å; V415-R419 WeakPolarHBondContact O-CB 3.38Å; V415-R419 PolarHBondContact O-N 2.88Å; M416-R419 PolarHBondContact O-N 3.37Å; R419-S421 VanDerWaalsContact C-N 3.32Å; R419-S421 PolarHBondContact O-N 3.42Å; R419-R422 PolarHBondContact O-N 2.79Å; R419-I423 HydrophobicContact CG-CD1 3.69Å; R419-I423 HydrophobicContact CG-CG1 4.4Å; R419-I423 WeakPolarHBondContact O-CG1 3.42Å; R419-I423 PolarHBondContact O-N 3.11Å
420	E	85.1	Confident	76.5	Confident	34 Å²	34	71.8 Å²	71.8	16%	0.159	36%	0.355	C	S	.	.	H	α-helix	trans	-55.9	-48.7	174.9	-175.3	-177.3	165.9	0	0	110.6	T240 K250 M416 R422 I423 L424	T240-E420 PolarHBondContact OG1-OE1 3.05Å; K250-E420 IonicContact NZ-OE2 2.96Å; K250-E420 PolarHBondContact NZ-OE2 3.44Å; M416-E420 WeakPolarHBondContact O-CB 3.37Å; M416-E420 PolarHBondContact O-N 3.35Å; E420-R422 VanDerWaalsContact C-N 3.34Å; E420-R422 PolarHBondContact O-N 2.81Å; E420-I423 PolarHBondContact O-N 2.95Å; E420-L424 HydrophobicContact CG-CD1 3.81Å; E420-L424 WeakPolarHBondContact O-CD1 3.35Å; E420-L424 PolarHBondContact O-N 2.87Å; E420-L424 VanDerWaalsContact O-N 3.16Å
421	S	83.7	Confident	73.7	Confident	15 Å²	15	76.4 Å²	76.4	11%	0.105	39%	0.385	C	S	.	.	H	α-helix	trans	-64.4	-33.1	179.4	-59.1	0	0	0	0	114	D417 Q418 R419 K425	D417-S421 WeakPolarHBondContact O-CB 3.24Å; D417-S421 PolarHBondContact O-N 3.36Å; D417-S421 PolarHBondContact O-OG 3.15Å; Q418-S421 PolarHBondContact O-N 2.99Å; R419-S421 VanDerWaalsContact C-N 3.32Å; R419-S421 PolarHBondContact O-N 3.42Å; S421-K425 WeakPolarHBondContact O-CB 3.45Å; S421-K425 VanDerWaalsContact O-CG 3.22Å; S421-K425 WeakPolarHBondContact O-CG 3.31Å; S421-K425 PolarHBondContact O-N 3.38Å
422	R	81	Confident	70.8	Confident	132 Å²	132	77.3 Å²	77.3	50%	0.498	40%	0.395	S	S	.	.	H	α-helix	trans	-72.3	-47.7	175.7	-75.4	-159.6	-64.2	-103.6	-0.1	112	Q418 R419 E420 L424 K425 E426	Q418-R422 VanDerWaalsContact CD-NH1 3.35Å; Q418-R422 VanDerWaalsContact NE2-NH1 3.15Å; Q418-R422 PolarHBondContact O-N 3.44Å; R419-R422 PolarHBondContact O-N 2.79Å; E420-R422 VanDerWaalsContact C-N 3.34Å; E420-R422 PolarHBondContact O-N 2.81Å; R422-L424 PolarHBondContact O-N 2.48Å; R422-K425 PolarHBondContact O-N 2.89Å; R422-K425 VanDerWaalsContact O-N 3.09Å; R422-E426 PolarHBondContact O-N 3.49Å
423	I	75.1	Confident	67.8	Low	90 Å²	90	79.5 Å²	79.5	46%	0.462	41%	0.407	S	S	.	.	H	α-helix	trans	-60.2	-37.2	-178.2	-67.9	169.3	0	0	0	111.3	R419 E420	R419-I423 HydrophobicContact CG-CD1 3.69Å; R419-I423 HydrophobicContact CG-CG1 4.4Å; R419-I423 WeakPolarHBondContact O-CG1 3.42Å; R419-I423 PolarHBondContact O-N 3.11Å; E420-I423 PolarHBondContact O-N 2.95Å
424	L	75.8	Confident	64.6	Low	50 Å²	50	82 Å²	82	26%	0.262	43%	0.427	S	S	.	.	H	α-helix	trans	-81.7	-18	178.2	-87.4	127	0	0	0	114.3	L36 I241 E420 R422	L36-L424 HydrophobicContact CD2-CD2 4.12Å; I241-L424 HydrophobicContact CG2-CD2 4.45Å; E420-L424 HydrophobicContact CG-CD1 3.81Å; E420-L424 WeakPolarHBondContact O-CD1 3.35Å; E420-L424 PolarHBondContact O-N 2.87Å; E420-L424 VanDerWaalsContact O-N 3.16Å; R422-L424 PolarHBondContact O-N 2.48Å
425	K	70.4	Confident	61.5	Low	130 Å²	130	87.9 Å²	87.9	57%	0.565	45%	0.449	S	S	*	.	H	α-helix	trans	-89.8	-26.4	178	-82.2	-177.7	-178.8	-174.4	0	113.4	S421 R422 P427	S421-K425 WeakPolarHBondContact O-CB 3.45Å; S421-K425 VanDerWaalsContact O-CG 3.22Å; S421-K425 WeakPolarHBondContact O-CG 3.31Å; S421-K425 PolarHBondContact O-N 3.38Å; R422-K425 PolarHBondContact O-N 2.89Å; R422-K425 VanDerWaalsContact O-N 3.09Å; K425-P427 VanDerWaalsContact O-CD 3.26Å; K425-P427 WeakPolarHBondContact O-CD 3.4Å; K425-P427 VanDerWaalsContact O-N 3.13Å
426	E	57.9	Low	58.7	Low	140 Å²	140	88.2 Å²	88.2	65%	0.654	45%	0.452	S	S	*	.	S	Bend	trans	-59.5	117.4	170.5	-77.6	-177.1	-173.1	0	0	107.6	R422 F428	R422-E426 PolarHBondContact O-N 3.49Å; E426-F428 PolarHBondContact O-N 3.28Å; E426-F428 VanDerWaalsContact O-N 3.12Å
427	P	45.6	Very low	55.7	Low	99 Å²	99	92.9 Å²	92.9	64%	0.643	48%	0.478	S	S	*	.			trans	-55.3	127.5	164.1	25	-29.9	0	0	0	104.7	K425 D429	K425-P427 VanDerWaalsContact O-CD 3.26Å; K425-P427 WeakPolarHBondContact O-CD 3.4Å; K425-P427 VanDerWaalsContact O-N 3.13Å; P427-D429 HydrophobicContact CB-CB 4.41Å; P427-D429 HydrophobicContact CG-CB 4.4Å; P427-D429 PolarHBondContact O-N 3.25Å
428	F	48.9	Very low	53	Low	144 Å²	144	98.8 Å²	98.8	63%	0.632	51%	0.509	S	S	*	.			trans	-68.9	71.6	165.5	-138.3	-82.3	0	0	0	106	K2 E426 L430 L433	K2-F428 HydrophobicContact CD-CD1 4.02Å; K2-F428 PolarHBondContact NZ-O 3.4Å; E426-F428 PolarHBondContact O-N 3.28Å; E426-F428 VanDerWaalsContact O-N 3.12Å; F428-L430 PolarHBondContact O-N 3.22Å; F428-L430 VanDerWaalsContact O-N 3.17Å; F428-L433 HydrophobicContact CE1-CD1 4.26Å
429	D	34.3	Very low	50.2	Low	80 Å²	80	101.7 Å²	101.7	43%	0.428	53%	0.526	S	S	.	.			trans	-72.7	107	-175.4	-157.3	-20.8	0	0	0	105.4	P427 T431 T432	P427-D429 HydrophobicContact CB-CB 4.41Å; P427-D429 HydrophobicContact CG-CB 4.4Å; P427-D429 PolarHBondContact O-N 3.25Å; D429-T431 PolarHBondContact O-N 3.45Å; D429-T431 VanDerWaalsContact O-N 3.07Å; D429-T431 PolarHBondContact OD1-OG1 3.2Å; D429-T432 PolarHBondContact O-N 3.3Å; D429-T432 PolarHBondContact O-OG1 3.35Å
430	L	36.8	Very low	47.4	Very low	45 Å²	45	105.5 Å²	105.5	24%	0.236	55%	0.553	C	S	.	*	T	Hydrogen-bonded Turn	trans	-67.5	-11.1	-168.8	-138.7	59.7	0	0	0	112	K2 L6 F428 L433	K2-L430 HydrophobicContact CB-CD1 4.1Å; K2-L430 HydrophobicContact CD-CD1 3.45Å; K2-L430 VanDerWaalsContact CD-CD1 3.45Å; K2-L430 HydrophobicContact CG-CD1 3.61Å; L6-L430 HydrophobicContact CB-CD2 3.98Å; L6-L430 HydrophobicContact CD1-CD2 3.55Å; L6-L430 HydrophobicContact CD2-CD2 3.55Å; L6-L430 HydrophobicContact CD2-CG 3.91Å; L6-L430 HydrophobicContact CG-CD2 3.86Å; F428-L430 PolarHBondContact O-N 3.22Å; F428-L430 VanDerWaalsContact O-N 3.17Å; L430-L433 HydrophobicContact CD1-CD1 4.44Å
431	T	35.1	Very low	44.7	Very low	113 Å²	113	112.6 Å²	112.6	69%	0.693	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-17.3	-177.3	60.3	0	0	0	0	113.9	D429	D429-T431 PolarHBondContact O-N 3.45Å; D429-T431 VanDerWaalsContact O-N 3.07Å; D429-T431 PolarHBondContact OD1-OG1 3.2Å
432	T	32.6	Very low	42.1	Very low	114 Å²	114	118.3 Å²	118.3	70%	0.699	61%	0.613	S	S	*	*	S	Bend	trans	-97.8	-1.1	179.9	57.3	0	0	0	0	114.3	D429	D429-T432 PolarHBondContact O-N 3.3Å; D429-T432 PolarHBondContact O-OG1 3.35Å
433	L	30.8	Very low	39.6	Very low	68 Å²	68	119.2 Å²	119.2	36%	0.356	63%	0.626	S	S	.	*	S	Bend	trans	-72.2	126.6	166.5	-78	155.5	0	0	0	107	F428 L430 Q435	F428-L433 HydrophobicContact CE1-CD1 4.26Å; L430-L433 HydrophobicContact CD1-CD1 4.44Å; L433-Q435 PolarHBondContact O-N 3.17Å
434	P	26.9	Very low	37.5	Very low	116 Å²	116	120.3 Å²	120.3	75%	0.753	64%	0.637	S	S	*	*			trans	-56	115.8	-179.3	23.1	-31.7	0	0	0	107.7
435	Q	25.1	Very low	35.4	Very low	157 Å²	157	126.2 Å²	126.2	73%	0.734	66%	0.663	S	S	*	*			trans	-54.2	128.7	166.6	-66.7	-172.4	-66.8	0	0	105.9	L433 D437	L433-Q435 PolarHBondContact O-N 3.17Å; Q435-D437 PolarHBondContact O-N 3.46Å
436	P	34	Very low	33.4	Very low	84 Å²	84	127.9 Å²	127.9	55%	0.545	68%	0.678	S	S	.	*			trans	-69.2	85.5	175.7	27.3	-30.4	0	0	0	107.8	E7 I438	E7-P436 WeakPolarHBondContact OE1-CG 3.43Å; P436-I438 PolarHBondContact O-N 3.07Å
437	D	29	Very low	32.2	Very low	146 Å²	146	126.8 Å²	126.8	78%	0.781	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	50.3	171.8	-79.5	-26	0	0	0	110.7	Q435	Q435-D437 PolarHBondContact O-N 3.46Å
438	I	31.6	Very low	31.4	Very low	146 Å²	146	128.4 Å²	128.4	75%	0.749	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.9	-18.3	171.7	-56.1	-177.3	0	0	0	112.8	P436 N440	P436-I438 PolarHBondContact O-N 3.07Å; I438-N440 PolarHBondContact O-N 2.76Å
439	L	28.7	Very low	30.5	Very low	150 Å²	150	128.5 Å²	128.5	79%	0.785	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	32.8	-178.4	-147.8	82.4	0	0	0	115
440	N	27.9	Very low	30.2	Very low	163 Å²	163	130.7 Å²	130.7	87%	0.872	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	22.4	169.6	-146.2	25.3	0	0	0	113.6	I438	I438-N440 PolarHBondContact O-N 2.76Å
441	K	27.5	Very low	29.9	Very low	182 Å²	182	136.2 Å²	136.2	79%	0.791	73%	0.725	S	S	*	*	S	Bend	trans	-102.6	94.1	169.4	-123.5	177.9	-177.7	177.7	0	110.3
442	N	29.6	Very low	29.6	Very low	136 Å²	136	135.5 Å²	135.5	73%	0.727	72%	0.721	S	S	*	*			trans	63.4	60.7	150.7	-56	-1.1	0	0	0	117.4	T444	N442-T444 PolarHBondContact O-N 3.4Å
443	I	28.7	Very low	29.5	Very low	150 Å²	150	135.5 Å²	135.5	77%	0.769	71%	0.709	S	S	*	*			trans	-87.9	76.6	154.2	-55.1	177.6	0	0	0	107.5
444	T	30.1	Very low	29.3	Very low	114 Å²	114	140.7 Å²	140.7	70%	0.699	73%	0.729	S	S	*	*			trans	-83.8	120.1	157.4	32.8	0	0	0	0	108.1	N442	N442-T444 PolarHBondContact O-N 3.4Å
445	E	31.6	Very low	29.3	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.813	73%	0.731	S	S	*	*			trans	62.5	101.7	152	-63.3	179.6	167.4	0	0	118.5	S447	E445-S447 PolarHBondContact O-N 3.15Å
446	N	29.3	Very low	29.4	Very low	165 Å²	165	141.5 Å²	141.5	88%	0.882	73%	0.73	S	S	*	*	S	Bend		21.9	89.2	128.1	-68.9	-13.9	0	0	0	117.2
447	S	31.7	Very low	29.1	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	74%	0.741	S	S	*	*	S	Bend	trans	178	7	138.5	61.9	0	0	0	0	115.7	E445	E445-S447 PolarHBondContact O-N 3.15Å
448	L	28.5	Very low	29.5	Very low	132 Å²	132	142.7 Å²	142.7	69%	0.691	74%	0.738	S	S	*	*			trans	-123.6	43.2	-178	-156.2	86.5	0	0	0	113.3
449	F	30	Very low	29.2	Very low	147 Å²	147	145 Å²	145	65%	0.645	74%	0.742	S	S	*	*	S	Bend	trans	-92.2	-9.4	172.2	-160.2	-100.7	0	0	0	112.8	Y453	F449-Y453 HydrophobicContact CE1-CD2 4.47Å; F449-Y453 HydrophobicContact CE1-CE2 4.15Å; F449-Y453 AromaticContact CZ-CE2 3.97Å; F449-Y453 HydrophobicContact CZ-CE2 3.97Å
450	D	29.6	Very low	29.1	Very low	126 Å²	126	144.7 Å²	144.7	67%	0.674	75%	0.747	S	S	*	*	S	Bend	trans	-102.2	-7.6	-169.3	-147.9	20.1	0	0	0	115.1
451	E	29.4	Very low	29	Very low	160 Å²	160	144.1 Å²	144.1	75%	0.748	74%	0.744	S	S	*	*	S	Bend	trans	-101.2	-18.3	176.9	-79.6	-148	149.5	0	0	115.2
452	T	28.9	Very low	28.8	Very low	98 Å²	98	140.7 Å²	140.7	60%	0.601	74%	0.738	S	S	*	*	S	Bend	trans	-76.1	-26.9	178.1	-46.1	0	0	0	0	112.3
453	Y	31.3	Very low	28.7	Very low	114 Å²	114	143.5 Å²	143.5	45%	0.447	74%	0.744	S	S	.	*	G	3₁₀ helix	trans	-80.6	-22.3	-176.9	-92	-85.6	0	0	0	115.1	E60 F449 L455 L456	E60-Y453 PolarHBondContact OE1-OH 3.33Å; F449-Y453 HydrophobicContact CE1-CD2 4.47Å; F449-Y453 HydrophobicContact CE1-CE2 4.15Å; F449-Y453 AromaticContact CZ-CE2 3.97Å; F449-Y453 HydrophobicContact CZ-CE2 3.97Å; Y453-L455 VanDerWaalsContact C-N 3.26Å; Y453-L455 PolarHBondContact O-N 3.35Å; Y453-L456 HydrophobicContact CD1-CD1 4.41Å
454	K	26.5	Very low	28.4	Very low	178 Å²	178	139.7 Å²	139.7	77%	0.774	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-77.9	-5	179.8	-83	-179.5	-179	163.2	0	114.9
455	L	26	Very low	28.2	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-97	6.4	176.5	-138.5	80	0	0	0	114.2	Y453 N457	Y453-L455 VanDerWaalsContact C-N 3.26Å; Y453-L455 PolarHBondContact O-N 3.35Å; L455-N457 PolarHBondContact O-N 3.2Å
456	L	28.6	Very low	27.9	Very low	137 Å²	137	139.8 Å²	139.8	72%	0.717	73%	0.729	S	S	*	*			trans	-97.8	32.5	-176.3	-83.1	151.3	0	0	0	114.4	Y453	Y453-L456 HydrophobicContact CD1-CD1 4.41Å
457	N	26.1	Very low	27.9	Very low	145 Å²	145	137.3 Å²	137.3	78%	0.775	72%	0.721	S	S	*	*	S	Bend	trans	-113.2	144.3	167.9	-128.9	1.4	0	0	0	110.1	L455 K459	L455-N457 PolarHBondContact O-N 3.2Å; N457-K459 PolarHBondContact O-N 2.87Å
458	P	37.9	Very low	28.3	Very low	111 Å²	111	137.8 Å²	137.8	72%	0.721	71%	0.711	S	S	*	*	S	Bend		-97.7	102.3	-125.7	33.9	-23.6	0	0	0	110.1
459	K	26.5	Very low	28.6	Very low	194 Å²	194	139.2 Å²	139.2	84%	0.843	71%	0.714	S	S	*	*			trans	177.3	86.6	158.6	-100.4	160.4	-171.9	-175.4	0	107.6	N457	N457-K459 PolarHBondContact O-N 2.87Å
460	T	25.4	Very low	28.9	Very low	143 Å²	143	138.4 Å²	138.4	88%	0.877	72%	0.716	S	S	*	*			trans	-177	133	139.4	19.3	0	0	0	0	109.4
461	N	25.8	Very low	29.5	Very low	151 Å²	151	138.1 Å²	138.1	81%	0.807	71%	0.71	S	S	*	*			trans	-57.5	168.5	171.1	-64.7	-34.1	0	0	0	110.8
462	T	24.1	Very low	30.1	Very low	110 Å²	110	133.7 Å²	133.7	68%	0.675	69%	0.694	S	S	*	*			trans	77.1	74	168.7	37.3	0	0	0	0	117.3	T464	T462-T464 HydrophobicContact CG2-CG2 3.72Å; T462-T464 PolarHBondContact O-N 2.8Å
463	F	26.3	Very low	31.1	Very low	196 Å²	196	133.9 Å²	133.9	86%	0.86	69%	0.688	S	S	*	*			trans	-80.4	77.7	146	-160.1	-95.8	0	0	0	107.9
464	T	22.4	Very low	32.1	Very low	70 Å²	70	132.4 Å²	132.4	43%	0.429	69%	0.691	S	S	.	*			trans	-98.7	83	177.6	37.9	0	0	0	0	110	T462 E468	T462-T464 HydrophobicContact CG2-CG2 3.72Å; T462-T464 PolarHBondContact O-N 2.8Å; T464-E468 WeakPolarHBondContact CG2-OE1 3.37Å
465	L	25.6	Very low	33.1	Very low	156 Å²	156	127.2 Å²	127.2	82%	0.817	67%	0.671	S	S	*	*			trans	-144.4	31.2	166.6	-81.3	-179.8	0	0	0	113.9
466	L	26.6	Very low	34.3	Very low	134 Å²	134	124.2 Å²	124.2	70%	0.702	66%	0.655	S	S	*	*	S	Bend	trans	-139.2	147.3	165.4	-80.7	162.2	0	0	0	109.7	E468	L466-E468 WeakPolarHBondContact O-CA 3.32Å; L466-E468 PolarHBondContact O-N 2.86Å
467	P	29.7	Very low	35.7	Very low	113 Å²	113	123 Å²	123	73%	0.734	64%	0.644	S	S	*	*			trans	-60.3	113.8	-172.4	-14.8	27.2	0	0	0	111.1	H469	P467-H469 PolarHBondContact O-N 3.39Å
468	E	39.9	Very low	37.6	Very low	126 Å²	126	122.9 Å²	122.9	59%	0.589	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-5.3	-144.7	-148.7	177.6	-178.4	0	0	116.6	T464 L466 T472	T464-E468 WeakPolarHBondContact CG2-OE1 3.37Å; L466-E468 WeakPolarHBondContact O-CA 3.32Å; L466-E468 PolarHBondContact O-N 2.86Å; E468-T472 PolarHBondContact O-OG1 2.86Å
469	H	33.8	Very low	39.1	Very low	163 Å²	163	120 Å²	120	76%	0.755	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-42.1	-172	-101.4	-65.4	0	0	0	116.2	P467	P467-H469 PolarHBondContact O-N 3.39Å
470	N	36.9	Very low	41.6	Very low	130 Å²	130	111.3 Å²	111.3	70%	0.695	58%	0.579	S	S	*	*	H	α-helix	trans	-87.2	-33.3	-173.8	-75.9	-7.6	0	0	0	113.4	T474	N470-T474 WeakPolarHBondContact O-CB 3.43Å; N470-T474 PolarHBondContact O-N 2.82Å; N470-T474 PolarHBondContact O-OG1 3.01Å
471	H	40.7	Very low	44.5	Very low	119 Å²	119	107.9 Å²	107.9	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-77.7	-41.7	-175.7	-136.1	-51.5	0	0	0	111.6	E473 T474 I475	H471-E473 VanDerWaalsContact C-N 3.34Å; H471-E473 PolarHBondContact O-N 3.1Å; H471-T474 PolarHBondContact O-N 3.29Å; H471-I475 WeakPolarHBondContact ND1-CD1 3.34Å; H471-I475 WeakPolarHBondContact O-CB 3.12Å; H471-I475 WeakPolarHBondContact O-CG1 2.92Å; H471-I475 PolarHBondContact O-N 3.06Å
472	T	44	Very low	47.5	Very low	68 Å²	68	100.9 Å²	100.9	42%	0.417	52%	0.519	S	S	.	.	H	α-helix	trans	-59.5	-43.5	176.9	-34.6	0	0	0	0	111.2	E468 I475 I476	E468-T472 PolarHBondContact O-OG1 2.86Å; T472-I475 PolarHBondContact O-N 2.76Å; T472-I476 HydrophobicContact CG2-CD1 3.95Å; T472-I476 WeakPolarHBondContact O-CB 3.1Å; T472-I476 WeakPolarHBondContact O-CD1 3.49Å; T472-I476 WeakPolarHBondContact O-CG1 3.48Å; T472-I476 PolarHBondContact O-N 2.71Å
473	E	49	Very low	50.8	Low	102 Å²	102	98.3 Å²	98.3	48%	0.477	50%	0.497	S	S	.	.	H	α-helix	trans	-67.3	-38.8	177.4	-160.3	-169.7	159.2	0	0	112.3	H471 K477	H471-E473 VanDerWaalsContact C-N 3.34Å; H471-E473 PolarHBondContact O-N 3.1Å; E473-K477 VanDerWaalsContact CD-NZ 3.33Å; E473-K477 HydrophobicContact CG-CD 4.43Å; E473-K477 VanDerWaalsContact O-CB 3.28Å; E473-K477 WeakPolarHBondContact O-CB 3.17Å; E473-K477 WeakPolarHBondContact O-CG 3.4Å; E473-K477 PolarHBondContact O-N 2.76Å; E473-K477 WeakPolarHBondContact OE1-CE 3.44Å; E473-K477 IonicContact OE1-NZ 2.87Å; E473-K477 PolarHBondContact OE1-NZ 2.9Å; E473-K477 IonicContact OE2-NZ 3.13Å
474	T	51.2	Low	53.9	Low	82 Å²	82	94.5 Å²	94.5	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-65.9	-43	177.5	-55.7	0	0	0	0	111.2	N470 H471 K477 Q478	N470-T474 WeakPolarHBondContact O-CB 3.43Å; N470-T474 PolarHBondContact O-N 2.82Å; N470-T474 PolarHBondContact O-OG1 3.01Å; H471-T474 PolarHBondContact O-N 3.29Å; T474-K477 WeakPolarHBondContact O-CB 3.48Å; T474-K477 PolarHBondContact O-N 3.49Å; T474-Q478 PolarHBondContact O-N 3.4Å; T474-Q478 VanDerWaalsContact O-N 3.11Å
475	I	48.8	Very low	57.3	Low	69 Å²	69	92.7 Å²	92.7	35%	0.354	47%	0.467	S	S	.	.	H	α-helix	trans	-65.8	-48.6	177	-69	170.6	0	0	0	110.6	H471 T472 K477 Q478 Y479	H471-I475 WeakPolarHBondContact ND1-CD1 3.34Å; H471-I475 WeakPolarHBondContact O-CB 3.12Å; H471-I475 WeakPolarHBondContact O-CG1 2.92Å; H471-I475 PolarHBondContact O-N 3.06Å; T472-I475 PolarHBondContact O-N 2.76Å; I475-K477 VanDerWaalsContact C-N 3.28Å; I475-K477 PolarHBondContact O-N 2.88Å; I475-Q478 WeakPolarHBondContact O-CB 3.4Å; I475-Q478 PolarHBondContact O-N 3.19Å; I475-Y479 HydrophobicContact CG2-CD2 3.69Å; I475-Y479 HydrophobicContact CG2-CE2 3.32Å; I475-Y479 VanDerWaalsContact O-CD2 3.26Å; I475-Y479 WeakPolarHBondContact O-CD2 3.17Å; I475-Y479 PolarHBondContact O-N 3Å; I475-Y479 VanDerWaalsContact O-N 3.08Å
476	I	51.8	Low	60.6	Low	89 Å²	89	85.5 Å²	85.5	46%	0.456	43%	0.43	S	S	.	.	H	α-helix	trans	-59.3	-38.9	175.4	-69.6	166.3	0	0	0	111.2	T472 Q478 G480	T472-I476 HydrophobicContact CG2-CD1 3.95Å; T472-I476 WeakPolarHBondContact O-CB 3.1Å; T472-I476 WeakPolarHBondContact O-CD1 3.49Å; T472-I476 WeakPolarHBondContact O-CG1 3.48Å; T472-I476 PolarHBondContact O-N 2.71Å; I476-Q478 VanDerWaalsContact C-N 3.27Å; I476-Q478 PolarHBondContact O-N 2.82Å; I476-G480 PolarHBondContact O-N 3.33Å
477	K	57.4	Low	63.9	Low	112 Å²	112	82.1 Å²	82.1	49%	0.487	41%	0.412	S	S	.	.	H	α-helix	trans	-62.5	-33.5	175.3	-82.3	171.1	-176.6	163.1	0	112.3	E473 T474 I475	E473-K477 VanDerWaalsContact CD-NZ 3.33Å; E473-K477 HydrophobicContact CG-CD 4.43Å; E473-K477 VanDerWaalsContact O-CB 3.28Å; E473-K477 WeakPolarHBondContact O-CB 3.17Å; E473-K477 WeakPolarHBondContact O-CG 3.4Å; E473-K477 PolarHBondContact O-N 2.76Å; E473-K477 WeakPolarHBondContact OE1-CE 3.44Å; E473-K477 IonicContact OE1-NZ 2.87Å; E473-K477 PolarHBondContact OE1-NZ 2.9Å; E473-K477 IonicContact OE2-NZ 3.13Å; T474-K477 WeakPolarHBondContact O-CB 3.48Å; T474-K477 PolarHBondContact O-N 3.49Å; I475-K477 VanDerWaalsContact C-N 3.28Å; I475-K477 PolarHBondContact O-N 2.88Å
478	Q	66.1	Low	67.1	Low	143 Å²	143	81.1 Å²	81.1	67%	0.668	40%	0.4	S	S	*	.	H	α-helix	trans	-75.7	-47.8	-179.5	-170	169.4	-9.9	0	0	112.1	T474 I475 I476 I481	T474-Q478 PolarHBondContact O-N 3.4Å; T474-Q478 VanDerWaalsContact O-N 3.11Å; I475-Q478 WeakPolarHBondContact O-CB 3.4Å; I475-Q478 PolarHBondContact O-N 3.19Å; I476-Q478 VanDerWaalsContact C-N 3.27Å; I476-Q478 PolarHBondContact O-N 2.82Å; Q478-I481 WeakPolarHBondContact O-CG2 3.43Å
479	Y	68.2	Low	69.8	Low	49 Å²	49	76.2 Å²	76.2	19%	0.192	38%	0.377	C	S	.	.	H	α-helix	trans	-68.7	-34.9	-179.5	-69	-73.9	0	0	0	113.3	E68 L72 N76 I475 I481	E68-Y479 VanDerWaalsContact CD-OH 3.28Å; E68-Y479 PolarHBondContact OE1-OH 3.34Å; E68-Y479 WeakPolarHBondContact OE2-CE1 3.35Å; E68-Y479 VanDerWaalsContact OE2-CZ 3.24Å; E68-Y479 PolarHBondContact OE2-OH 2.72Å; L72-Y479 HydrophobicContact CB-CD1 3.99Å; L72-Y479 HydrophobicContact CB-CE1 4.4Å; L72-Y479 HydrophobicContact CD1-CD1 3.75Å; N76-Y479 PolarHBondContact ND2-O 3.44Å; N76-Y479 PolarHBondContact OD1-O 3.06Å; I475-Y479 HydrophobicContact CG2-CD2 3.69Å; I475-Y479 HydrophobicContact CG2-CE2 3.32Å; I475-Y479 VanDerWaalsContact O-CD2 3.26Å; I475-Y479 WeakPolarHBondContact O-CD2 3.17Å; I475-Y479 PolarHBondContact O-N 3Å; I475-Y479 VanDerWaalsContact O-N 3.08Å; Y479-I481 VanDerWaalsContact C-N 3.28Å; Y479-I481 PolarHBondContact O-N 3.3Å
480	G	79.4	Confident	72.8	Confident	12 Å²	12	68.5 Å²	68.5	12%	0.124	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	10.5	-176.4	0	0	0	0	0	116.3	I476 K484	I476-G480 PolarHBondContact O-N 3.33Å; G480-K484 PolarHBondContact O-N 3.34Å
481	I	87	Confident	75.7	Confident	71 Å²	71	68.3 Å²	68.3	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-69	-36	-173.8	-163.8	161.4	0	0	0	113.1	Q478 Y479 K484 I485	Q478-I481 WeakPolarHBondContact O-CG2 3.43Å; Y479-I481 VanDerWaalsContact C-N 3.28Å; Y479-I481 PolarHBondContact O-N 3.3Å; I481-K484 PolarHBondContact O-N 2.9Å; I481-I485 HydrophobicContact CG1-CD1 4.09Å; I481-I485 VanDerWaalsContact O-CG1 3.3Å; I481-I485 WeakPolarHBondContact O-CG1 3.46Å; I481-I485 PolarHBondContact O-N 2.91Å
482	G	88.4	Confident	78.4	Confident	5 Å²	5	62.9 Å²	62.9	5%	0.052	31%	0.31	C	S	.	.	H	α-helix	trans	-65.8	-38.6	177.9	0	0	0	0	0	112.8	N76 I485 T486	N76-G482 WeakPolarHBondContact OD1-CA 3.48Å; N76-G482 PolarHBondContact OD1-N 2.86Å; G482-I485 PolarHBondContact O-N 3.26Å; G482-T486 WeakPolarHBondContact O-CB 3.31Å; G482-T486 PolarHBondContact O-N 3.32Å; G482-T486 PolarHBondContact O-OG1 2.69Å
483	R	93	Very high	80.8	Confident	56 Å²	56	59.7 Å²	59.7	21%	0.211	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-46.8	171.5	178.4	-179.7	169.1	-159.8	-5.7	111.5	N76 L77 L78 K79 E82 T486 L487	N76-R483 PolarHBondContact OD1-N 3.05Å; L77-R483 WeakPolarHBondContact O-CD 3.23Å; L78-R483 HydrophobicContact CD1-CG 4.27Å; K79-R483 VanDerWaalsContact CD-NH2 3.26Å; E82-R483 IonicContact OE1-CZ 3.65Å; E82-R483 IonicContact OE1-NE 2.71Å; E82-R483 IonicContact OE1-NH2 3.4Å; E82-R483 PolarHBondContact OE1-NH2 2.92Å; E82-R483 IonicContact OE2-CZ 3.99Å; E82-R483 IonicContact OE2-NE 2.81Å; E82-R483 PolarHBondContact OE2-NE 2.86Å; E82-R483 IonicContact OE2-NH2 3.99Å; E82-R483 PolarHBondContact OE2-NH2 3.09Å; R483-T486 WeakPolarHBondContact O-CB 3.18Å; R483-T486 PolarHBondContact O-N 2.65Å; R483-L487 HydrophobicContact CG-CD1 4.3Å; R483-L487 WeakPolarHBondContact O-CG 3.32Å; R483-L487 PolarHBondContact O-N 3.4Å
484	K	92.1	Very high	83.1	Confident	116 Å²	116	56 Å²	56	50%	0.504	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-46.4	177.6	-68.3	176.8	-177.7	173.1	0	111.3	G480 I481 T486 L487 I488	G480-K484 PolarHBondContact O-N 3.34Å; I481-K484 PolarHBondContact O-N 2.9Å; K484-T486 VanDerWaalsContact C-N 3.3Å; K484-T486 PolarHBondContact O-N 3.28Å; K484-L487 PolarHBondContact O-N 2.93Å; K484-I488 VanDerWaalsContact O-CG1 3.28Å; K484-I488 WeakPolarHBondContact O-CG1 3.33Å; K484-I488 PolarHBondContact O-N 2.81Å
485	I	92.7	Very high	85.3	Confident	32 Å²	32	53.2 Å²	53.2	16%	0.164	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-43.3	175.8	-70.1	167	0	0	0	110.8	F412 M416 I481 G482 L487 I488 H489	F412-I485 HydrophobicContact CE2-CG2 4.2Å; F412-I485 HydrophobicContact CZ-CG2 3.94Å; M416-I485 HydrophobicContact CE-CD1 4.27Å; M416-I485 HydrophobicContact CE-CG2 4.22Å; M416-I485 HydrophobicContact SD-CG2 4.41Å; I481-I485 HydrophobicContact CG1-CD1 4.09Å; I481-I485 VanDerWaalsContact O-CG1 3.3Å; I481-I485 WeakPolarHBondContact O-CG1 3.46Å; I481-I485 PolarHBondContact O-N 2.91Å; G482-I485 PolarHBondContact O-N 3.26Å; I485-L487 PolarHBondContact O-N 3.16Å; I485-I488 PolarHBondContact O-N 3.29Å; I485-H489 VanDerWaalsContact O-CB 3.29Å; I485-H489 WeakPolarHBondContact O-CB 3.29Å; I485-H489 PolarHBondContact O-N 3.39Å
486	T	95.1	Very high	87.5	Confident	5 Å²	5	50 Å²	50	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-44.5	178.7	-57.3	0	0	0	0	111.4	L78 I144 G482 R483 K484 S490	L78-T486 HydrophobicContact CD1-CG2 3.53Å; I144-T486 HydrophobicContact CG2-CG2 3.59Å; G482-T486 WeakPolarHBondContact O-CB 3.31Å; G482-T486 PolarHBondContact O-N 3.32Å; G482-T486 PolarHBondContact O-OG1 2.69Å; R483-T486 WeakPolarHBondContact O-CB 3.18Å; R483-T486 PolarHBondContact O-N 2.65Å; K484-T486 VanDerWaalsContact C-N 3.3Å; K484-T486 PolarHBondContact O-N 3.28Å; T486-S490 WeakPolarHBondContact O-CB 3.29Å; T486-S490 PolarHBondContact O-N 3.49Å; T486-S490 PolarHBondContact O-OG 3.36Å
487	L	96.3	Very high	89.6	Confident	62 Å²	62	45.7 Å²	45.7	33%	0.325	22%	0.219	S	C	.	.	H	α-helix	trans	-66.2	-43	176.9	-70.5	171.5	0	0	0	112.3	L78 R483 K484 I485 S490 F491	L78-L487 HydrophobicContact CD2-CD2 3.89Å; L78-L487 HydrophobicContact CG-CD2 4.16Å; R483-L487 HydrophobicContact CG-CD1 4.3Å; R483-L487 WeakPolarHBondContact O-CG 3.32Å; R483-L487 PolarHBondContact O-N 3.4Å; K484-L487 PolarHBondContact O-N 2.93Å; I485-L487 PolarHBondContact O-N 3.16Å; L487-S490 WeakPolarHBondContact O-CB 3.28Å; L487-S490 PolarHBondContact O-N 3.15Å; L487-F491 WeakPolarHBondContact O-CB 3.43Å; L487-F491 PolarHBondContact O-N 3.35Å
488	I	96.5	Very high	91.4	Very high	92 Å²	92	43.3 Å²	43.3	47%	0.472	21%	0.213	S	C	.	.	H	α-helix	trans	-64.6	-45.8	177.7	-66.4	165.6	0	0	0	110.7	F412 K484 I485 S490 F491 C492	F412-I488 HydrophobicContact CD2-CG2 3.68Å; F412-I488 HydrophobicContact CE2-CB 4.44Å; F412-I488 HydrophobicContact CE2-CG2 4.02Å; K484-I488 VanDerWaalsContact O-CG1 3.28Å; K484-I488 WeakPolarHBondContact O-CG1 3.33Å; K484-I488 PolarHBondContact O-N 2.81Å; I485-I488 PolarHBondContact O-N 3.29Å; I488-S490 VanDerWaalsContact C-N 3.33Å; I488-S490 PolarHBondContact O-N 2.95Å; I488-F491 WeakPolarHBondContact O-CB 3.38Å; I488-F491 PolarHBondContact O-N 2.88Å; I488-C492 PolarHBondContact O-N 3.49Å; I488-C492 PolarHBondContact O-SG 3.33Å
489	H	96.8	Very high	92.6	Very high	23 Å²	23	36.6 Å²	36.6	11%	0.106	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-44.5	176.9	-165.3	162.9	0	0	0	110.7	R143 I144 F412 I485 F491 C492 L493	R143-H489 PolarHBondContact NH1-CE1 2.89Å; R143-H489 PolarHBondContact NH2-CE1 2.83Å; R143-H489 PolarHBondContact NH2-NE2 3.3Å; I144-H489 HydrophobicContact CD1-CB 4.15Å; I144-H489 VanDerWaalsContact CD1-CD2 3.41Å; I144-H489 WeakPolarHBondContact CD1-CD2 3.33Å; F412-H489 HydrophobicContact CE1-CB 3.83Å; F412-H489 AromaticContact CE1-CD2 3.9Å; F412-H489 AromaticContact CE1-CE1 3.81Å; F412-H489 AromaticContact CE1-CG 3.48Å; F412-H489 VanDerWaalsContact CE1-CG 3.48Å; F412-H489 AromaticContact CE1-ND1 3.45Å; F412-H489 WeakPolarHBondContact CE1-ND1 3.48Å; F412-H489 HydrophobicContact CE2-CB 4.1Å; F412-H489 HydrophobicContact CZ-CB 3.56Å; F412-H489 AromaticContact CZ-CG 3.73Å; F412-H489 AromaticContact CZ-ND1 3.76Å; I485-H489 VanDerWaalsContact O-CB 3.29Å; I485-H489 WeakPolarHBondContact O-CB 3.29Å; I485-H489 PolarHBondContact O-N 3.39Å; H489-F491 VanDerWaalsContact C-N 3.32Å; H489-F491 PolarHBondContact O-N 2.84Å; H489-C492 WeakPolarHBondContact O-CB 3.44Å; H489-C492 PolarHBondContact O-N 3.4Å; H489-C492 VanDerWaalsContact O-N 3.15Å; H489-L493 PolarHBondContact O-N 3.15Å
490	S	97.4	Very high	93.8	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-56.8	-45.1	175.8	-66.9	0	0	0	0	112	Y90 I144 T486 L487 I488 L493 L494	Y90-S490 PolarHBondContact OH-O 3.02Å; I144-S490 WeakPolarHBondContact CG2-OG 3.37Å; T486-S490 WeakPolarHBondContact O-CB 3.29Å; T486-S490 PolarHBondContact O-N 3.49Å; T486-S490 PolarHBondContact O-OG 3.36Å; L487-S490 WeakPolarHBondContact O-CB 3.28Å; L487-S490 PolarHBondContact O-N 3.15Å; I488-S490 VanDerWaalsContact C-N 3.33Å; I488-S490 PolarHBondContact O-N 2.95Å; S490-L493 PolarHBondContact O-N 3.15Å; S490-L494 VanDerWaalsContact O-CG 3.29Å; S490-L494 WeakPolarHBondContact O-CG 3.11Å; S490-L494 PolarHBondContact O-N 3.23Å
491	F	97	Very high	94.6	Very high	126 Å²	126	34.2 Å²	34.2	55%	0.553	17%	0.171	S	C	*	.	H	α-helix	trans	-60.4	-44.9	175	173.8	-96.8	0	0	0	112.2	L487 I488 H489 L493 L494 C495	L487-F491 WeakPolarHBondContact O-CB 3.43Å; L487-F491 PolarHBondContact O-N 3.35Å; I488-F491 WeakPolarHBondContact O-CB 3.38Å; I488-F491 PolarHBondContact O-N 2.88Å; H489-F491 VanDerWaalsContact C-N 3.32Å; H489-F491 PolarHBondContact O-N 2.84Å; F491-L493 VanDerWaalsContact C-N 3.34Å; F491-L493 PolarHBondContact O-N 3.48Å; F491-L494 WeakPolarHBondContact O-CB 3.32Å; F491-L494 PolarHBondContact O-N 3.42Å; F491-L494 VanDerWaalsContact O-N 3.17Å; F491-C495 PolarHBondContact O-N 3.48Å; F491-C495 PolarHBondContact O-SG 3.18Å; F491-C495 VanDerWaalsContact O-SG 3.37Å
492	C	97.4	Very high	94.9	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.034	16%	0.162	C	C	.	.	H	α-helix	trans	-60.2	-43	178.3	-63.6	0	0	0	0	112.3	P408 L409 I488 H489 C495 V496	P408-C492 HydrophobicContact CB-CB 4.26Å; L409-C492 HydrophobicContact CB-CB 4.12Å; L409-C492 HydrophobicContact CD1-CB 4.17Å; I488-C492 PolarHBondContact O-N 3.49Å; I488-C492 PolarHBondContact O-SG 3.33Å; H489-C492 WeakPolarHBondContact O-CB 3.44Å; H489-C492 PolarHBondContact O-N 3.4Å; H489-C492 VanDerWaalsContact O-N 3.15Å; C492-C495 WeakPolarHBondContact O-CB 3.47Å; C492-C495 PolarHBondContact O-N 3.03Å; C492-V496 PolarHBondContact O-N 2.86Å; C492-V496 VanDerWaalsContact O-N 3.15Å
493	L	96.3	Very high	95	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-70.7	-31.4	176	-75.8	-162.9	0	0	0	113.1	Y90 N140 I144 Q165 L409 H489 S490 F491 V496 L497	Y90-L493 WeakPolarHBondContact OH-CB 3.48Å; N140-L493 HydrophobicContact CB-CD1 3.78Å; I144-L493 HydrophobicContact CD1-CD1 3.28Å; I144-L493 HydrophobicContact CD1-CG 4Å; I144-L493 HydrophobicContact CG1-CD1 4.49Å; Q165-L493 VanDerWaalsContact NE2-CD2 3.33Å; L409-L493 HydrophobicContact CD1-CD2 4.02Å; L409-L493 HydrophobicContact CD2-CD2 4.02Å; H489-L493 PolarHBondContact O-N 3.15Å; S490-L493 PolarHBondContact O-N 3.15Å; F491-L493 VanDerWaalsContact C-N 3.34Å; F491-L493 PolarHBondContact O-N 3.48Å; L493-V496 WeakPolarHBondContact O-CB 3.47Å; L493-V496 PolarHBondContact O-N 2.89Å; L493-L497 PolarHBondContact O-N 3.03Å
494	L	97.3	Very high	94.8	Very high	26 Å²	26	29.7 Å²	29.7	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-62.8	-43.2	170	-74.3	171	0	0	0	110.9	L86 I89 Y90 M93 S490 F491 V496 L497 V498	L86-L494 HydrophobicContact CD1-CD1 4.44Å; I89-L494 HydrophobicContact CG2-CD1 4.21Å; I89-L494 HydrophobicContact CG2-CD2 3.59Å; Y90-L494 HydrophobicContact CD2-CD2 3.51Å; Y90-L494 HydrophobicContact CD2-CG 4.06Å; Y90-L494 HydrophobicContact CE2-CD1 4.06Å; Y90-L494 HydrophobicContact CE2-CD2 3.43Å; Y90-L494 VanDerWaalsContact CE2-CD2 3.43Å; Y90-L494 HydrophobicContact CE2-CG 3.47Å; Y90-L494 VanDerWaalsContact CE2-CG 3.47Å; Y90-L494 HydrophobicContact CG-CD2 4.18Å; M93-L494 HydrophobicContact SD-CD2 3.61Å; S490-L494 VanDerWaalsContact O-CG 3.29Å; S490-L494 WeakPolarHBondContact O-CG 3.11Å; S490-L494 PolarHBondContact O-N 3.23Å; F491-L494 WeakPolarHBondContact O-CB 3.32Å; F491-L494 PolarHBondContact O-N 3.42Å; F491-L494 VanDerWaalsContact O-N 3.17Å; L494-V496 VanDerWaalsContact C-N 3.27Å; L494-V496 PolarHBondContact O-N 2.96Å; L494-L497 HydrophobicContact CD2-CD1 4.38Å; L494-L497 WeakPolarHBondContact O-CB 3.32Å; L494-L497 PolarHBondContact O-N 3.4Å; L494-L497 VanDerWaalsContact O-N 3.1Å; L494-V498 WeakPolarHBondContact O-CG2 3.38Å; L494-V498 PolarHBondContact O-N 3.42Å
495	C	96.5	Very high	94.7	Very high	23 Å²	23	27.6 Å²	27.6	16%	0.155	15%	0.15	C	C	.	.	H	α-helix	trans	-56.7	-42.9	172.8	-64.9	0	0	0	0	111.4	A405 P408 F491 C492 L497 V498	A405-C495 VanDerWaalsContact CB-O 3.26Å; A405-C495 WeakPolarHBondContact CB-O 3.08Å; A405-C495 CarbonylContact O-C 2.94Å; A405-C495 VanDerWaalsContact O-CB 3.24Å; A405-C495 WeakPolarHBondContact O-CB 3.29Å; P408-C495 HydrophobicContact CG-CB 4.35Å; F491-C495 PolarHBondContact O-N 3.48Å; F491-C495 PolarHBondContact O-SG 3.18Å; F491-C495 VanDerWaalsContact O-SG 3.37Å; C492-C495 WeakPolarHBondContact O-CB 3.47Å; C492-C495 PolarHBondContact O-N 3.03Å; C495-L497 PolarHBondContact O-N 2.96Å; C495-V498 WeakPolarHBondContact O-CB 3.31Å; C495-V498 PolarHBondContact O-N 2.99Å; C495-V498 VanDerWaalsContact O-N 3.14Å
496	V	95	Very high	94.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.9	-46.6	174	168.3	0	0	0	0	111.6	L132 A405 W406 L409 C492 L493 L494 V498 S499	L132-V496 HydrophobicContact CD1-CG1 4.4Å; L132-V496 HydrophobicContact CD2-CG1 3.94Å; A405-V496 PolarHBondContact O-N 2.88Å; W406-V496 HydrophobicContact CD2-CB 4.48Å; W406-V496 HydrophobicContact CD2-CG1 4.15Å; W406-V496 HydrophobicContact CD2-CG2 3.72Å; W406-V496 HydrophobicContact CE3-CG1 4.22Å; W406-V496 HydrophobicContact CE3-CG2 3.61Å; W406-V496 HydrophobicContact CG-CG2 4.23Å; W406-V496 HydrophobicContact CH2-CG1 3.55Å; W406-V496 HydrophobicContact CH2-CG2 4.43Å; W406-V496 HydrophobicContact CZ2-CG1 3.42Å; W406-V496 VanDerWaalsContact CZ2-CG1 3.42Å; W406-V496 HydrophobicContact CZ3-CG1 3.94Å; W406-V496 HydrophobicContact CZ3-CG2 3.98Å; L409-V496 HydrophobicContact CB-CG2 4.28Å; L409-V496 HydrophobicContact CD2-CG2 3.96Å; C492-V496 PolarHBondContact O-N 2.86Å; C492-V496 VanDerWaalsContact O-N 3.15Å; L493-V496 WeakPolarHBondContact O-CB 3.47Å; L493-V496 PolarHBondContact O-N 2.89Å; L494-V496 VanDerWaalsContact C-N 3.27Å; L494-V496 PolarHBondContact O-N 2.96Å; V496-V498 VanDerWaalsContact C-N 3.27Å; V496-V498 PolarHBondContact O-N 3.49Å; V496-S499 WeakPolarHBondContact O-CB 3.4Å; V496-S499 PolarHBondContact O-N 3.14Å; V496-S499 VanDerWaalsContact O-N 3.11Å; V496-S499 PolarHBondContact O-OG 3.44Å
497	L	95.9	Very high	94.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-33	175.5	-85.6	166.1	0	0	0	113	Y90 M93 I94 Q137 L493 L494 C495 S499 A500 C501	Y90-L497 HydrophobicContact CD1-CD1 3.79Å; Y90-L497 HydrophobicContact CE1-CD1 3.88Å; Y90-L497 HydrophobicContact CG-CD1 4.45Å; M93-L497 HydrophobicContact CB-CB 4.32Å; M93-L497 HydrophobicContact CB-CD1 4.26Å; M93-L497 HydrophobicContact CE-CB 3.57Å; M93-L497 HydrophobicContact SD-CB 4.23Å; I94-L497 HydrophobicContact CG1-CD1 4.4Å; I94-L497 HydrophobicContact CG1-CD2 4.08Å; Q137-L497 HydrophobicContact CB-CD2 4.27Å; Q137-L497 HydrophobicContact CG-CD1 4.34Å; Q137-L497 HydrophobicContact CG-CD2 3.75Å; Q137-L497 HydrophobicContact CG-CG 3.96Å; L493-L497 PolarHBondContact O-N 3.03Å; L494-L497 HydrophobicContact CD2-CD1 4.38Å; L494-L497 WeakPolarHBondContact O-CB 3.32Å; L494-L497 PolarHBondContact O-N 3.4Å; L494-L497 VanDerWaalsContact O-N 3.1Å; C495-L497 PolarHBondContact O-N 2.96Å; L497-S499 PolarHBondContact O-N 3.03Å; L497-A500 PolarHBondContact O-N 3.24Å; L497-C501 PolarHBondContact O-N 3.34Å; L497-C501 PolarHBondContact O-SG 2.88Å
498	V	95.2	Very high	93.4	Very high	62 Å²	62	24.6 Å²	24.6	38%	0.376	14%	0.137	S	C	.	.	H	α-helix	trans	-56.9	-37.8	175.5	174.4	0	0	0	0	111	M93 L401 L494 C495 V496 C501 A502	M93-V498 HydrophobicContact CE-CB 4.2Å; M93-V498 HydrophobicContact CE-CG2 3.5Å; M93-V498 VanDerWaalsContact CE-N 3.3Å; L401-V498 HydrophobicContact CD1-CG1 4.42Å; L494-V498 WeakPolarHBondContact O-CG2 3.38Å; L494-V498 PolarHBondContact O-N 3.42Å; C495-V498 WeakPolarHBondContact O-CB 3.31Å; C495-V498 PolarHBondContact O-N 2.99Å; C495-V498 VanDerWaalsContact O-N 3.14Å; V496-V498 VanDerWaalsContact C-N 3.27Å; V496-V498 PolarHBondContact O-N 3.49Å; V498-C501 PolarHBondContact O-N 2.67Å; V498-A502 VanDerWaalsContact O-CB 3.27Å; V498-A502 WeakPolarHBondContact O-CB 3.31Å; V498-A502 PolarHBondContact O-N 3.4Å
499	S	91.6	Very high	92.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-43.3	178.8	71	0	0	0	0	112.6	W406 V496 L497 A502 N503	W406-S499 PolarHBondContact NE1-OG 3.45Å; V496-S499 WeakPolarHBondContact O-CB 3.4Å; V496-S499 PolarHBondContact O-N 3.14Å; V496-S499 VanDerWaalsContact O-N 3.11Å; V496-S499 PolarHBondContact O-OG 3.44Å; L497-S499 PolarHBondContact O-N 3.03Å; S499-A502 PolarHBondContact O-N 2.88Å; S499-N503 PolarHBondContact O-N 2.8Å; S499-N503 PolarHBondContact O-ND2 3.36Å; S499-N503 PolarHBondContact O-OD1 2.97Å
500	A	93.9	Very high	91.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.4	-38.1	176.4	0	0	0	0	0	112.2	D129 L132 L497 P504	D129-A500 HydrophobicContact CB-CB 4Å; L132-A500 HydrophobicContact CD2-CB 4.26Å; L497-A500 PolarHBondContact O-N 3.24Å; A500-P504 WeakPolarHBondContact O-CD 3.32Å
501	C	95.1	Very high	90.7	Very high	12 Å²	12	30.7 Å²	30.7	8%	0.081	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-40.9	176.8	-70	0	0	0	0	112.7	M93 F96 L497 V498	M93-C501 PolarHBondContact O-SG 2.85Å; F96-C501 HydrophobicContact CD1-CB 3.6Å; F96-C501 HydrophobicContact CE1-CB 3.92Å; F96-C501 VanDerWaalsContact CE1-O 3.27Å; F96-C501 WeakPolarHBondContact CE1-O 3.3Å; L497-C501 PolarHBondContact O-N 3.34Å; L497-C501 PolarHBondContact O-SG 2.88Å; V498-C501 PolarHBondContact O-N 2.67Å
502	A	93.1	Very high	90	Very high	22 Å²	22	28.9 Å²	28.9	18%	0.182	15%	0.149	C	C	.	.	H	α-helix	trans	-77.3	-29.6	-173.9	0	0	0	0	0	113.4	L401 V498 S499 V505 L506	L401-A502 HydrophobicContact CD2-CB 3.12Å; V498-A502 VanDerWaalsContact O-CB 3.27Å; V498-A502 WeakPolarHBondContact O-CB 3.31Å; V498-A502 PolarHBondContact O-N 3.4Å; S499-A502 PolarHBondContact O-N 2.88Å; A502-V505 WeakPolarHBondContact O-CB 3.27Å; A502-V505 PolarHBondContact O-N 3.17Å; A502-V505 VanDerWaalsContact O-N 3.15Å; A502-L506 HydrophobicContact CB-CD1 4.23Å; A502-L506 WeakPolarHBondContact O-CB 3.4Å; A502-L506 VanDerWaalsContact O-CG 3.26Å; A502-L506 WeakPolarHBondContact O-CG 3.38Å; A502-L506 PolarHBondContact O-N 3.24Å
503	N	91	Very high	89.4	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.027	17%	0.172	C	C	.	.	H	α-helix	trans	-52.5	-54.7	-177.9	-79.4	-13.9	0	0	0	112.8	D129 S499 V505 L506 Y507	D129-N503 PolarHBondContact OD2-ND2 3.26Å; S499-N503 PolarHBondContact O-N 2.8Å; S499-N503 PolarHBondContact O-ND2 3.36Å; S499-N503 PolarHBondContact O-OD1 2.97Å; N503-V505 VanDerWaalsContact C-N 3.33Å; N503-V505 PolarHBondContact O-N 3.2Å; N503-L506 PolarHBondContact O-N 2.95Å; N503-Y507 HydrophobicContact CB-CE2 3.95Å; N503-Y507 WeakPolarHBondContact O-CD2 3.3Å; N503-Y507 PolarHBondContact O-N 2.04Å
504	P	89.8	Confident	88.9	Confident	9 Å²	9	33.1 Å²	33.1	6%	0.058	17%	0.172	C	C	.	.	H	α-helix	trans	-57.7	-40.1	176	-26.7	35.7	0	0	0	114.2	G100 V104 A500 Y507 G508	G100-P504 VanDerWaalsContact CA-CG 3.47Å; G100-P504 WeakPolarHBondContact O-CG 3.37Å; V104-P504 HydrophobicContact CG2-CB 4.16Å; V104-P504 HydrophobicContact CG2-CG 4.4Å; A500-P504 WeakPolarHBondContact O-CD 3.32Å; P504-Y507 PolarHBondContact O-N 3.32Å; P504-G508 PolarHBondContact O-N 3.49Å
505	V	89.1	Confident	88.4	Confident	72 Å²	72	34.4 Å²	34.4	44%	0.436	18%	0.177	S	C	.	.	H	α-helix	trans	-64	-45.1	177.7	178.7	0	0	0	0	110.3	F96 A502 N503 G508 W509	F96-V505 HydrophobicContact CE1-CG2 4.03Å; F96-V505 HydrophobicContact CZ-CG2 3.69Å; A502-V505 WeakPolarHBondContact O-CB 3.27Å; A502-V505 PolarHBondContact O-N 3.17Å; A502-V505 VanDerWaalsContact O-N 3.15Å; N503-V505 VanDerWaalsContact C-N 3.33Å; N503-V505 PolarHBondContact O-N 3.2Å; V505-G508 PolarHBondContact O-N 2.91Å; V505-W509 VanDerWaalsContact O-CB 3.3Å; V505-W509 WeakPolarHBondContact O-CB 3.23Å; V505-W509 PolarHBondContact O-N 2.86Å
506	L	87.8	Confident	88	Confident	26 Å²	26	41 Å²	41	14%	0.136	20%	0.199	C	C	.	.	H	α-helix	trans	-62.5	-45.5	178.3	-74.1	172.3	0	0	0	111	L394 I398 L401 A502 N503 W509 L510	L394-L506 VanDerWaalsContact CD1-C 3.43Å; L394-L506 HydrophobicContact CD1-CB 3.51Å; L394-L506 HydrophobicContact CD1-CD2 4.3Å; L394-L506 HydrophobicContact CD1-CG 4.44Å; L394-L506 WeakPolarHBondContact CD1-O 3.46Å; I398-L506 HydrophobicContact CB-CD1 4.42Å; I398-L506 HydrophobicContact CD1-CB 4.18Å; I398-L506 HydrophobicContact CG1-CB 3.92Å; I398-L506 HydrophobicContact CG1-CD1 3.5Å; I398-L506 HydrophobicContact CG1-CG 4.3Å; L401-L506 HydrophobicContact CD2-CD1 4.13Å; A502-L506 HydrophobicContact CB-CD1 4.23Å; A502-L506 WeakPolarHBondContact O-CB 3.4Å; A502-L506 VanDerWaalsContact O-CG 3.26Å; A502-L506 WeakPolarHBondContact O-CG 3.38Å; A502-L506 PolarHBondContact O-N 3.24Å; N503-L506 PolarHBondContact O-N 2.95Å; L506-W509 PolarHBondContact O-N 3.37Å; L506-L510 HydrophobicContact CD2-CD1 4.33Å; L506-L510 PolarHBondContact O-N 3.22Å
507	Y	86.5	Confident	87.6	Confident	3 Å²	3	41.5 Å²	41.5	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-46.7	173.4	-61	-49.3	0	0	0	112.2	V104 I122 L125 I398 N503 P504 W509 N511	V104-Y507 HydrophobicContact CG1-CD2 4.38Å; V104-Y507 HydrophobicContact CG2-CD2 3.88Å; I122-Y507 HydrophobicContact CD1-CD1 4.45Å; I122-Y507 HydrophobicContact CD1-CE1 4.16Å; I122-Y507 HydrophobicContact CG1-CE1 4.14Å; I122-Y507 HydrophobicContact CG2-CD1 4.29Å; I122-Y507 HydrophobicContact CG2-CD2 4.19Å; I122-Y507 HydrophobicContact CG2-CE1 3.93Å; I122-Y507 HydrophobicContact CG2-CE2 3.85Å; I122-Y507 HydrophobicContact CG2-CG 4.43Å; L125-Y507 WeakPolarHBondContact CD2-OH 3.02Å; I398-Y507 HydrophobicContact CD1-CD1 4.01Å; I398-Y507 HydrophobicContact CD1-CE1 3.41Å; I398-Y507 VanDerWaalsContact CD1-CE1 3.41Å; N503-Y507 HydrophobicContact CB-CE2 3.95Å; N503-Y507 WeakPolarHBondContact O-CD2 3.3Å; N503-Y507 PolarHBondContact O-N 2.04Å; P504-Y507 PolarHBondContact O-N 3.32Å; Y507-W509 VanDerWaalsContact C-N 3.29Å; Y507-W509 PolarHBondContact O-N 3.25Å; Y507-N511 VanDerWaalsContact O-CB 3.23Å; Y507-N511 WeakPolarHBondContact O-CB 2.97Å; Y507-N511 PolarHBondContact O-N 2.86Å; Y507-N511 VanDerWaalsContact O-N 3.1Å
508	G	82.7	Confident	87.1	Confident	8 Å²	8	42.1 Å²	42.1	8%	0.082	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-28.6	-178.7	0	0	0	0	0	114.1	P504 V505 H515 F518	P504-G508 PolarHBondContact O-N 3.49Å; V505-G508 PolarHBondContact O-N 2.91Å; G508-H515 VanDerWaalsContact O-CA 3.25Å; G508-H515 WeakPolarHBondContact O-CA 3.49Å; G508-H515 WeakPolarHBondContact O-CB 3.34Å; G508-H515 VanDerWaalsContact O-CG 3.27Å; G508-H515 PolarHBondContact O-ND1 3.39Å; G508-F518 VanDerWaalsContact CA-CD2 3.41Å; G508-F518 VanDerWaalsContact CA-CE2 3.43Å
509	W	79.8	Confident	86.6	Confident	190 Å²	190	42 Å²	42	72%	0.72	20%	0.2	S	C	*	.	H	α-helix	trans	-94.6	-41.3	-177	-171.6	32.2	0	0	0	113.7	V505 L506 Y507	V505-W509 VanDerWaalsContact O-CB 3.3Å; V505-W509 WeakPolarHBondContact O-CB 3.23Å; V505-W509 PolarHBondContact O-N 2.86Å; L506-W509 PolarHBondContact O-N 3.37Å; Y507-W509 VanDerWaalsContact C-N 3.29Å; Y507-W509 PolarHBondContact O-N 3.25Å
510	L	73.2	Confident	86.3	Confident	42 Å²	42	46.5 Å²	46.5	22%	0.22	22%	0.224	C	C	.	.	H	α-helix	trans	-107.7	-11.1	-171	-58.8	171.5	0	0	0	113.9	L394 L506	L394-L510 HydrophobicContact CB-CB 3.57Å; L394-L510 HydrophobicContact CB-CD1 3.68Å; L394-L510 HydrophobicContact CB-CG 4.25Å; L394-L510 HydrophobicContact CD1-CB 3.84Å; L394-L510 HydrophobicContact CD1-CD1 3.76Å; L394-L510 HydrophobicContact CD1-CG 4.28Å; L394-L510 HydrophobicContact CD2-CB 3.76Å; L394-L510 HydrophobicContact CG-CB 3.88Å; L394-L510 HydrophobicContact CG-CD1 4.27Å; L506-L510 HydrophobicContact CD2-CD1 4.33Å; L506-L510 PolarHBondContact O-N 3.22Å
511	N	81.6	Confident	85.8	Confident	13 Å²	13	48.7 Å²	48.7	7%	0.07	24%	0.235	C	C	.	.			trans	-101.9	101.8	172.7	-169.8	-28	0	0	0	110.5	L394 Y507 N513 F514 H515	L394-N511 HydrophobicContact CD2-CB 3.88Å; Y507-N511 VanDerWaalsContact O-CB 3.23Å; Y507-N511 WeakPolarHBondContact O-CB 2.97Å; Y507-N511 PolarHBondContact O-N 2.86Å; Y507-N511 VanDerWaalsContact O-N 3.1Å; N511-N513 PolarHBondContact O-N 3.18Å; N511-N513 PolarHBondContact OD1-N 3.12Å; N511-F514 HydrophobicContact CB-CB 4.35Å; N511-F514 HydrophobicContact CB-CD2 4.02Å; N511-F514 WeakPolarHBondContact ND2-CD2 3.43Å; N511-F514 PolarHBondContact O-N 3.48Å; N511-H515 WeakPolarHBondContact O-CB 3.19Å; N511-H515 PolarHBondContact O-N 2.83Å
512	E	80.8	Confident	85.3	Confident	87 Å²	87	52.3 Å²	52.3	41%	0.407	25%	0.249	S	C	.	.	H	α-helix	trans	-48.2	-35.6	-178	-61.7	-85.1	173.4	0	0	113.7	R390 R516	R390-E512 IonicContact NH1-OE1 3.45Å; R390-E512 PolarHBondContact NH1-OE1 2.98Å; E512-R516 WeakPolarHBondContact O-CB 3.3Å; E512-R516 PolarHBondContact O-N 2.96Å
513	N	85.7	Confident	84.4	Confident	94 Å²	94	55.2 Å²	55.2	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-70.3	-45.3	179.4	-68.6	-26.7	0	0	0	111.9	M114 N511 E517	M114-N513 HydrophobicContact CE-CB 4.17Å; N511-N513 PolarHBondContact O-N 3.18Å; N511-N513 PolarHBondContact OD1-N 3.12Å; N513-E517 WeakPolarHBondContact O-CG 3.36Å; N513-E517 PolarHBondContact O-N 3.29Å
514	F	86.1	Confident	83.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.7	-42.6	175.3	-78.6	-85.6	0	0	0	110.9	V104 T107 V108 M114 I122 N511 R516 E517 F518	V104-F514 HydrophobicContact CG1-CE1 3.9Å; V104-F514 HydrophobicContact CG1-CZ 4.28Å; T107-F514 HydrophobicContact CG2-CD1 4Å; T107-F514 HydrophobicContact CG2-CE1 4.28Å; V108-F514 HydrophobicContact CG2-CE1 3.65Å; V108-F514 HydrophobicContact CG2-CZ 3.49Å; V108-F514 VanDerWaalsContact CG2-CZ 3.49Å; M114-F514 HydrophobicContact CE-CD1 3.79Å; M114-F514 HydrophobicContact CE-CD2 3.74Å; M114-F514 HydrophobicContact CE-CE1 3.73Å; M114-F514 HydrophobicContact CE-CE2 3.71Å; M114-F514 HydrophobicContact CE-CG 3.81Å; M114-F514 HydrophobicContact CE-CZ 3.71Å; I122-F514 HydrophobicContact CD1-CE2 4.06Å; I122-F514 HydrophobicContact CG2-CE2 4.37Å; I122-F514 HydrophobicContact CG2-CZ 3.96Å; N511-F514 HydrophobicContact CB-CB 4.35Å; N511-F514 HydrophobicContact CB-CD2 4.02Å; N511-F514 WeakPolarHBondContact ND2-CD2 3.43Å; N511-F514 PolarHBondContact O-N 3.48Å; F514-R516 VanDerWaalsContact C-N 3.32Å; F514-R516 PolarHBondContact O-N 3.42Å; F514-E517 PolarHBondContact O-N 3.26Å; F514-E517 VanDerWaalsContact O-N 3.12Å; F514-F518 HydrophobicContact CB-CZ 4.45Å; F514-F518 HydrophobicContact CD1-CE1 4.03Å; F514-F518 HydrophobicContact CD1-CZ 4.1Å; F514-F518 WeakPolarHBondContact O-CB 3.42Å; F514-F518 WeakPolarHBondContact O-CD1 3.25Å; F514-F518 VanDerWaalsContact O-CG 3.32Å; F514-F518 WeakPolarHBondContact O-CG 3.16Å; F514-F518 PolarHBondContact O-N 3.33Å
515	H	86.5	Confident	82.8	Confident	53 Å²	53	69.7 Å²	69.7	25%	0.245	34%	0.339	C	S	.	.	H	α-helix	trans	-52.6	-50.4	177.7	-174.7	48.7	0	0	0	111.8	G508 N511 E517 F518 I519	G508-H515 VanDerWaalsContact O-CA 3.25Å; G508-H515 WeakPolarHBondContact O-CA 3.49Å; G508-H515 WeakPolarHBondContact O-CB 3.34Å; G508-H515 VanDerWaalsContact O-CG 3.27Å; G508-H515 PolarHBondContact O-ND1 3.39Å; N511-H515 WeakPolarHBondContact O-CB 3.19Å; N511-H515 PolarHBondContact O-N 2.83Å; H515-E517 PolarHBondContact O-N 3.38Å; H515-F518 PolarHBondContact O-N 3.28Å; H515-I519 WeakPolarHBondContact NE2-CD1 3.37Å; H515-I519 VanDerWaalsContact O-CG1 3.32Å; H515-I519 WeakPolarHBondContact O-CG1 3.21Å; H515-I519 PolarHBondContact O-N 3.47Å
516	R	86.8	Confident	81.6	Confident	163 Å²	163	70.5 Å²	70.5	62%	0.615	34%	0.337	S	S	*	.	H	α-helix	trans	-59.4	-46.6	177.4	178.4	-174.3	154.5	-162.8	-3.7	112.1	E512 F514 I519 L520	E512-R516 WeakPolarHBondContact O-CB 3.3Å; E512-R516 PolarHBondContact O-N 2.96Å; F514-R516 VanDerWaalsContact C-N 3.32Å; F514-R516 PolarHBondContact O-N 3.42Å; R516-I519 PolarHBondContact O-N 2.71Å; R516-L520 HydrophobicContact CG-CD1 4.35Å; R516-L520 VanDerWaalsContact O-CG 3.32Å; R516-L520 WeakPolarHBondContact O-CG 3.3Å; R516-L520 PolarHBondContact O-N 2.94Å
517	E	87	Confident	80.2	Confident	10 Å²	10	79.2 Å²	79.2	5%	0.047	37%	0.368	C	S	.	.	H	α-helix	trans	-68.5	-35.6	-179	-68.1	-62.6	140.7	0	0	112.1	T107 R110 K111 M114 N513 F514 H515 L520 M521	T107-E517 HydrophobicContact CG2-CB 3.51Å; T107-E517 HydrophobicContact CG2-CG 3.94Å; R110-E517 IonicContact NH1-OE2 2.7Å; R110-E517 PolarHBondContact NH1-OE2 3.46Å; K111-E517 VanDerWaalsContact CE-OE1 3.3Å; K111-E517 WeakPolarHBondContact CE-OE1 3.45Å; K111-E517 WeakPolarHBondContact CE-OE2 3.33Å; K111-E517 HydrophobicContact CG-CG 4.2Å; K111-E517 WeakPolarHBondContact CG-OE2 3.43Å; K111-E517 IonicContact NZ-OE2 3.46Å; M114-E517 HydrophobicContact SD-CG 3.88Å; N513-E517 WeakPolarHBondContact O-CG 3.36Å; N513-E517 PolarHBondContact O-N 3.29Å; F514-E517 PolarHBondContact O-N 3.26Å; F514-E517 VanDerWaalsContact O-N 3.12Å; H515-E517 PolarHBondContact O-N 3.38Å; E517-L520 PolarHBondContact O-N 2.86Å; E517-M521 WeakPolarHBondContact O-CG 3.46Å; E517-M521 PolarHBondContact O-N 3.46Å
518	F	86.7	Confident	78.4	Confident	12 Å²	12	83.1 Å²	83.1	5%	0.053	40%	0.395	C	S	.	.	H	α-helix	trans	-65.6	-41.2	174.5	-70.7	3.4	0	0	0	111.6	L103 V104 T107 G508 F514 H515 L520 M521 F522 F526	L103-F518 HydrophobicContact CD1-CD1 4.39Å; L103-F518 HydrophobicContact CD1-CE1 4.33Å; L103-F518 HydrophobicContact CD2-CD1 3.83Å; L103-F518 HydrophobicContact CD2-CD2 4.16Å; L103-F518 HydrophobicContact CD2-CE1 3.7Å; L103-F518 HydrophobicContact CD2-CE2 4.01Å; L103-F518 HydrophobicContact CD2-CG 4.08Å; L103-F518 HydrophobicContact CD2-CZ 3.78Å; L103-F518 HydrophobicContact CG-CD1 3.96Å; L103-F518 HydrophobicContact CG-CE1 3.55Å; L103-F518 HydrophobicContact CG-CZ 3.93Å; V104-F518 HydrophobicContact CG2-CZ 4.04Å; T107-F518 HydrophobicContact CG2-CE1 4.42Å; T107-F518 WeakPolarHBondContact OG1-CE1 3.43Å; G508-F518 VanDerWaalsContact CA-CD2 3.41Å; G508-F518 VanDerWaalsContact CA-CE2 3.43Å; F514-F518 HydrophobicContact CB-CZ 4.45Å; F514-F518 HydrophobicContact CD1-CE1 4.03Å; F514-F518 HydrophobicContact CD1-CZ 4.1Å; F514-F518 WeakPolarHBondContact O-CB 3.42Å; F514-F518 WeakPolarHBondContact O-CD1 3.25Å; F514-F518 VanDerWaalsContact O-CG 3.32Å; F514-F518 WeakPolarHBondContact O-CG 3.16Å; F514-F518 PolarHBondContact O-N 3.33Å; H515-F518 PolarHBondContact O-N 3.28Å; F518-L520 VanDerWaalsContact C-N 3.3Å; F518-L520 PolarHBondContact O-N 2.86Å; F518-M521 PolarHBondContact O-N 2.77Å; F518-F522 WeakPolarHBondContact O-CD2 3.24Å; F518-F522 PolarHBondContact O-N 3.29Å; F518-F526 HydrophobicContact CB-CE2 4.45Å
519	I	84.9	Confident	76.4	Confident	60 Å²	60	92.9 Å²	92.9	31%	0.308	44%	0.435	S	S	.	.	H	α-helix	trans	-58.9	-43.5	172.3	-69.8	166.9	0	0	0	110.8	H515 R516 M521 F522 P523 F526	H515-I519 WeakPolarHBondContact NE2-CD1 3.37Å; H515-I519 VanDerWaalsContact O-CG1 3.32Å; H515-I519 WeakPolarHBondContact O-CG1 3.21Å; H515-I519 PolarHBondContact O-N 3.47Å; R516-I519 PolarHBondContact O-N 2.71Å; I519-M521 VanDerWaalsContact C-N 3.28Å; I519-M521 PolarHBondContact O-N 3.32Å; I519-F522 CarbonylContact O-C 3.45Å; I519-F522 VanDerWaalsContact O-C 3.32Å; I519-F522 PolarHBondContact O-N 3.5Å; I519-P523 WeakPolarHBondContact O-CA 3.41Å; I519-P523 VanDerWaalsContact O-N 3.16Å; I519-F526 HydrophobicContact CB-CB 4.33Å; I519-F526 HydrophobicContact CB-CD2 4.39Å; I519-F526 HydrophobicContact CB-CG 4.4Å; I519-F526 HydrophobicContact CG1-CB 3.79Å; I519-F526 HydrophobicContact CG1-CD1 3.95Å; I519-F526 HydrophobicContact CG1-CD2 3.94Å; I519-F526 HydrophobicContact CG1-CG 3.62Å; I519-F526 HydrophobicContact CG2-CB 4.14Å
520	L	84.5	Confident	74.6	Confident	96 Å²	96	92.5 Å²	92.5	50%	0.503	44%	0.439	S	S	.	.	H	α-helix	trans	-66.4	-29.5	179.1	-70.4	173.5	0	0	0	112.9	R516 E517 F518	R516-L520 HydrophobicContact CG-CD1 4.35Å; R516-L520 VanDerWaalsContact O-CG 3.32Å; R516-L520 WeakPolarHBondContact O-CG 3.3Å; R516-L520 PolarHBondContact O-N 2.94Å; E517-L520 PolarHBondContact O-N 2.86Å; F518-L520 VanDerWaalsContact C-N 3.3Å; F518-L520 PolarHBondContact O-N 2.86Å
521	M	83.8	Confident	72.5	Confident	45 Å²	45	98.3 Å²	98.3	22%	0.222	47%	0.465	C	S	.	.	H	α-helix	trans	-81	-33.6	176	-68.7	-178	-162.1	0	0	112.4	L103 Y106 T107 E517 F518 I519 P523	L103-M521 HydrophobicContact CD1-SD 3.48Å; L103-M521 WeakPolarHBondContact CD1-SD 3.14Å; Y106-M521 HydrophobicContact CD1-CE 3.6Å; Y106-M521 HydrophobicContact CD1-SD 3.79Å; Y106-M521 HydrophobicContact CE1-CE 3.52Å; Y106-M521 HydrophobicContact CE1-SD 3.77Å; T107-M521 HydrophobicContact CG2-CE 4.34Å; T107-M521 VanDerWaalsContact OG1-CE 3.31Å; T107-M521 WeakPolarHBondContact OG1-CE 3.38Å; E517-M521 WeakPolarHBondContact O-CG 3.46Å; E517-M521 PolarHBondContact O-N 3.46Å; F518-M521 PolarHBondContact O-N 2.77Å; I519-M521 VanDerWaalsContact C-N 3.28Å; I519-M521 PolarHBondContact O-N 3.32Å; M521-P523 WeakPolarHBondContact O-CD 2.95Å
522	F	83.7	Confident	70	Confident	88 Å²	88	105.6 Å²	105.6	39%	0.386	50%	0.502	S	S	.	.			trans	-124	61.9	-177.4	-57.3	-78.8	0	0	0	112.7	L103 F518 I519 M524 L525 F526	L103-F522 HydrophobicContact CD1-CE2 3.78Å; L103-F522 HydrophobicContact CD1-CZ 4.31Å; L103-F522 HydrophobicContact CD2-CE2 3.73Å; L103-F522 HydrophobicContact CD2-CZ 4.5Å; L103-F522 HydrophobicContact CG-CE2 4.42Å; F518-F522 WeakPolarHBondContact O-CD2 3.24Å; F518-F522 PolarHBondContact O-N 3.29Å; I519-F522 CarbonylContact O-C 3.45Å; I519-F522 VanDerWaalsContact O-C 3.32Å; I519-F522 PolarHBondContact O-N 3.5Å; F522-M524 PolarHBondContact O-N 3.32Å; F522-M524 VanDerWaalsContact O-N 3.13Å; F522-L525 HydrophobicContact CB-CB 4.06Å; F522-L525 HydrophobicContact CB-CD1 3.87Å; F522-L525 HydrophobicContact CB-CG 4.23Å; F522-L525 HydrophobicContact CD1-CD1 3.96Å; F522-L525 HydrophobicContact CG-CD1 4Å; F522-L525 PolarHBondContact O-N 3.37Å; F522-L525 VanDerWaalsContact O-N 3.08Å; F522-F526 HydrophobicContact CB-CD2 4.19Å; F522-F526 HydrophobicContact CB-CE2 4.28Å; F522-F526 WeakPolarHBondContact O-CD2 2.99Å; F522-F526 PolarHBondContact O-N 3.28Å
523	P	75.4	Confident	67.7	Low	83 Å²	83	105 Å²	105	54%	0.539	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.8	-177.2	23.2	-33.1	0	0	0	112.6	I519 M521 R527	I519-P523 WeakPolarHBondContact O-CA 3.41Å; I519-P523 VanDerWaalsContact O-N 3.16Å; M521-P523 WeakPolarHBondContact O-CD 2.95Å; P523-R527 PolarHBondContact O-N 3.42Å; P523-R527 VanDerWaalsContact O-N 3.12Å
524	M	75.9	Confident	64.9	Low	179 Å²	179	105.4 Å²	105.4	88%	0.882	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-34.8	178.1	-66.5	-169.7	-77	0	0	113.4	F522	F522-M524 PolarHBondContact O-N 3.32Å; F522-M524 VanDerWaalsContact O-N 3.13Å
525	L	70.1	Confident	62.3	Low	140 Å²	140	111 Å²	111	73%	0.733	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-30.2	178.7	-70.7	174.1	0	0	0	112.2	F522	F522-L525 HydrophobicContact CB-CB 4.06Å; F522-L525 HydrophobicContact CB-CD1 3.87Å; F522-L525 HydrophobicContact CB-CG 4.23Å; F522-L525 HydrophobicContact CD1-CD1 3.96Å; F522-L525 HydrophobicContact CG-CD1 4Å; F522-L525 PolarHBondContact O-N 3.37Å; F522-L525 VanDerWaalsContact O-N 3.08Å
526	F	65	Low	59.5	Low	89 Å²	89	115 Å²	115	39%	0.39	58%	0.58	S	S	.	*	S	Bend	trans	-105.4	14	-176.2	-67.3	-78.5	0	0	0	114.2	F518 I519 F522 S528	F518-F526 HydrophobicContact CB-CE2 4.45Å; I519-F526 HydrophobicContact CB-CB 4.33Å; I519-F526 HydrophobicContact CB-CD2 4.39Å; I519-F526 HydrophobicContact CB-CG 4.4Å; I519-F526 HydrophobicContact CG1-CB 3.79Å; I519-F526 HydrophobicContact CG1-CD1 3.95Å; I519-F526 HydrophobicContact CG1-CD2 3.94Å; I519-F526 HydrophobicContact CG1-CG 3.62Å; I519-F526 HydrophobicContact CG2-CB 4.14Å; F522-F526 HydrophobicContact CB-CD2 4.19Å; F522-F526 HydrophobicContact CB-CE2 4.28Å; F522-F526 WeakPolarHBondContact O-CD2 2.99Å; F522-F526 PolarHBondContact O-N 3.28Å; F526-S528 PolarHBondContact O-N 3.02Å
527	R	57	Low	56.9	Low	209 Å²	209	112.8 Å²	112.8	79%	0.789	58%	0.584	S	S	*	*			trans	-67.7	83	170.7	-160.8	176.1	-176.5	178	1	108.4	P523 K529	P523-R527 PolarHBondContact O-N 3.42Å; P523-R527 VanDerWaalsContact O-N 3.12Å; R527-K529 PolarHBondContact O-N 2.56Å; R527-K529 VanDerWaalsContact O-N 3.13Å
528	S	49.9	Very low	54.1	Low	84 Å²	84	115 Å²	115	59%	0.587	61%	0.61	S	S	*	*			trans	-50.6	124.5	159.5	177.1	0	0	0	0	105.8	F526 K530	F526-S528 PolarHBondContact O-N 3.02Å; S528-K530 PolarHBondContact O-N 2.96Å
529	K	41.1	Very low	51.5	Low	213 Å²	213	121 Å²	121	93%	0.926	64%	0.641	S	S	*	*			trans	-61.9	65.2	158.7	-76.5	-177.6	176.5	178.8	0	108	R527 Q531	R527-K529 PolarHBondContact O-N 2.56Å; R527-K529 VanDerWaalsContact O-N 3.13Å; K529-Q531 PolarHBondContact O-N 3.16Å
530	K	40.4	Very low	48.9	Very low	183 Å²	183	125.5 Å²	125.5	80%	0.796	67%	0.666	S	S	*	*			trans	-89.5	93.3	160.6	-118.6	-177.5	177.7	-177.2	0	104.6	S528 I532	S528-K530 PolarHBondContact O-N 2.96Å; K530-I532 PolarHBondContact O-N 2.68Å
531	Q	30.2	Very low	46.5	Very low	164 Å²	164	129 Å²	129	77%	0.766	68%	0.679	S	S	*	*			trans	9.9	111.4	148.9	-126.7	164.6	-17.9	0	0	113.2	K529 S533	K529-Q531 PolarHBondContact O-N 3.16Å; Q531-S533 PolarHBondContact O-N 2.78Å
532	I	29.7	Very low	44.1	Very low	166 Å²	166	133.6 Å²	133.6	85%	0.851	71%	0.705	S	S	*	*			trans	-60.8	81	151.5	-63	161.9	0	0	0	105	K530	K530-I532 PolarHBondContact O-N 2.68Å
533	S	31.3	Very low	41.5	Very low	73 Å²	73	140 Å²	140	51%	0.51	73%	0.728	S	S	.	*			trans	-99.4	96.4	158.2	-59.4	0	0	0	0	103.6	Q531 V535	Q531-S533 PolarHBondContact O-N 2.78Å; S533-V535 PolarHBondContact O-N 3.44Å
534	S	27.7	Very low	39.7	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	74%	0.742	S	S	*	*			trans	-29.4	104.5	162.1	50.1	0	0	0	0	111.5
535	V	30.2	Very low	37.9	Very low	118 Å²	118	136.9 Å²	136.9	72%	0.715	73%	0.732	S	S	*	*			trans	-121.3	92	149.6	-179.1	0	0	0	0	104	S533 V537	S533-V535 PolarHBondContact O-N 3.44Å; V535-V537 HydrophobicContact CG1-CG2 4.35Å; V535-V537 PolarHBondContact O-N 3.33Å
536	T	28.3	Very low	36.2	Very low	135 Å²	135	135.8 Å²	135.8	83%	0.828	73%	0.731	S	S	*	*			trans	-53.5	97.4	160.7	-43.7	0	0	0	0	105.8	G538	T536-G538 VanDerWaalsContact C-N 3.34Å; T536-G538 PolarHBondContact O-N 3.11Å
537	V	31.9	Very low	34.8	Very low	117 Å²	117	139.3 Å²	139.3	71%	0.709	75%	0.752	S	S	*	*			trans	-72.5	101.2	170.2	176.7	0	0	0	0	104.7	V535 I539	V535-V537 HydrophobicContact CG1-CG2 4.35Å; V535-V537 PolarHBondContact O-N 3.33Å; V537-I539 PolarHBondContact O-N 3.33Å
538	G	29.3	Very low	33.7	Very low	57 Å²	57	141.3 Å²	141.3	59%	0.588	77%	0.77	S	S	*	*			trans	-48	124.6	165.1	0	0	0	0	0	108.5	T536 D540	T536-G538 VanDerWaalsContact C-N 3.34Å; T536-G538 PolarHBondContact O-N 3.11Å; G538-D540 VanDerWaalsContact C-N 3.27Å; G538-D540 PolarHBondContact O-N 3.33Å
539	I	30.8	Very low	32.8	Very low	139 Å²	139	144.2 Å²	144.2	71%	0.713	78%	0.779	S	S	*	*			trans	-74.5	86.3	177.5	-61.5	169.6	0	0	0	105.9	V537 H541	V537-I539 PolarHBondContact O-N 3.33Å; I539-H541 PolarHBondContact O-N 2.98Å
540	D	31.4	Very low	32.4	Very low	153 Å²	153	140.6 Å²	140.6	82%	0.818	77%	0.772	S	S	*	*			trans	-82.5	97.8	162.2	-85.5	-27.7	0	0	0	108.4	G538 N542	G538-D540 VanDerWaalsContact C-N 3.27Å; G538-D540 PolarHBondContact O-N 3.33Å; D540-N542 PolarHBondContact O-N 3.16Å
541	H	33.6	Very low	32	Very low	169 Å²	169	138.2 Å²	138.2	78%	0.782	77%	0.77	S	S	*	*			trans	-60.2	83.9	165	-86.5	-68.7	0	0	0	109.8	I539	I539-H541 PolarHBondContact O-N 2.98Å
542	N	33.2	Very low	32.1	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	77%	0.771	S	S	*	*			trans	-150.7	17.3	161.6	-99.7	-23.2	0	0	0	115.4	D540	D540-N542 PolarHBondContact O-N 3.16Å
543	Y	30.2	Very low	32.2	Very low	222 Å²	222	134.9 Å²	134.9	87%	0.871	77%	0.766	S	S	*	*			trans	-102.1	13.6	175.8	-102.3	-87.3	0	0	0	115.3
544	A	36.7	Very low	32.3	Very low	100 Å²	100	139 Å²	139	83%	0.826	78%	0.783	S	S	*	*	S	Bend	trans	-90.5	-2	-178.4	0	0	0	0	0	115.5
545	S	37.7	Very low	32.6	Very low	97 Å²	97	141.5 Å²	141.5	68%	0.678	79%	0.787	S	S	*	*	S	Bend	trans	-107.1	16.7	-175.6	57.5	0	0	0	0	116.1
546	V	35.1	Very low	32.8	Very low	117 Å²	117	143.3 Å²	143.3	71%	0.709	79%	0.792	S	S	*	*	S	Bend	trans	-117	12.9	176.6	-169.2	0	0	0	0	113.1
547	I	35.4	Very low	33.2	Very low	163 Å²	163	144 Å²	144	84%	0.836	79%	0.789	S	S	*	*			trans	-123.5	27.2	171.7	-43.7	-175.5	0	0	0	112.4
548	Q	32.9	Very low	33.3	Very low	251 Å²	251	146.5 Å²	146.5	100%	1.173	80%	0.796	S	S	*	*			trans	-128.1	0	153.5	-89.6	-178.8	-30.1	0	0	107.6

Retrieved 548 of 548 residues in 967 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).