A0A077ZJG4_TRITR Loading...

UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase

UDP-N-acetylglucosamine--dolichyl-phosphate N-acetylglucosaminephosphotransferase that operates in the biosynthetic pathway of dolichol-linked oligosaccharides, the glycan precursors employed in protein asparagine (N)-glycosylation. The assembly of dolichol-linked oligosaccharides begins on the cytosolic side of the endoplasmic reticulum membrane and finishes in its lumen. The sequential addition of sugars to dolichol pyrophosphate produces dolichol-linked oligosaccharides containing fourteen sugars, including two GlcNAcs, nine mannoses and three glucoses. Once assembled, the oligosaccharide is transferred from the lipid to nascent proteins by oligosaccharyltransferases. Catalyzes the initial step of dolichol-linked oligosaccharide biosynthesis, transfering GlcNAc-1-P from cytosolic UDP-GlcNAc onto the carrier lipid dolichyl phosphate (P-dolichol), yielding GlcNAc-P-P-dolichol embedded in the cytoplasmic leaflet of the endoplasmic reticulum membrane.

AlphaFold DB , UniProt , Accession A0A077ZJG4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 409 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	82.4	Confident	205 Å²	205	86.1 Å²	86.1	100%	1.01	46%	0.462	S	S	*	.				0	81.7	0	-73.3	-166.7	170.5	0	0	109.2	S3 E214	M1-S3 VanDerWaalsContact C-N 3.34Å; M1-S3 PolarHBondContact O-N 3.09Å; M1-E214 WeakPolarHBondContact CA-OE1 3.27Å; M1-E214 PolarHBondContact N-OE1 2.97Å
2	E	61.3	Low	83.8	Confident	114 Å²	114	79 Å²	79	53%	0.533	42%	0.424	S	S	.	.			trans	-59.8	104.5	156.4	-128.3	-173.4	-180	0	0	105.3	E214 L217	E2-E214 PolarHBondContact N-OE1 3.38Å; E2-L217 HydrophobicContact CB-CD2 4.02Å; E2-L217 WeakPolarHBondContact O-CD2 3.47Å
3	S	72.9	Confident	84.9	Confident	83 Å²	83	80 Å²	80	58%	0.58	43%	0.426	S	S	*	.			trans	-67.4	139.9	-177.9	54.3	0	0	0	0	109.3	M1 P5	M1-S3 VanDerWaalsContact C-N 3.34Å; M1-S3 PolarHBondContact O-N 3.09Å; S3-P5 WeakPolarHBondContact O-CD 3.25Å; S3-P5 VanDerWaalsContact O-N 3.11Å
4	V	79.2	Confident	85.8	Confident	56 Å²	56	83.1 Å²	83.1	34%	0.339	44%	0.442	S	S	.	.			trans	-52.5	122.7	173.4	178.1	0	0	0	0	107.8	V6 L9 I210 L217 L221	V4-V6 VanDerWaalsContact C-N 3.31Å; V4-V6 WeakPolarHBondContact O-CG2 3.49Å; V4-V6 PolarHBondContact O-N 3.2Å; V4-L9 HydrophobicContact CG1-CD1 3.7Å; V4-I210 HydrophobicContact CG2-CG2 3.91Å; V4-L217 HydrophobicContact CG2-CD1 4.05Å; V4-L221 HydrophobicContact CG1-CD2 4.25Å
5	P	83.9	Confident	86.7	Confident	30 Å²	30	79.5 Å²	79.5	20%	0.195	42%	0.423	C	S	.	.			trans	-72.3	91.2	179.1	30.2	-33	0	0	0	108.6	S3 V7 P8 L221	S3-P5 WeakPolarHBondContact O-CD 3.25Å; S3-P5 VanDerWaalsContact O-N 3.11Å; P5-V7 VanDerWaalsContact C-N 3.31Å; P5-V7 PolarHBondContact O-N 3.12Å; P5-P8 HydrophobicContact CB-CG 4.08Å; P5-P8 WeakPolarHBondContact O-CD 3.48Å; P5-L221 VanDerWaalsContact CD-CD1 3.4Å; P5-L221 HydrophobicContact CG-CD1 3.64Å
6	V	87.8	Confident	87.4	Confident	86 Å²	86	74.5 Å²	74.5	52%	0.521	40%	0.396	S	S	.	.	H	α-helix	trans	-63.3	-37.4	-175.4	-178.2	0	0	0	0	111.5	V4 L9 M10	V4-V6 VanDerWaalsContact C-N 3.31Å; V4-V6 WeakPolarHBondContact O-CG2 3.49Å; V4-V6 PolarHBondContact O-N 3.2Å; V6-L9 PolarHBondContact O-N 3.14Å; V6-M10 HydrophobicContact CG1-CG 3.95Å; V6-M10 HydrophobicContact CG1-SD 3.74Å; V6-M10 WeakPolarHBondContact O-CG 3.4Å; V6-M10 PolarHBondContact O-N 3.34Å
7	V	91.6	Very high	88.1	Confident	111 Å²	111	72.6 Å²	72.6	67%	0.673	39%	0.393	S	S	*	.	H	α-helix	trans	-61.7	-51.2	-175.4	173.8	0	0	0	0	112.5	P5 L9 M10 Y11	P5-V7 VanDerWaalsContact C-N 3.31Å; P5-V7 PolarHBondContact O-N 3.12Å; V7-L9 VanDerWaalsContact C-N 3.31Å; V7-L9 PolarHBondContact O-N 3.26Å; V7-M10 PolarHBondContact O-N 3.01Å; V7-Y11 PolarHBondContact O-N 3.3Å
8	P	94.8	Very high	88.7	Confident	15 Å²	15	70.7 Å²	70.7	10%	0.097	39%	0.394	C	S	.	.	H	α-helix	trans	-55.1	-42.2	171.7	-29.3	34.7	0	0	0	113.7	P5 Y11 N12 F71 Y225	P5-P8 HydrophobicContact CB-CG 4.08Å; P5-P8 WeakPolarHBondContact O-CD 3.48Å; P8-Y11 PolarHBondContact O-N 3.5Å; P8-N12 VanDerWaalsContact O-CB 3.27Å; P8-N12 WeakPolarHBondContact O-CB 3.47Å; P8-N12 PolarHBondContact O-N 3.02Å; P8-F71 HydrophobicContact CB-CZ 4.23Å; P8-F71 WeakPolarHBondContact O-CE2 3.39Å; P8-Y225 HydrophobicContact CB-CE1 4.06Å
9	L	94.8	Very high	89.2	Confident	41 Å²	41	67.3 Å²	67.3	22%	0.215	38%	0.376	C	S	.	.	H	α-helix	trans	-65.5	-41.8	178	-70.2	173	0	0	0	112.2	V4 V6 V7 N12 M13 L221 L224 Y225	V4-L9 HydrophobicContact CG1-CD1 3.7Å; V6-L9 PolarHBondContact O-N 3.14Å; V7-L9 VanDerWaalsContact C-N 3.31Å; V7-L9 PolarHBondContact O-N 3.26Å; L9-N12 WeakPolarHBondContact O-CB 2.81Å; L9-N12 PolarHBondContact O-N 3.4Å; L9-M13 VanDerWaalsContact O-CG 3.3Å; L9-M13 WeakPolarHBondContact O-CG 3.41Å; L9-M13 PolarHBondContact O-N 2.97Å; L9-L221 HydrophobicContact CD1-CD2 3.91Å; L9-L221 HydrophobicContact CD2-CD2 4.2Å; L9-L221 HydrophobicContact CG-CD2 4.26Å; L9-L224 HydrophobicContact CD2-CB 4.43Å; L9-Y225 HydrophobicContact CD2-CD1 4.07Å; L9-Y225 HydrophobicContact CD2-CE1 3.73Å; L9-Y225 HydrophobicContact CG-CE1 4.24Å
10	M	95.9	Very high	89.6	Confident	113 Å²	113	64.8 Å²	64.8	56%	0.557	36%	0.364	S	S	*	.	H	α-helix	trans	-61.7	-45.4	174.7	-72.3	177.4	67.5	0	0	111.5	V6 V7 N12 M13 L14	V6-M10 HydrophobicContact CG1-CG 3.95Å; V6-M10 HydrophobicContact CG1-SD 3.74Å; V6-M10 WeakPolarHBondContact O-CG 3.4Å; V6-M10 PolarHBondContact O-N 3.34Å; V7-M10 PolarHBondContact O-N 3.01Å; M10-N12 VanDerWaalsContact C-N 3.33Å; M10-N12 PolarHBondContact O-N 3.09Å; M10-M13 PolarHBondContact O-N 2.96Å; M10-L14 WeakPolarHBondContact O-CG 3.43Å; M10-L14 PolarHBondContact O-N 2.92Å
11	Y	97.3	Very high	90.1	Very high	93 Å²	93	67.9 Å²	67.9	37%	0.365	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-40.8	177.3	-173.5	-116.2	0	0	0	111.8	V7 P8 M13 L14 L15 F71 A74	V7-Y11 PolarHBondContact O-N 3.3Å; P8-Y11 PolarHBondContact O-N 3.5Å; Y11-M13 PolarHBondContact O-N 3.04Å; Y11-L14 PolarHBondContact O-N 2.99Å; Y11-L15 HydrophobicContact CD1-CD1 3.91Å; Y11-L15 HydrophobicContact CD1-CG 4.44Å; Y11-L15 HydrophobicContact CE1-CD1 3.43Å; Y11-L15 VanDerWaalsContact CE1-CD1 3.43Å; Y11-L15 HydrophobicContact CE1-CG 4.09Å; Y11-L15 HydrophobicContact CE2-CD1 4.45Å; Y11-L15 HydrophobicContact CE2-CD2 4.39Å; Y11-L15 HydrophobicContact CE2-CG 4.24Å; Y11-L15 WeakPolarHBondContact O-CG 3.36Å; Y11-L15 PolarHBondContact O-N 2.83Å; Y11-F71 AromaticContact CD1-CD2 3.68Å; Y11-F71 HydrophobicContact CD1-CD2 3.68Å; Y11-F71 HydrophobicContact CD1-CE2 4.04Å; Y11-F71 HydrophobicContact CE1-CD2 4.23Å; Y11-A74 HydrophobicContact CD1-CB 3.41Å; Y11-A74 VanDerWaalsContact CD1-CB 3.41Å; Y11-A74 HydrophobicContact CE1-CB 3.96Å; Y11-A74 HydrophobicContact CG-CB 4.33Å
12	N	98.3	Very high	92.5	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-59	-45.8	173.8	-170.7	-87.1	0	0	0	111.7	P8 L9 M10 L15 S16 F71 Y225 V228 P229	P8-N12 VanDerWaalsContact O-CB 3.27Å; P8-N12 WeakPolarHBondContact O-CB 3.47Å; P8-N12 PolarHBondContact O-N 3.02Å; L9-N12 WeakPolarHBondContact O-CB 2.81Å; L9-N12 PolarHBondContact O-N 3.4Å; M10-N12 VanDerWaalsContact C-N 3.33Å; M10-N12 PolarHBondContact O-N 3.09Å; N12-L15 PolarHBondContact O-N 2.84Å; N12-S16 VanDerWaalsContact O-CB 3.26Å; N12-S16 WeakPolarHBondContact O-CB 3.47Å; N12-S16 PolarHBondContact O-N 2.8Å; N12-S16 PolarHBondContact O-OG 3.27Å; N12-F71 HydrophobicContact CB-CD2 4.01Å; N12-F71 HydrophobicContact CB-CE2 3.51Å; N12-F71 HydrophobicContact CB-CZ 3.86Å; N12-Y225 PolarHBondContact ND2-O 3.5Å; N12-Y225 VanDerWaalsContact ND2-O 3.09Å; N12-V228 WeakPolarHBondContact OD1-CB 3.28Å; N12-V228 WeakPolarHBondContact OD1-CG1 3.48Å; N12-P229 WeakPolarHBondContact OD1-CD 3.37Å
13	M	98.1	Very high	94.2	Very high	92 Å²	92	56.3 Å²	56.3	45%	0.453	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-42.3	176.6	-72.3	-67.7	-66.7	0	0	112.3	L9 M10 Y11 S16 A17 V228 F232	L9-M13 VanDerWaalsContact O-CG 3.3Å; L9-M13 WeakPolarHBondContact O-CG 3.41Å; L9-M13 PolarHBondContact O-N 2.97Å; M10-M13 PolarHBondContact O-N 2.96Å; Y11-M13 PolarHBondContact O-N 3.04Å; M13-S16 PolarHBondContact O-N 2.77Å; M13-A17 WeakPolarHBondContact O-CB 3.21Å; M13-A17 PolarHBondContact O-N 2.75Å; M13-V228 HydrophobicContact SD-CG1 3.48Å; M13-V228 WeakPolarHBondContact SD-CG1 3.42Å; M13-F232 HydrophobicContact CE-CE2 4.07Å; M13-F232 HydrophobicContact CE-CZ 3.84Å; M13-F232 HydrophobicContact SD-CE2 4.16Å; M13-F232 HydrophobicContact SD-CZ 4.43Å
14	L	98.3	Very high	95.4	Very high	123 Å²	123	55 Å²	55	64%	0.644	31%	0.311	S	S	*	.	H	α-helix	trans	-62.9	-48.8	177.2	-73	171.4	0	0	0	111.8	M10 Y11 S16 A17 G18	M10-L14 WeakPolarHBondContact O-CG 3.43Å; M10-L14 PolarHBondContact O-N 2.92Å; Y11-L14 PolarHBondContact O-N 2.99Å; L14-S16 VanDerWaalsContact C-N 3.28Å; L14-S16 PolarHBondContact O-N 3.06Å; L14-A17 PolarHBondContact O-N 2.86Å; L14-G18 PolarHBondContact O-N 3.33Å
15	L	98.6	Very high	96.3	Very high	29 Å²	29	55.8 Å²	55.8	15%	0.152	32%	0.319	C	S	.	.	H	α-helix	trans	-61.8	-38.3	175.4	-70.6	178.9	0	0	0	111.7	Y11 N12 G18 G19 I67 L70 F71	Y11-L15 HydrophobicContact CD1-CD1 3.91Å; Y11-L15 HydrophobicContact CD1-CG 4.44Å; Y11-L15 HydrophobicContact CE1-CD1 3.43Å; Y11-L15 VanDerWaalsContact CE1-CD1 3.43Å; Y11-L15 HydrophobicContact CE1-CG 4.09Å; Y11-L15 HydrophobicContact CE2-CD1 4.45Å; Y11-L15 HydrophobicContact CE2-CD2 4.39Å; Y11-L15 HydrophobicContact CE2-CG 4.24Å; Y11-L15 WeakPolarHBondContact O-CG 3.36Å; Y11-L15 PolarHBondContact O-N 2.83Å; N12-L15 PolarHBondContact O-N 2.84Å; L15-G18 PolarHBondContact O-N 2.87Å; L15-G19 PolarHBondContact O-N 3.42Å; L15-I67 HydrophobicContact CB-CG2 3.81Å; L15-L70 HydrophobicContact CD1-CB 4.05Å; L15-L70 HydrophobicContact CD2-CB 4.31Å; L15-L70 HydrophobicContact CD2-CD1 4.32Å; L15-F71 HydrophobicContact CD1-CB 3.89Å; L15-F71 HydrophobicContact CD1-CD2 4.18Å
16	S	98.7	Very high	97	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-43.8	177.9	-60.6	0	0	0	0	112.1	N12 M13 L14 G19 A20 P229 F232	N12-S16 VanDerWaalsContact O-CB 3.26Å; N12-S16 WeakPolarHBondContact O-CB 3.47Å; N12-S16 PolarHBondContact O-N 2.8Å; N12-S16 PolarHBondContact O-OG 3.27Å; M13-S16 PolarHBondContact O-N 2.77Å; L14-S16 VanDerWaalsContact C-N 3.28Å; L14-S16 PolarHBondContact O-N 3.06Å; S16-G19 PolarHBondContact O-N 2.8Å; S16-A20 PolarHBondContact O-N 3.31Å; S16-P229 VanDerWaalsContact OG-CA 3.24Å; S16-P229 WeakPolarHBondContact OG-CA 3.49Å; S16-P229 WeakPolarHBondContact OG-CB 3.46Å; S16-F232 WeakPolarHBondContact O-CD1 3.39Å
17	A	98.5	Very high	97.5	Very high	42 Å²	42	52.2 Å²	52.2	35%	0.347	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-47	175.5	0	0	0	0	0	111.8	M13 L14 G19 A20 L21 F232	M13-A17 WeakPolarHBondContact O-CB 3.21Å; M13-A17 PolarHBondContact O-N 2.75Å; L14-A17 PolarHBondContact O-N 2.86Å; A17-G19 VanDerWaalsContact C-N 3.32Å; A17-G19 PolarHBondContact O-N 3.23Å; A17-A20 PolarHBondContact O-N 3.19Å; A17-L21 PolarHBondContact O-N 3.43Å; A17-F232 HydrophobicContact CB-CE1 4.05Å
18	G	98.5	Very high	97.8	Very high	39 Å²	39	52.6 Å²	52.6	40%	0.402	29%	0.288	S	S	.	.	H	α-helix	trans	-60.5	-41.8	174.7	0	0	0	0	0	112.4	L14 L15 A20 L21 L22	L14-G18 PolarHBondContact O-N 3.33Å; L15-G18 PolarHBondContact O-N 2.87Å; G18-A20 PolarHBondContact O-N 3.14Å; G18-L21 PolarHBondContact O-N 2.73Å; G18-L22 PolarHBondContact O-N 2.62Å
19	G	98.7	Very high	97.9	Very high	5 Å²	5	57.8 Å²	57.8	5%	0.052	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-38.5	175.2	0	0	0	0	0	113.6	L15 S16 A17 L22 A23 I63	L15-G19 PolarHBondContact O-N 3.42Å; S16-G19 PolarHBondContact O-N 2.8Å; A17-G19 VanDerWaalsContact C-N 3.32Å; A17-G19 PolarHBondContact O-N 3.23Å; G19-L22 PolarHBondContact O-N 3.12Å; G19-A23 VanDerWaalsContact O-CB 3.24Å; G19-A23 WeakPolarHBondContact O-CB 3.1Å; G19-A23 PolarHBondContact O-N 3.14Å; G19-I63 WeakPolarHBondContact O-CG2 3.2Å
20	A	98.4	Very high	98.1	Very high	17 Å²	17	59.3 Å²	59.3	14%	0.14	32%	0.316	C	S	.	.	H	α-helix	trans	-65.3	-41.4	174.5	0	0	0	0	0	112.5	S16 A17 G18 A23 N24 F232 V236	S16-A20 PolarHBondContact O-N 3.31Å; A17-A20 PolarHBondContact O-N 3.19Å; G18-A20 PolarHBondContact O-N 3.14Å; A20-A23 PolarHBondContact O-N 3.49Å; A20-N24 PolarHBondContact O-N 3.13Å; A20-F232 HydrophobicContact CB-CB 4.23Å; A20-F232 HydrophobicContact CB-CD1 4.08Å; A20-V236 HydrophobicContact CB-CG2 3.86Å; A20-V236 WeakPolarHBondContact O-CG2 3.36Å
21	L	98.2	Very high	98.2	Very high	131 Å²	131	54.8 Å²	54.8	69%	0.686	30%	0.295	S	S	*	.	H	α-helix	trans	-62.3	-46.2	175	-65.5	175.4	0	0	0	111.1	A17 G18 A23 N24 S25	A17-L21 PolarHBondContact O-N 3.43Å; G18-L21 PolarHBondContact O-N 2.73Å; L21-A23 PolarHBondContact O-N 3.03Å; L21-N24 PolarHBondContact O-N 2.98Å; L21-S25 PolarHBondContact O-N 2.85Å; L21-S25 PolarHBondContact O-OG 2.96Å
22	L	98.3	Very high	98.2	Very high	75 Å²	75	56.6 Å²	56.6	39%	0.393	31%	0.305	S	S	.	.	H	α-helix	trans	-60.7	-44.8	175.5	-177	63.1	0	0	0	111.4	G18 G19 N24 S25 L26 I63	G18-L22 PolarHBondContact O-N 2.62Å; G19-L22 PolarHBondContact O-N 3.12Å; L22-N24 VanDerWaalsContact C-N 3.33Å; L22-N24 PolarHBondContact O-N 2.8Å; L22-S25 PolarHBondContact O-N 2.94Å; L22-L26 HydrophobicContact CD1-CD1 3.82Å; L22-L26 HydrophobicContact CD1-CD2 4.45Å; L22-L26 HydrophobicContact CD1-CG 3.89Å; L22-L26 HydrophobicContact CD2-CD1 4.27Å; L22-L26 HydrophobicContact CG-CD1 3.78Å; L22-L26 HydrophobicContact CG-CG 4.14Å; L22-L26 WeakPolarHBondContact O-CG 3.4Å; L22-L26 PolarHBondContact O-N 3.19Å; L22-I63 HydrophobicContact CD2-CG1 4.41Å; L22-I63 HydrophobicContact CD2-CG2 4.37Å; L22-I63 HydrophobicContact CG-CD1 4.38Å
23	A	98.4	Very high	98.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-58.4	-42.7	177.9	0	0	0	0	0	112.5	G19 A20 L21 S25 L26 V27 T60 I63 V236	G19-A23 VanDerWaalsContact O-CB 3.24Å; G19-A23 WeakPolarHBondContact O-CB 3.1Å; G19-A23 PolarHBondContact O-N 3.14Å; A20-A23 PolarHBondContact O-N 3.49Å; L21-A23 PolarHBondContact O-N 3.03Å; A23-S25 VanDerWaalsContact C-N 3.29Å; A23-S25 PolarHBondContact O-N 3.37Å; A23-L26 PolarHBondContact O-N 2.78Å; A23-V27 WeakPolarHBondContact O-CB 3.32Å; A23-V27 VanDerWaalsContact O-CG2 3.28Å; A23-V27 WeakPolarHBondContact O-CG2 3.28Å; A23-V27 PolarHBondContact O-N 3.31Å; A23-T60 HydrophobicContact CB-CG2 4.39Å; A23-I63 HydrophobicContact CB-CD1 3.69Å; A23-I63 HydrophobicContact CB-CG2 4.44Å; A23-V236 HydrophobicContact CB-CB 4.2Å; A23-V236 HydrophobicContact CB-CG1 3.93Å; A23-V236 HydrophobicContact CB-CG2 4.36Å
24	N	97.7	Very high	98.1	Very high	56 Å²	56	56.6 Å²	56.6	30%	0.299	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-36.6	-179.2	-179.8	70	0	0	0	111.9	A20 L21 L22 V236 R239 W240	A20-N24 PolarHBondContact O-N 3.13Å; L21-N24 PolarHBondContact O-N 2.98Å; L22-N24 VanDerWaalsContact C-N 3.33Å; L22-N24 PolarHBondContact O-N 2.8Å; N24-V236 HydrophobicContact CB-CG1 3.87Å; N24-R239 PolarHBondContact OD1-NH2 3.01Å; N24-W240 PolarHBondContact OD1-NE1 3.18Å; N24-W240 VanDerWaalsContact OD1-NE1 3.17Å
25	S	97.9	Very high	98	Very high	72 Å²	72	52.2 Å²	52.2	50%	0.503	29%	0.287	S	S	.	.	H	α-helix	trans	-70.2	-48.9	175.5	-62.2	0	0	0	0	111.9	L21 L22 A23 K28 E29	L21-S25 PolarHBondContact O-N 2.85Å; L21-S25 PolarHBondContact O-OG 2.96Å; L22-S25 PolarHBondContact O-N 2.94Å; A23-S25 VanDerWaalsContact C-N 3.29Å; A23-S25 PolarHBondContact O-N 3.37Å; S25-K28 WeakPolarHBondContact O-CB 3.36Å; S25-K28 PolarHBondContact O-N 3.3Å; S25-E29 PolarHBondContact O-N 3.25Å; S25-E29 VanDerWaalsContact O-N 3.09Å
26	L	98.4	Very high	98	Very high	41 Å²	41	59.2 Å²	59.2	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-70.8	-36.3	-176.7	-65.7	-172.5	0	0	0	112.7	L22 A23 K28 E29 F30 V59 I63	L22-L26 HydrophobicContact CD1-CD1 3.82Å; L22-L26 HydrophobicContact CD1-CD2 4.45Å; L22-L26 HydrophobicContact CD1-CG 3.89Å; L22-L26 HydrophobicContact CD2-CD1 4.27Å; L22-L26 HydrophobicContact CG-CD1 3.78Å; L22-L26 HydrophobicContact CG-CG 4.14Å; L22-L26 WeakPolarHBondContact O-CG 3.4Å; L22-L26 PolarHBondContact O-N 3.19Å; A23-L26 PolarHBondContact O-N 2.78Å; L26-K28 VanDerWaalsContact C-N 3.27Å; L26-K28 PolarHBondContact O-N 2.79Å; L26-E29 PolarHBondContact O-N 3.46Å; L26-F30 HydrophobicContact CB-CD2 4.17Å; L26-F30 HydrophobicContact CD2-CD2 4.43Å; L26-F30 HydrophobicContact CD2-CE2 4.14Å; L26-F30 WeakPolarHBondContact O-CB 3.3Å; L26-F30 WeakPolarHBondContact O-CD2 3.47Å; L26-F30 PolarHBondContact O-N 2.84Å; L26-V59 HydrophobicContact CB-CG1 3.85Å; L26-I63 HydrophobicContact CB-CD1 4.09Å; L26-I63 HydrophobicContact CD1-CD1 3.8Å; L26-I63 HydrophobicContact CD1-CG1 4.12Å; L26-I63 HydrophobicContact CG-CD1 4.38Å
27	V	98.5	Very high	97.8	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-41.9	173.1	169.5	0	0	0	0	110.6	A23 S31 M56 V59 T60 W240 V247	A23-V27 WeakPolarHBondContact O-CB 3.32Å; A23-V27 VanDerWaalsContact O-CG2 3.28Å; A23-V27 WeakPolarHBondContact O-CG2 3.28Å; A23-V27 PolarHBondContact O-N 3.31Å; V27-S31 WeakPolarHBondContact O-CB 3.32Å; V27-S31 PolarHBondContact O-N 3.43Å; V27-S31 PolarHBondContact O-OG 3.5Å; V27-M56 HydrophobicContact CB-CE 4.14Å; V27-M56 HydrophobicContact CG1-CE 3.89Å; V27-M56 HydrophobicContact CG2-CE 4.28Å; V27-M56 WeakPolarHBondContact O-CE 3.39Å; V27-V59 HydrophobicContact CG2-CB 4.47Å; V27-V59 HydrophobicContact CG2-CG1 4.15Å; V27-T60 HydrophobicContact CG2-CG2 3.89Å; V27-W240 HydrophobicContact CG1-CB 4.05Å; V27-W240 HydrophobicContact CG1-CD2 3.77Å; V27-W240 HydrophobicContact CG1-CE3 4.4Å; V27-W240 HydrophobicContact CG1-CG 3.57Å; V27-V247 HydrophobicContact CG1-CG1 4.22Å
28	K	97.4	Very high	97.7	Very high	120 Å²	120	72.7 Å²	72.7	52%	0.522	37%	0.365	S	S	.	.	H	α-helix	trans	-63.3	-44.4	176.9	-175.1	-179.7	178.7	-176.4	0	112	S25 L26 S31 W240	S25-K28 WeakPolarHBondContact O-CB 3.36Å; S25-K28 PolarHBondContact O-N 3.3Å; L26-K28 VanDerWaalsContact C-N 3.27Å; L26-K28 PolarHBondContact O-N 2.79Å; K28-S31 PolarHBondContact O-OG 3.18Å; K28-W240 HydrophobicContact CB-CH2 3.7Å; K28-W240 HydrophobicContact CB-CZ2 3.83Å; K28-W240 HydrophobicContact CD-CH2 4.35Å; K28-W240 HydrophobicContact CG-CH2 3.89Å; K28-W240 HydrophobicContact CG-CZ2 4.45Å
29	E	98	Very high	97.5	Very high	123 Å²	123	72.9 Å²	72.9	58%	0.575	36%	0.357	S	S	*	.	H	α-helix	trans	-68.9	-54.7	-179.5	-175.3	179.7	163.6	0	0	112	S25 L26 S31 K32 L33	S25-E29 PolarHBondContact O-N 3.25Å; S25-E29 VanDerWaalsContact O-N 3.09Å; L26-E29 PolarHBondContact O-N 3.46Å; E29-S31 VanDerWaalsContact C-N 3.3Å; E29-S31 PolarHBondContact O-N 3.18Å; E29-K32 WeakPolarHBondContact O-CB 3.48Å; E29-K32 PolarHBondContact O-N 3.44Å; E29-K32 VanDerWaalsContact O-N 3.11Å; E29-L33 PolarHBondContact O-N 3.32Å
30	F	98.1	Very high	97.4	Very high	74 Å²	74	75.5 Å²	75.5	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-66.4	-31.4	-177.4	-81.7	-94.2	0	0	0	112	L26 K32 L33 F34 M56 V59	L26-F30 HydrophobicContact CB-CD2 4.17Å; L26-F30 HydrophobicContact CD2-CD2 4.43Å; L26-F30 HydrophobicContact CD2-CE2 4.14Å; L26-F30 WeakPolarHBondContact O-CB 3.3Å; L26-F30 WeakPolarHBondContact O-CD2 3.47Å; L26-F30 PolarHBondContact O-N 2.84Å; F30-K32 PolarHBondContact O-N 2.93Å; F30-K32 VanDerWaalsContact O-N 3.16Å; F30-L33 HydrophobicContact CD1-CD2 3.93Å; F30-L33 HydrophobicContact CE1-CD2 4.02Å; F30-L33 CarbonylContact O-C 3.58Å; F30-L33 WeakPolarHBondContact O-CA 3.5Å; F30-L33 WeakPolarHBondContact O-CB 3.39Å; F30-L33 PolarHBondContact O-N 3.36Å; F30-F34 HydrophobicContact CB-CD2 4.15Å; F30-F34 HydrophobicContact CB-CE2 4.23Å; F30-F34 HydrophobicContact CD1-CE2 4.04Å; F30-F34 VanDerWaalsContact O-CD2 3.29Å; F30-F34 WeakPolarHBondContact O-CD2 3.44Å; F30-F34 PolarHBondContact O-N 2.85Å; F30-M56 HydrophobicContact CB-CE 3.92Å; F30-V59 HydrophobicContact CB-CG2 3.78Å; F30-V59 HydrophobicContact CD1-CG2 4.43Å; F30-V59 HydrophobicContact CG-CG2 4.05Å
31	S	97.8	Very high	97.2	Very high	18 Å²	18	75.2 Å²	75.2	13%	0.126	37%	0.366	C	S	.	.	H	α-helix	trans	-55	-36.8	173.5	67.6	0	0	0	0	112.6	V27 K28 E29 A35 P53	V27-S31 WeakPolarHBondContact O-CB 3.32Å; V27-S31 PolarHBondContact O-N 3.43Å; V27-S31 PolarHBondContact O-OG 3.5Å; K28-S31 PolarHBondContact O-OG 3.18Å; E29-S31 VanDerWaalsContact C-N 3.3Å; E29-S31 PolarHBondContact O-N 3.18Å; S31-A35 WeakPolarHBondContact O-CB 3.42Å; S31-A35 PolarHBondContact O-N 3.5Å; S31-A35 VanDerWaalsContact O-N 3.09Å; S31-P53 WeakPolarHBondContact O-CB 3.48Å; S31-P53 VanDerWaalsContact O-CG 3.24Å; S31-P53 WeakPolarHBondContact O-CG 3.48Å
32	K	97.5	Very high	97.1	Very high	131 Å²	131	72 Å²	72	57%	0.57	35%	0.352	S	S	*	.	H	α-helix	trans	-70.9	-36.9	174.8	-60.1	177.2	-179.1	-178.5	0	111.9	E29 F30 K36	E29-K32 WeakPolarHBondContact O-CB 3.48Å; E29-K32 PolarHBondContact O-N 3.44Å; E29-K32 VanDerWaalsContact O-N 3.11Å; F30-K32 PolarHBondContact O-N 2.93Å; F30-K32 VanDerWaalsContact O-N 3.16Å; K32-K36 WeakPolarHBondContact O-CG 3.31Å; K32-K36 PolarHBondContact O-N 3.01Å
33	L	97.7	Very high	96.9	Very high	76 Å²	76	68.7 Å²	68.7	40%	0.398	34%	0.335	S	S	.	.	H	α-helix	trans	-67	-49.7	177.4	-179.5	62.1	0	0	0	111.4	E29 F30 A35 K36 L37	E29-L33 PolarHBondContact O-N 3.32Å; F30-L33 HydrophobicContact CD1-CD2 3.93Å; F30-L33 HydrophobicContact CE1-CD2 4.02Å; F30-L33 CarbonylContact O-C 3.58Å; F30-L33 WeakPolarHBondContact O-CA 3.5Å; F30-L33 WeakPolarHBondContact O-CB 3.39Å; F30-L33 PolarHBondContact O-N 3.36Å; L33-A35 VanDerWaalsContact C-N 3.27Å; L33-A35 PolarHBondContact O-N 3.27Å; L33-K36 WeakPolarHBondContact O-CB 3.46Å; L33-K36 PolarHBondContact O-N 3.36Å; L33-L37 HydrophobicContact CD1-CD1 4.25Å; L33-L37 HydrophobicContact CD1-CG 4.44Å; L33-L37 HydrophobicContact CG-CD1 4.14Å; L33-L37 WeakPolarHBondContact O-CG 3.42Å; L33-L37 PolarHBondContact O-N 3.23Å
34	F	97.5	Very high	96.6	Very high	16 Å²	16	73.3 Å²	73.3	7%	0.07	36%	0.357	C	S	.	.	H	α-helix	trans	-59	-39.5	176	-82	-90.3	0	0	0	111.1	F30 L37 R38 M39 P53 Q54 M56 V58 V59 F110	F30-F34 HydrophobicContact CB-CD2 4.15Å; F30-F34 HydrophobicContact CB-CE2 4.23Å; F30-F34 HydrophobicContact CD1-CE2 4.04Å; F30-F34 VanDerWaalsContact O-CD2 3.29Å; F30-F34 WeakPolarHBondContact O-CD2 3.44Å; F30-F34 PolarHBondContact O-N 2.85Å; F34-L37 CarbonylContact O-C 3.23Å; F34-L37 PolarHBondContact O-N 3.38Å; F34-R38 PolarHBondContact O-N 3.23Å; F34-M39 HydrophobicContact CB-CB 4.31Å; F34-M39 HydrophobicContact CD1-CB 3.75Å; F34-M39 HydrophobicContact CD1-CE 3.21Å; F34-M39 HydrophobicContact CD1-CG 4.33Å; F34-M39 HydrophobicContact CD1-SD 3.68Å; F34-M39 HydrophobicContact CE1-CE 3.37Å; F34-M39 HydrophobicContact CE1-SD 3.74Å; F34-M39 HydrophobicContact CG-CE 4.04Å; F34-M39 HydrophobicContact CZ-CE 4.32Å; F34-M39 PolarHBondContact O-N 3.3Å; F34-P53 HydrophobicContact CB-CB 4.16Å; F34-Q54 VanDerWaalsContact CD1-O 3.32Å; F34-Q54 WeakPolarHBondContact CD1-O 3.47Å; F34-M56 HydrophobicContact CD2-SD 3.73Å; F34-M56 HydrophobicContact CE2-SD 4.25Å; F34-M56 HydrophobicContact CG-SD 4.23Å; F34-V58 HydrophobicContact CE2-CG1 4.34Å; F34-V58 HydrophobicContact CZ-CG1 3.81Å; F34-V59 HydrophobicContact CE2-CG2 4.3Å; F34-F110 HydrophobicContact CE1-CE2 4.37Å
35	A	96.4	Very high	96.1	Very high	31 Å²	31	70.9 Å²	70.9	26%	0.256	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-46.8	171.7	0	0	0	0	0	112.8	S31 L33 L37 R38 Q40 P53	S31-A35 WeakPolarHBondContact O-CB 3.42Å; S31-A35 PolarHBondContact O-N 3.5Å; S31-A35 VanDerWaalsContact O-N 3.09Å; L33-A35 VanDerWaalsContact C-N 3.27Å; L33-A35 PolarHBondContact O-N 3.27Å; A35-L37 VanDerWaalsContact C-N 3.27Å; A35-L37 PolarHBondContact O-N 2.9Å; A35-R38 PolarHBondContact O-N 3.28Å; A35-Q40 HydrophobicContact CB-CG 4.46Å; A35-P53 HydrophobicContact CB-CG 4.08Å
36	K	96.7	Very high	95.7	Very high	176 Å²	176	68.1 Å²	68.1	77%	0.765	32%	0.324	S	S	*	.	H	α-helix	trans	-61.3	-35.7	177.1	-75.1	175.6	179.2	-174.4	0	112.5	K32 L33 R38	K32-K36 WeakPolarHBondContact O-CG 3.31Å; K32-K36 PolarHBondContact O-N 3.01Å; L33-K36 WeakPolarHBondContact O-CB 3.46Å; L33-K36 PolarHBondContact O-N 3.36Å; K36-R38 PolarHBondContact O-N 2.93Å
37	L	96	Very high	95.2	Very high	103 Å²	103	73.3 Å²	73.3	54%	0.539	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	6.5	176.5	-64.4	174.3	0	0	0	113.3	L33 F34 A35 M39	L33-L37 HydrophobicContact CD1-CD1 4.25Å; L33-L37 HydrophobicContact CD1-CG 4.44Å; L33-L37 HydrophobicContact CG-CD1 4.14Å; L33-L37 WeakPolarHBondContact O-CG 3.42Å; L33-L37 PolarHBondContact O-N 3.23Å; F34-L37 CarbonylContact O-C 3.23Å; F34-L37 PolarHBondContact O-N 3.38Å; A35-L37 VanDerWaalsContact C-N 3.27Å; A35-L37 PolarHBondContact O-N 2.9Å; L37-M39 HydrophobicContact CB-CE 3.67Å; L37-M39 HydrophobicContact CB-CG 4.32Å; L37-M39 HydrophobicContact CD1-CE 3.45Å; L37-M39 VanDerWaalsContact CD1-CE 3.45Å; L37-M39 HydrophobicContact CG-CE 4.2Å; L37-M39 PolarHBondContact O-N 3.03Å; L37-M39 VanDerWaalsContact O-N 3.15Å
38	R	95.2	Very high	94.7	Very high	222 Å²	222	77.3 Å²	77.3	84%	0.838	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	22.2	-176.6	-56.5	-177.9	175.4	-176.9	-1.6	113.9	F34 A35 K36 Q40	F34-R38 PolarHBondContact O-N 3.23Å; A35-R38 PolarHBondContact O-N 3.28Å; K36-R38 PolarHBondContact O-N 2.93Å; R38-Q40 VanDerWaalsContact C-N 3.33Å; R38-Q40 PolarHBondContact O-N 3.38Å; R38-Q40 VanDerWaalsContact O-N 3.11Å
39	M	95.9	Very high	94.3	Very high	44 Å²	44	78.4 Å²	78.4	22%	0.217	37%	0.374	C	S	.	.			trans	-84.9	82.4	171.7	-67.3	-169.2	-81.5	0	0	108.4	F34 L37 Q54 I114	F34-M39 HydrophobicContact CB-CB 4.31Å; F34-M39 HydrophobicContact CD1-CB 3.75Å; F34-M39 HydrophobicContact CD1-CE 3.21Å; F34-M39 HydrophobicContact CD1-CG 4.33Å; F34-M39 HydrophobicContact CD1-SD 3.68Å; F34-M39 HydrophobicContact CE1-CE 3.37Å; F34-M39 HydrophobicContact CE1-SD 3.74Å; F34-M39 HydrophobicContact CG-CE 4.04Å; F34-M39 HydrophobicContact CZ-CE 4.32Å; F34-M39 PolarHBondContact O-N 3.3Å; L37-M39 HydrophobicContact CB-CE 3.67Å; L37-M39 HydrophobicContact CB-CG 4.32Å; L37-M39 HydrophobicContact CD1-CE 3.45Å; L37-M39 VanDerWaalsContact CD1-CE 3.45Å; L37-M39 HydrophobicContact CG-CE 4.2Å; L37-M39 PolarHBondContact O-N 3.03Å; L37-M39 VanDerWaalsContact O-N 3.15Å; M39-Q54 CarbonylContact C-O 3.6Å; M39-Q54 WeakPolarHBondContact CB-O 3.25Å; M39-Q54 PolarHBondContact O-N 3Å; M39-Q54 VanDerWaalsContact O-O 3.09Å; M39-I114 HydrophobicContact SD-CD1 3.63Å
40	Q	96.3	Very high	94	Very high	59 Å²	59	74.6 Å²	74.6	28%	0.276	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	147.1	-175	-61.6	-179.4	-79.9	0	0	110.8	A35 R38 M51 I52	A35-Q40 HydrophobicContact CB-CG 4.46Å; R38-Q40 VanDerWaalsContact C-N 3.33Å; R38-Q40 PolarHBondContact O-N 3.38Å; R38-Q40 VanDerWaalsContact O-N 3.11Å; Q40-M51 HydrophobicContact CB-CB 4.14Å; Q40-M51 HydrophobicContact CB-CE 3.85Å; Q40-M51 PolarHBondContact NE2-O 3Å; Q40-M51 VanDerWaalsContact NE2-O 3.16Å; Q40-I52 CarbonylContact C-O 3.59Å; Q40-I52 WeakPolarHBondContact CA-O 3.42Å; Q40-I52 WeakPolarHBondContact CB-O 3.21Å
41	G	93.8	Very high	94	Very high	12 Å²	12	75.6 Å²	75.6	12%	0.124	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	150.6	171.3	0	0	0	0	0	111.6	I52 F248	G41-I52 PolarHBondContact N-O 2.84Å; G41-I52 PolarHBondContact O-N 3.3Å; G41-F248 WeakPolarHBondContact O-CE2 3.37Å
42	T	94.8	Very high	93.9	Very high	62 Å²	62	75.5 Å²	75.5	38%	0.38	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	129.4	173.9	-51.6	0	0	0	0	110.5	M44 R49 M51	T42-M44 HydrophobicContact CG2-CG 4.48Å; T42-M44 PolarHBondContact O-N 3.37Å; T42-R49 HydrophobicContact CG2-CB 3.96Å; T42-M51 PolarHBondContact OG1-SD 3.11Å
43	D	94.7	Very high	94	Very high	6 Å²	6	69.9 Å²	69.9	3%	0.032	34%	0.343	C	S	.	.			trans	-77.7	87.2	173.3	-162	-10.3	0	0	0	111.5	C45 K46 R49 S50 I52 N188 F248	D43-C45 PolarHBondContact O-N 3.42Å; D43-K46 IonicContact OD1-NZ 3.59Å; D43-K46 WeakPolarHBondContact OD2-CD 3.41Å; D43-K46 IonicContact OD2-NZ 2.57Å; D43-K46 PolarHBondContact OD2-NZ 2.85Å; D43-R49 WeakPolarHBondContact O-CA 3.49Å; D43-S50 PolarHBondContact N-O 3.48Å; D43-I52 HydrophobicContact CB-CG1 4.09Å; D43-N188 PolarHBondContact OD1-ND2 3.11Å; D43-F248 HydrophobicContact CB-CZ 3.83Å
44	M	91.6	Very high	93.9	Very high	97 Å²	97	69 Å²	69	48%	0.478	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.3	-171.5	-68.1	-178.5	-77.4	0	0	114.4	T42 K46 L303	T42-M44 HydrophobicContact CG2-CG 4.48Å; T42-M44 PolarHBondContact O-N 3.37Å; M44-K46 VanDerWaalsContact C-N 3.32Å; M44-K46 PolarHBondContact O-N 2.99Å; M44-L303 HydrophobicContact CE-CD1 3.38Å; M44-L303 HydrophobicContact CE-CD2 4.46Å; M44-L303 HydrophobicContact CE-CG 4.48Å
45	C	89	Confident	93.9	Very high	6 Å²	6	68.3 Å²	68.3	4%	0.041	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	17.8	-175.1	-69.3	0	0	0	0	113.3	D43 Y306 L313	D43-C45 PolarHBondContact O-N 3.42Å; C45-Y306 VanDerWaalsContact O-CD2 3.27Å; C45-Y306 WeakPolarHBondContact O-CD2 3.28Å; C45-Y306 VanDerWaalsContact O-CE2 3.31Å; C45-Y306 WeakPolarHBondContact O-CE2 3.44Å; C45-L313 HydrophobicContact CB-CD2 3.83Å
46	K	87.9	Confident	94	Very high	13 Å²	13	66.9 Å²	66.9	6%	0.057	32%	0.321	C	S	.	.	S	Bend	trans	-144.1	152.8	-177.3	-59.7	-168.9	-175	109.2	0	112.5	D43 M44 S48 R49 N188 Y243 P244 E375	D43-K46 IonicContact OD1-NZ 3.59Å; D43-K46 WeakPolarHBondContact OD2-CD 3.41Å; D43-K46 IonicContact OD2-NZ 2.57Å; D43-K46 PolarHBondContact OD2-NZ 2.85Å; M44-K46 VanDerWaalsContact C-N 3.32Å; M44-K46 PolarHBondContact O-N 2.99Å; K46-S48 VanDerWaalsContact C-N 3.29Å; K46-S48 PolarHBondContact O-N 2.95Å; K46-R49 WeakPolarHBondContact O-CG 3.31Å; K46-R49 PolarHBondContact O-N 2.83Å; K46-N188 PolarHBondContact NZ-ND2 3.11Å; K46-Y243 HydrophobicContact CD-CE2 4.14Å; K46-Y243 HydrophobicContact CG-CE2 4.35Å; K46-P244 HydrophobicContact CD-CB 4.33Å; K46-E375 IonicContact NZ-OE2 3.33Å
47	K	87.7	Confident	94.1	Very high	150 Å²	150	58.5 Å²	58.5	65%	0.652	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.6	177.3	-172.2	173.4	-177.1	173.1	0	113.6	R49 Y306	K47-R49 VanDerWaalsContact C-N 3.27Å; K47-R49 PolarHBondContact O-N 3.4Å; K47-Y306 HydrophobicContact CB-CE1 4.32Å; K47-Y306 PolarHBondContact N-OH 3.36Å
48	S	89	Confident	94.2	Very high	84 Å²	84	54.9 Å²	54.9	59%	0.587	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.2	-178.7	60.2	0	0	0	0	113.5	K46 S50	K46-S48 VanDerWaalsContact C-N 3.29Å; K46-S48 PolarHBondContact O-N 2.95Å; S48-S50 PolarHBondContact O-N 3.36Å; S48-S50 PolarHBondContact OG-OG 3.14Å
49	R	88.8	Confident	94.4	Very high	143 Å²	143	44.9 Å²	44.9	54%	0.54	23%	0.231	S	C	.	.			trans	42.7	39.8	-170.6	-60.1	-169.7	-174.7	-163	5.6	113.1	T42 D43 K46 K47 E308	T42-R49 HydrophobicContact CG2-CB 3.96Å; D43-R49 WeakPolarHBondContact O-CA 3.49Å; K46-R49 WeakPolarHBondContact O-CG 3.31Å; K46-R49 PolarHBondContact O-N 2.83Å; K47-R49 VanDerWaalsContact C-N 3.27Å; K47-R49 PolarHBondContact O-N 3.4Å; R49-E308 IonicContact CZ-OE1 3.7Å; R49-E308 IonicContact NE-OE1 3.67Å; R49-E308 IonicContact NH2-OE1 2.91Å; R49-E308 PolarHBondContact NH2-OE1 3.4Å
50	S	92.7	Very high	94.5	Very high	44 Å²	44	42.8 Å²	42.8	31%	0.308	22%	0.22	S	C	.	.			trans	-63.2	146.4	-175.9	43.8	0	0	0	0	111.8	D43 S48	D43-S50 PolarHBondContact N-O 3.48Å; S48-S50 PolarHBondContact O-N 3.36Å; S48-S50 PolarHBondContact OG-OG 3.14Å
51	M	96.3	Very high	94.6	Very high	95 Å²	95	40 Å²	40	47%	0.468	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	118.1	172.6	-64.9	-61.8	-71.9	0	0	110	Q40 T42	Q40-M51 HydrophobicContact CB-CB 4.14Å; Q40-M51 HydrophobicContact CB-CE 3.85Å; Q40-M51 PolarHBondContact NE2-O 3Å; Q40-M51 VanDerWaalsContact NE2-O 3.16Å; T42-M51 PolarHBondContact OG1-SD 3.11Å
52	I	97.3	Very high	94.9	Very high	15 Å²	15	41.7 Å²	41.7	8%	0.077	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.7	-174	-61.2	-58.3	0	0	0	110.1	Q40 G41 D43 A245 V247 F248	Q40-I52 CarbonylContact C-O 3.59Å; Q40-I52 WeakPolarHBondContact CA-O 3.42Å; Q40-I52 WeakPolarHBondContact CB-O 3.21Å; G41-I52 PolarHBondContact N-O 2.84Å; G41-I52 PolarHBondContact O-N 3.3Å; D43-I52 HydrophobicContact CB-CG1 4.09Å; I52-A245 WeakPolarHBondContact CD1-O 3.42Å; I52-V247 VanDerWaalsContact CG2-C 3.45Å; I52-F248 HydrophobicContact CB-CD1 4.37Å; I52-F248 HydrophobicContact CB-CD2 3.97Å; I52-F248 HydrophobicContact CB-CE1 4.12Å; I52-F248 HydrophobicContact CB-CE2 3.72Å; I52-F248 HydrophobicContact CB-CG 4.29Å; I52-F248 HydrophobicContact CB-CZ 3.79Å; I52-F248 HydrophobicContact CG1-CE1 4.24Å; I52-F248 HydrophobicContact CG1-CE2 4.27Å; I52-F248 HydrophobicContact CG1-CZ 3.89Å; I52-F248 HydrophobicContact CG2-CD1 3.84Å; I52-F248 HydrophobicContact CG2-CD2 4.06Å; I52-F248 HydrophobicContact CG2-CE1 3.96Å; I52-F248 HydrophobicContact CG2-CE2 4.21Å; I52-F248 HydrophobicContact CG2-CG 3.88Å; I52-F248 HydrophobicContact CG2-CZ 4.15Å
53	P	98	Very high	95.1	Very high	14 Å²	14	38.9 Å²	38.9	9%	0.091	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	138.8	179.2	-24.2	35.3	0	0	0	113.9	S31 F34 A35 F248	S31-P53 WeakPolarHBondContact O-CB 3.48Å; S31-P53 VanDerWaalsContact O-CG 3.24Å; S31-P53 WeakPolarHBondContact O-CG 3.48Å; F34-P53 HydrophobicContact CB-CB 4.16Å; A35-P53 HydrophobicContact CB-CG 4.08Å; P53-F248 PolarHBondContact O-N 2.95Å
54	Q	97.3	Very high	95.3	Very high	56 Å²	56	38.6 Å²	38.6	26%	0.262	20%	0.202	S	C	.	.			trans	-152.1	157.2	178.6	77	177.6	40	0	0	110.8	F34 M39 F248	F34-Q54 VanDerWaalsContact CD1-O 3.32Å; F34-Q54 WeakPolarHBondContact CD1-O 3.47Å; M39-Q54 CarbonylContact C-O 3.6Å; M39-Q54 WeakPolarHBondContact CB-O 3.25Å; M39-Q54 PolarHBondContact O-N 3Å; M39-Q54 VanDerWaalsContact O-O 3.09Å; Q54-F248 HydrophobicContact CB-CB 3.86Å
55	P	97.6	Very high	95.6	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.019	18%	0.181	C	C	.	.			cis	-92.6	103.8	-5	35.7	-35.5	0	0	0	112.4	G57 V58 F110 D113 V249	P55-G57 PolarHBondContact O-N 3.43Å; P55-V58 WeakPolarHBondContact O-CG1 3.24Å; P55-V58 PolarHBondContact O-N 3.23Å; P55-F110 HydrophobicContact CG-CD2 3.87Å; P55-F110 HydrophobicContact CG-CE2 4.03Å; P55-D113 HydrophobicContact CB-CB 4.02Å; P55-D113 VanDerWaalsContact CB-CG 3.45Å; P55-D113 WeakPolarHBondContact CB-OD2 3.42Å; P55-D113 HydrophobicContact CG-CB 3.72Å; P55-D113 WeakPolarHBondContact CG-OD2 3.38Å; P55-V249 CarbonylContact C-O 3.41Å
56	M	98.4	Very high	96.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-8.3	-174.9	-69.2	-57.4	-60.5	0	0	114.4	V27 F30 F34 V58 V59 L237 V247 F248	V27-M56 HydrophobicContact CB-CE 4.14Å; V27-M56 HydrophobicContact CG1-CE 3.89Å; V27-M56 HydrophobicContact CG2-CE 4.28Å; V27-M56 WeakPolarHBondContact O-CE 3.39Å; F30-M56 HydrophobicContact CB-CE 3.92Å; F34-M56 HydrophobicContact CD2-SD 3.73Å; F34-M56 HydrophobicContact CE2-SD 4.25Å; F34-M56 HydrophobicContact CG-SD 4.23Å; M56-V58 PolarHBondContact O-N 3.14Å; M56-V59 HydrophobicContact CE-CB 4.19Å; M56-V59 HydrophobicContact CE-CG2 3.66Å; M56-V59 PolarHBondContact O-N 3.05Å; M56-V59 HydrophobicContact SD-CG2 4.29Å; M56-L237 HydrophobicContact CB-CD1 4.28Å; M56-V247 HydrophobicContact CB-CB 3.8Å; M56-V247 HydrophobicContact CB-CG1 4.3Å; M56-V247 HydrophobicContact CB-CG2 3.93Å; M56-V247 HydrophobicContact CG-CB 3.55Å; M56-V247 HydrophobicContact CG-CG1 3.71Å; M56-V247 HydrophobicContact CG-CG2 4.23Å; M56-F248 PolarHBondContact N-O 3.24Å
57	G	98.5	Very high	96.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.8	-31.4	167.5	0	0	0	0	0	113.3	P55 V59 T60 A61 V249	P55-G57 PolarHBondContact O-N 3.43Å; G57-V59 VanDerWaalsContact C-N 3.28Å; G57-V59 PolarHBondContact O-N 3Å; G57-T60 PolarHBondContact O-N 3.47Å; G57-T60 PolarHBondContact O-OG1 2.96Å; G57-T60 VanDerWaalsContact O-OG1 3.05Å; G57-A61 WeakPolarHBondContact O-CB 3.33Å; G57-A61 PolarHBondContact O-N 2.82Å; G57-V249 VanDerWaalsContact CA-O 3.3Å; G57-V249 WeakPolarHBondContact CA-O 3.45Å; G57-V249 PolarHBondContact N-O 3.23Å
58	V	98.5	Very high	97.1	Very high	28 Å²	28	30.6 Å²	30.6	17%	0.17	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-35.8	178.8	77.1	0	0	0	0	112.2	F34 P55 M56 A62 F110 T252	F34-V58 HydrophobicContact CE2-CG1 4.34Å; F34-V58 HydrophobicContact CZ-CG1 3.81Å; P55-V58 WeakPolarHBondContact O-CG1 3.24Å; P55-V58 PolarHBondContact O-N 3.23Å; M56-V58 PolarHBondContact O-N 3.14Å; V58-A62 WeakPolarHBondContact O-CB 3.35Å; V58-A62 PolarHBondContact O-N 3.02Å; V58-F110 HydrophobicContact CB-CD2 4.15Å; V58-F110 HydrophobicContact CG1-CD2 4.45Å; V58-F110 HydrophobicContact CG1-CE2 4.47Å; V58-F110 HydrophobicContact CG2-CB 4.42Å; V58-F110 HydrophobicContact CG2-CD2 3.85Å; V58-F110 HydrophobicContact CG2-CE2 4.41Å; V58-F110 HydrophobicContact CG2-CG 4.21Å; V58-T252 HydrophobicContact CB-CG2 3.9Å; V58-T252 HydrophobicContact CG2-CG2 4.18Å
59	V	98.5	Very high	97.5	Very high	11 Å²	11	31.5 Å²	31.5	7%	0.067	16%	0.16	C	C	.	.	H	α-helix	trans	-70.1	-47.2	-178.7	178.4	0	0	0	0	110.2	L26 V27 F30 F34 M56 G57 A61 A62 I63	L26-V59 HydrophobicContact CB-CG1 3.85Å; V27-V59 HydrophobicContact CG2-CB 4.47Å; V27-V59 HydrophobicContact CG2-CG1 4.15Å; F30-V59 HydrophobicContact CB-CG2 3.78Å; F30-V59 HydrophobicContact CD1-CG2 4.43Å; F30-V59 HydrophobicContact CG-CG2 4.05Å; F34-V59 HydrophobicContact CE2-CG2 4.3Å; M56-V59 HydrophobicContact CE-CB 4.19Å; M56-V59 HydrophobicContact CE-CG2 3.66Å; M56-V59 PolarHBondContact O-N 3.05Å; M56-V59 HydrophobicContact SD-CG2 4.29Å; G57-V59 VanDerWaalsContact C-N 3.28Å; G57-V59 PolarHBondContact O-N 3Å; V59-A61 VanDerWaalsContact C-N 3.33Å; V59-A61 PolarHBondContact O-N 2.98Å; V59-A62 PolarHBondContact O-N 3.2Å; V59-I63 HydrophobicContact CG1-CD1 4.12Å; V59-I63 WeakPolarHBondContact O-CD1 3.41Å; V59-I63 VanDerWaalsContact O-CG1 3.29Å; V59-I63 WeakPolarHBondContact O-CG1 3.37Å; V59-I63 PolarHBondContact O-N 3.19Å; V59-I63 VanDerWaalsContact O-N 3.12Å
60	T	98.6	Very high	98	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69.2	-32.2	177.4	50.4	0	0	0	0	112.8	A23 V27 G57 Y64 L237	A23-T60 HydrophobicContact CB-CG2 4.39Å; V27-T60 HydrophobicContact CG2-CG2 3.89Å; G57-T60 PolarHBondContact O-N 3.47Å; G57-T60 PolarHBondContact O-OG1 2.96Å; G57-T60 VanDerWaalsContact O-OG1 3.05Å; T60-Y64 VanDerWaalsContact O-CB 3.31Å; T60-Y64 WeakPolarHBondContact O-CB 3.44Å; T60-Y64 PolarHBondContact O-N 3.11Å; T60-L237 HydrophobicContact CG2-CB 3.93Å; T60-L237 HydrophobicContact CG2-CD1 4.28Å
61	A	98.8	Very high	98.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.7	-42.8	173.6	0	0	0	0	0	111.7	G57 V59 I63 Y64 M65 I106 F256	G57-A61 WeakPolarHBondContact O-CB 3.33Å; G57-A61 PolarHBondContact O-N 2.82Å; V59-A61 VanDerWaalsContact C-N 3.33Å; V59-A61 PolarHBondContact O-N 2.98Å; A61-I63 VanDerWaalsContact C-N 3.34Å; A61-I63 PolarHBondContact O-N 3.37Å; A61-Y64 WeakPolarHBondContact O-CB 3.39Å; A61-Y64 PolarHBondContact O-N 3.46Å; A61-M65 WeakPolarHBondContact O-CG 3.28Å; A61-M65 PolarHBondContact O-N 3.08Å; A61-I106 HydrophobicContact CB-CD1 3.81Å; A61-I106 HydrophobicContact CB-CG1 3.91Å; A61-I106 HydrophobicContact CB-CG2 4.04Å; A61-F256 HydrophobicContact CB-CD1 3.77Å; A61-F256 HydrophobicContact CB-CE1 4.07Å; A61-F256 HydrophobicContact CB-CG 4.11Å
62	A	98.6	Very high	98.3	Very high	48 Å²	48	24.3 Å²	24.3	40%	0.397	13%	0.13	S	C	.	.	H	α-helix	trans	-60.8	-42.8	175.5	0	0	0	0	0	111.9	V58 V59 M65 I66	V58-A62 WeakPolarHBondContact O-CB 3.35Å; V58-A62 PolarHBondContact O-N 3.02Å; V59-A62 PolarHBondContact O-N 3.2Å; A62-M65 PolarHBondContact O-N 2.97Å; A62-I66 WeakPolarHBondContact O-CG1 3.43Å; A62-I66 PolarHBondContact O-N 3.21Å
63	I	98.7	Very high	98.2	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-66.3	-41.3	176.8	-64.8	165.9	0	0	0	111	G19 L22 A23 L26 V59 A61 M65 I66 I67 T233	G19-I63 WeakPolarHBondContact O-CG2 3.2Å; L22-I63 HydrophobicContact CD2-CG1 4.41Å; L22-I63 HydrophobicContact CD2-CG2 4.37Å; L22-I63 HydrophobicContact CG-CD1 4.38Å; A23-I63 HydrophobicContact CB-CD1 3.69Å; A23-I63 HydrophobicContact CB-CG2 4.44Å; L26-I63 HydrophobicContact CB-CD1 4.09Å; L26-I63 HydrophobicContact CD1-CD1 3.8Å; L26-I63 HydrophobicContact CD1-CG1 4.12Å; L26-I63 HydrophobicContact CG-CD1 4.38Å; V59-I63 HydrophobicContact CG1-CD1 4.12Å; V59-I63 WeakPolarHBondContact O-CD1 3.41Å; V59-I63 VanDerWaalsContact O-CG1 3.29Å; V59-I63 WeakPolarHBondContact O-CG1 3.37Å; V59-I63 PolarHBondContact O-N 3.19Å; V59-I63 VanDerWaalsContact O-N 3.12Å; A61-I63 VanDerWaalsContact C-N 3.34Å; A61-I63 PolarHBondContact O-N 3.37Å; I63-M65 VanDerWaalsContact C-N 3.3Å; I63-M65 PolarHBondContact O-N 2.95Å; I63-I66 PolarHBondContact O-N 3.35Å; I63-I67 HydrophobicContact CG2-CD1 4.28Å; I63-I67 VanDerWaalsContact O-CG1 3.3Å; I63-I67 WeakPolarHBondContact O-CG1 3.48Å; I63-I67 PolarHBondContact O-N 2.9Å; I63-T233 HydrophobicContact CG2-CG2 4.2Å
64	Y	98.8	Very high	98.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-55.8	-44.7	171.4	172.5	-92.2	0	0	0	112	T60 A61 I67 L68 I102 F226 P229 F256 L260	T60-Y64 VanDerWaalsContact O-CB 3.31Å; T60-Y64 WeakPolarHBondContact O-CB 3.44Å; T60-Y64 PolarHBondContact O-N 3.11Å; A61-Y64 WeakPolarHBondContact O-CB 3.39Å; A61-Y64 PolarHBondContact O-N 3.46Å; Y64-I67 WeakPolarHBondContact O-CB 3.37Å; Y64-I67 PolarHBondContact O-N 3.4Å; Y64-L68 HydrophobicContact CD1-CD1 4.2Å; Y64-L68 HydrophobicContact CD1-CG 4.39Å; Y64-L68 HydrophobicContact CE1-CD1 3.34Å; Y64-L68 HydrophobicContact CE1-CG 3.86Å; Y64-L68 HydrophobicContact CE2-CG 4.47Å; Y64-L68 PolarHBondContact O-N 3.22Å; Y64-I102 HydrophobicContact CE1-CD1 4.41Å; Y64-I102 HydrophobicContact CE1-CG2 4.23Å; Y64-F226 VanDerWaalsContact CE2-O 3.29Å; Y64-F226 WeakPolarHBondContact CE2-O 3.36Å; Y64-F226 WeakPolarHBondContact OH-CD1 3.42Å; Y64-F226 PolarHBondContact OH-O 3.43Å; Y64-P229 HydrophobicContact CD2-CB 4Å; Y64-P229 HydrophobicContact CD2-CG 4.34Å; Y64-P229 HydrophobicContact CE2-CB 3.96Å; Y64-P229 HydrophobicContact CE2-CG 3.79Å; Y64-F256 AromaticContact CD1-CE2 3.48Å; Y64-F256 HydrophobicContact CD1-CE2 3.48Å; Y64-F256 VanDerWaalsContact CD1-CE2 3.48Å; Y64-F256 AromaticContact CD1-CZ 3.44Å; Y64-F256 HydrophobicContact CD1-CZ 3.44Å; Y64-F256 VanDerWaalsContact CD1-CZ 3.44Å; Y64-F256 AromaticContact CD2-CZ 3.98Å; Y64-F256 HydrophobicContact CD2-CZ 3.98Å; Y64-F256 AromaticContact CE1-CE2 3.61Å; Y64-F256 HydrophobicContact CE1-CE2 3.61Å; Y64-F256 AromaticContact CE1-CZ 3.89Å; Y64-F256 HydrophobicContact CE1-CZ 3.89Å; Y64-F256 HydrophobicContact CE2-CZ 4.36Å; Y64-F256 HydrophobicContact CG-CE1 4.49Å; Y64-F256 HydrophobicContact CG-CE2 4.05Å; Y64-F256 AromaticContact CG-CZ 3.49Å; Y64-F256 HydrophobicContact CG-CZ 3.49Å; Y64-F256 VanDerWaalsContact CG-CZ 3.49Å; Y64-L260 HydrophobicContact CE1-CD1 4.07Å; Y64-L260 HydrophobicContact CE2-CD1 3.87Å; Y64-L260 VanDerWaalsContact CZ-CD1 3.43Å; Y64-L260 WeakPolarHBondContact OH-CD1 3.31Å
65	M	98.7	Very high	98	Very high	11 Å²	11	24.2 Å²	24.2	5%	0.054	14%	0.137	C	C	.	.	H	α-helix	trans	-64.7	-41.1	177	-67.5	-55.6	-62.7	0	0	112.3	A61 A62 I63 I67 L68 F69 V99 I102 C103 I106	A61-M65 WeakPolarHBondContact O-CG 3.28Å; A61-M65 PolarHBondContact O-N 3.08Å; A62-M65 PolarHBondContact O-N 2.97Å; I63-M65 VanDerWaalsContact C-N 3.3Å; I63-M65 PolarHBondContact O-N 2.95Å; M65-I67 VanDerWaalsContact C-N 3.3Å; M65-I67 PolarHBondContact O-N 3.25Å; M65-L68 PolarHBondContact O-N 3.15Å; M65-F69 HydrophobicContact CB-CE2 4.12Å; M65-F69 HydrophobicContact CB-CZ 4.24Å; M65-F69 HydrophobicContact CE-CE1 3.68Å; M65-F69 HydrophobicContact CE-CZ 3.64Å; M65-F69 VanDerWaalsContact O-CD2 3.31Å; M65-F69 WeakPolarHBondContact O-CD2 3.46Å; M65-F69 WeakPolarHBondContact O-CG 3.41Å; M65-F69 PolarHBondContact O-N 3.3Å; M65-V99 HydrophobicContact CE-CG1 3.67Å; M65-I102 HydrophobicContact SD-CG2 3.74Å; M65-C103 HydrophobicContact CE-CB 3.81Å; M65-I106 HydrophobicContact CG-CD1 3.57Å; M65-I106 HydrophobicContact SD-CD1 3.78Å
66	I	98.6	Very high	97.8	Very high	82 Å²	82	24.4 Å²	24.4	42%	0.421	14%	0.137	S	C	.	.	H	α-helix	trans	-58.2	-44.5	174.1	-68.9	165.5	0	0	0	110.5	A62 I63 L68 F69 L70	A62-I66 WeakPolarHBondContact O-CG1 3.43Å; A62-I66 PolarHBondContact O-N 3.21Å; I63-I66 PolarHBondContact O-N 3.35Å; I66-L68 PolarHBondContact O-N 3.06Å; I66-F69 PolarHBondContact O-N 3.3Å; I66-L70 HydrophobicContact CG2-CD1 3.96Å; I66-L70 HydrophobicContact CG2-CG 4.42Å; I66-L70 WeakPolarHBondContact O-CG 3.36Å; I66-L70 PolarHBondContact O-N 3.15Å
67	I	98.7	Very high	97.6	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-58.6	-49.2	176	-64.5	161.3	0	0	0	110.3	L15 I63 Y64 M65 F69 L70 F71 P229 T233	L15-I67 HydrophobicContact CB-CG2 3.81Å; I63-I67 HydrophobicContact CG2-CD1 4.28Å; I63-I67 VanDerWaalsContact O-CG1 3.3Å; I63-I67 WeakPolarHBondContact O-CG1 3.48Å; I63-I67 PolarHBondContact O-N 2.9Å; Y64-I67 WeakPolarHBondContact O-CB 3.37Å; Y64-I67 PolarHBondContact O-N 3.4Å; M65-I67 VanDerWaalsContact C-N 3.3Å; M65-I67 PolarHBondContact O-N 3.25Å; I67-F69 PolarHBondContact O-N 3.29Å; I67-L70 PolarHBondContact O-N 2.9Å; I67-F71 WeakPolarHBondContact O-CB 3.21Å; I67-F71 PolarHBondContact O-N 3.41Å; I67-P229 HydrophobicContact CB-CB 4.41Å; I67-P229 HydrophobicContact CD1-CB 4.26Å; I67-P229 HydrophobicContact CG2-CB 3.69Å; I67-P229 HydrophobicContact CG2-CG 4.36Å; I67-T233 HydrophobicContact CD1-CG2 3.81Å
68	L	98.5	Very high	97.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-41.5	178.9	-69.8	-168.4	0	0	0	112.5	Y64 M65 I66 F71 I72 F95 V99 F226 P229	Y64-L68 HydrophobicContact CD1-CD1 4.2Å; Y64-L68 HydrophobicContact CD1-CG 4.39Å; Y64-L68 HydrophobicContact CE1-CD1 3.34Å; Y64-L68 HydrophobicContact CE1-CG 3.86Å; Y64-L68 HydrophobicContact CE2-CG 4.47Å; Y64-L68 PolarHBondContact O-N 3.22Å; M65-L68 PolarHBondContact O-N 3.15Å; I66-L68 PolarHBondContact O-N 3.06Å; L68-F71 CarbonylContact O-C 3.56Å; L68-F71 WeakPolarHBondContact O-CB 3.42Å; L68-F71 PolarHBondContact O-N 3.3Å; L68-F71 VanDerWaalsContact O-N 3.13Å; L68-I72 WeakPolarHBondContact O-CG1 3.18Å; L68-I72 PolarHBondContact O-N 2.92Å; L68-F95 HydrophobicContact CD2-CZ 4.41Å; L68-V99 HydrophobicContact CB-CG2 4.41Å; L68-V99 HydrophobicContact CD1-CG2 4.02Å; L68-F226 HydrophobicContact CD1-CD1 3.77Å; L68-F226 HydrophobicContact CD1-CE1 3.67Å; L68-P229 HydrophobicContact CD2-CG 4.02Å
69	F	98.4	Very high	96.9	Very high	103 Å²	103	38.6 Å²	38.6	45%	0.452	19%	0.189	S	C	.	.	H	α-helix	trans	-62.9	-44.8	178.6	-63.7	-27.9	0	0	0	112.2	M65 I66 I67 F71 I72 V99	M65-F69 HydrophobicContact CB-CE2 4.12Å; M65-F69 HydrophobicContact CB-CZ 4.24Å; M65-F69 HydrophobicContact CE-CE1 3.68Å; M65-F69 HydrophobicContact CE-CZ 3.64Å; M65-F69 VanDerWaalsContact O-CD2 3.31Å; M65-F69 WeakPolarHBondContact O-CD2 3.46Å; M65-F69 WeakPolarHBondContact O-CG 3.41Å; M65-F69 PolarHBondContact O-N 3.3Å; I66-F69 PolarHBondContact O-N 3.3Å; I67-F69 PolarHBondContact O-N 3.29Å; F69-F71 PolarHBondContact O-N 3.49Å; F69-I72 HydrophobicContact CD1-CD1 4.3Å; F69-I72 PolarHBondContact O-N 3.07Å; F69-V99 HydrophobicContact CD1-CG1 4.1Å; F69-V99 HydrophobicContact CE1-CG1 3.5Å; F69-V99 VanDerWaalsContact CE1-CG1 3.5Å
70	L	98.2	Very high	96.5	Very high	94 Å²	94	41.7 Å²	41.7	49%	0.492	20%	0.204	S	C	.	.	H	α-helix	trans	-66.4	-28.3	174.3	-65.8	175.1	0	0	0	112	L15 I66 I67 P73	L15-L70 HydrophobicContact CD1-CB 4.05Å; L15-L70 HydrophobicContact CD2-CB 4.31Å; L15-L70 HydrophobicContact CD2-CD1 4.32Å; I66-L70 HydrophobicContact CG2-CD1 3.96Å; I66-L70 HydrophobicContact CG2-CG 4.42Å; I66-L70 WeakPolarHBondContact O-CG 3.36Å; I66-L70 PolarHBondContact O-N 3.15Å; I67-L70 PolarHBondContact O-N 2.9Å; L70-P73 WeakPolarHBondContact O-CD 3.45Å
71	F	98.1	Very high	96.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-78.4	-21.7	179.6	-172.1	-109.2	0	0	0	114	P8 Y11 N12 L15 I67 L68 F69 P73 A74 P75 F95 Y225	P8-F71 HydrophobicContact CB-CZ 4.23Å; P8-F71 WeakPolarHBondContact O-CE2 3.39Å; Y11-F71 AromaticContact CD1-CD2 3.68Å; Y11-F71 HydrophobicContact CD1-CD2 3.68Å; Y11-F71 HydrophobicContact CD1-CE2 4.04Å; Y11-F71 HydrophobicContact CE1-CD2 4.23Å; N12-F71 HydrophobicContact CB-CD2 4.01Å; N12-F71 HydrophobicContact CB-CE2 3.51Å; N12-F71 HydrophobicContact CB-CZ 3.86Å; L15-F71 HydrophobicContact CD1-CB 3.89Å; L15-F71 HydrophobicContact CD1-CD2 4.18Å; I67-F71 WeakPolarHBondContact O-CB 3.21Å; I67-F71 PolarHBondContact O-N 3.41Å; L68-F71 CarbonylContact O-C 3.56Å; L68-F71 WeakPolarHBondContact O-CB 3.42Å; L68-F71 PolarHBondContact O-N 3.3Å; L68-F71 VanDerWaalsContact O-N 3.13Å; F69-F71 PolarHBondContact O-N 3.49Å; F71-P73 VanDerWaalsContact C-CD 3.48Å; F71-P73 VanDerWaalsContact C-N 3.33Å; F71-P73 VanDerWaalsContact O-N 3.13Å; F71-A74 HydrophobicContact CD2-CB 3.9Å; F71-A74 HydrophobicContact CE2-CB 3.67Å; F71-A74 HydrophobicContact CZ-CB 4.31Å; F71-A74 WeakPolarHBondContact O-CB 3.36Å; F71-A74 PolarHBondContact O-N 2.89Å; F71-P75 HydrophobicContact CD1-CG 4.13Å; F71-P75 HydrophobicContact CE1-CG 3.35Å; F71-P75 HydrophobicContact CZ-CG 3.65Å; F71-P75 WeakPolarHBondContact O-CD 3.19Å; F71-F95 HydrophobicContact CD1-CE2 4.14Å; F71-F95 AromaticContact CD1-CZ 3.96Å; F71-F95 HydrophobicContact CD1-CZ 3.96Å; F71-F95 HydrophobicContact CE1-CE2 4.36Å; F71-Y225 AromaticContact CE1-CD1 3.64Å; F71-Y225 HydrophobicContact CE1-CD1 3.64Å; F71-Y225 AromaticContact CE1-CD2 3.93Å; F71-Y225 HydrophobicContact CE1-CD2 3.93Å; F71-Y225 HydrophobicContact CE1-CE1 4.27Å; F71-Y225 AromaticContact CE1-CG 3.46Å; F71-Y225 HydrophobicContact CE1-CG 3.46Å; F71-Y225 VanDerWaalsContact CE1-CG 3.46Å; F71-Y225 AromaticContact CZ-CD1 3.53Å; F71-Y225 HydrophobicContact CZ-CD1 3.53Å; F71-Y225 HydrophobicContact CZ-CD2 4.42Å; F71-Y225 AromaticContact CZ-CE1 3.83Å; F71-Y225 HydrophobicContact CZ-CE1 3.83Å; F71-Y225 AromaticContact CZ-CG 3.87Å; F71-Y225 HydrophobicContact CZ-CG 3.87Å
72	I	97	Very high	95.6	Very high	36 Å²	36	52.5 Å²	52.5	19%	0.185	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45	-49.1	-175.5	-73.9	165.5	0	0	0	113	L68 F69 A74 P75 F76 F92 F95 L96	L68-I72 WeakPolarHBondContact O-CG1 3.18Å; L68-I72 PolarHBondContact O-N 2.92Å; F69-I72 HydrophobicContact CD1-CD1 4.3Å; F69-I72 PolarHBondContact O-N 3.07Å; I72-A74 VanDerWaalsContact C-N 3.27Å; I72-A74 PolarHBondContact O-N 3.38Å; I72-P75 WeakPolarHBondContact O-CD 3.45Å; I72-F76 VanDerWaalsContact O-CD2 3.27Å; I72-F76 WeakPolarHBondContact O-CD2 3.14Å; I72-F92 HydrophobicContact CG2-CE2 3.94Å; I72-F95 HydrophobicContact CB-CE1 4.49Å; I72-F95 HydrophobicContact CG1-CD1 4.03Å; I72-F95 HydrophobicContact CG1-CE1 3.56Å; I72-L96 HydrophobicContact CD1-CD2 4.11Å
73	P	95.6	Very high	95	Very high	47 Å²	47	55.3 Å²	55.3	31%	0.305	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.1	-176.2	-21.1	34.8	0	0	0	114.1	L70 F71 F76 Y77 I80	L70-P73 WeakPolarHBondContact O-CD 3.45Å; F71-P73 VanDerWaalsContact C-CD 3.48Å; F71-P73 VanDerWaalsContact C-N 3.33Å; F71-P73 VanDerWaalsContact O-N 3.13Å; P73-F76 CarbonylContact O-C 2.93Å; P73-F76 PolarHBondContact O-N 3.38Å; P73-Y77 PolarHBondContact O-N 3.02Å; P73-I80 HydrophobicContact CB-CD1 4.44Å
74	A	95.8	Very high	94.4	Very high	15 Å²	15	59.7 Å²	59.7	12%	0.124	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-69	-47.5	-167	0	0	0	0	0	114.2	Y11 F71 I72 F76 Y77	Y11-A74 HydrophobicContact CD1-CB 3.41Å; Y11-A74 VanDerWaalsContact CD1-CB 3.41Å; Y11-A74 HydrophobicContact CE1-CB 3.96Å; Y11-A74 HydrophobicContact CG-CB 4.33Å; F71-A74 HydrophobicContact CD2-CB 3.9Å; F71-A74 HydrophobicContact CE2-CB 3.67Å; F71-A74 HydrophobicContact CZ-CB 4.31Å; F71-A74 WeakPolarHBondContact O-CB 3.36Å; F71-A74 PolarHBondContact O-N 2.89Å; I72-A74 VanDerWaalsContact C-N 3.27Å; I72-A74 PolarHBondContact O-N 3.38Å; A74-F76 PolarHBondContact O-N 3.48Å; A74-F76 VanDerWaalsContact O-N 3.14Å; A74-Y77 WeakPolarHBondContact O-CB 3.29Å; A74-Y77 PolarHBondContact O-N 3.18Å
75	P	94.9	Very high	93.7	Very high	21 Å²	21	64.8 Å²	64.8	14%	0.136	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-60.4	-21.4	173.3	-24.5	34.9	0	0	0	113.9	F71 I72 W79 Y225	F71-P75 HydrophobicContact CD1-CG 4.13Å; F71-P75 HydrophobicContact CE1-CG 3.35Å; F71-P75 HydrophobicContact CZ-CG 3.65Å; F71-P75 WeakPolarHBondContact O-CD 3.19Å; I72-P75 WeakPolarHBondContact O-CD 3.45Å; P75-W79 WeakPolarHBondContact O-CZ3 3.35Å; P75-Y225 HydrophobicContact CB-CD2 4.42Å; P75-Y225 HydrophobicContact CB-CE2 3.8Å; P75-Y225 HydrophobicContact CG-CD2 3.9Å; P75-Y225 HydrophobicContact CG-CE2 3.69Å
76	F	94.7	Very high	93.4	Very high	8 Å²	8	72.3 Å²	72.3	4%	0.035	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-108	7.4	-175.3	-56.2	-81.7	0	0	0	113.4	I72 P73 A74 R78 W79 I80 F87 P88 R91 F92	I72-F76 VanDerWaalsContact O-CD2 3.27Å; I72-F76 WeakPolarHBondContact O-CD2 3.14Å; P73-F76 CarbonylContact O-C 2.93Å; P73-F76 PolarHBondContact O-N 3.38Å; A74-F76 PolarHBondContact O-N 3.48Å; A74-F76 VanDerWaalsContact O-N 3.14Å; F76-R78 VanDerWaalsContact C-N 3.31Å; F76-R78 PolarHBondContact O-N 2.91Å; F76-W79 PolarHBondContact O-N 3.18Å; F76-I80 HydrophobicContact CB-CD1 3.76Å; F76-I80 HydrophobicContact CB-CG1 4.17Å; F76-I80 WeakPolarHBondContact O-CG1 3.15Å; F76-I80 PolarHBondContact O-N 3.05Å; F76-F87 HydrophobicContact CB-CE2 4.09Å; F76-F87 HydrophobicContact CB-CZ 4.36Å; F76-F87 HydrophobicContact CD1-CE2 4.23Å; F76-F87 AromaticContact CD1-CZ 3.92Å; F76-F87 HydrophobicContact CD1-CZ 3.92Å; F76-F87 HydrophobicContact CG-CE2 4.4Å; F76-F87 HydrophobicContact CG-CZ 4.21Å; F76-P88 HydrophobicContact CD1-CG 3.84Å; F76-P88 HydrophobicContact CE1-CG 4.04Å; F76-R91 HydrophobicContact CE1-CB 4.01Å; F76-R91 HydrophobicContact CZ-CB 4.28Å; F76-F92 HydrophobicContact CD1-CB 4.43Å; F76-F92 HydrophobicContact CD1-CD2 4.48Å; F76-F92 AromaticContact CD2-CD2 4Å; F76-F92 HydrophobicContact CD2-CD2 4Å; F76-F92 HydrophobicContact CE1-CB 3.77Å; F76-F92 HydrophobicContact CE1-CD2 4.28Å; F76-F92 AromaticContact CE2-CD2 3.79Å; F76-F92 HydrophobicContact CE2-CD2 3.79Å; F76-F92 HydrophobicContact CG-CD2 4.36Å; F76-F92 VanDerWaalsContact CZ-CA 3.4Å; F76-F92 HydrophobicContact CZ-CB 3.87Å; F76-F92 AromaticContact CZ-CD2 3.96Å; F76-F92 HydrophobicContact CZ-CD2 3.96Å; F76-F92 HydrophobicContact CZ-CG 4.44Å
77	Y	92.7	Very high	93.2	Very high	123 Å²	123	70.5 Å²	70.5	48%	0.482	35%	0.349	S	S	.	.	H	α-helix	trans	-50.3	-48	-171.5	178.4	-87.8	0	0	0	112.9	P73 A74 W79 I80 Y81 D82	P73-Y77 PolarHBondContact O-N 3.02Å; A74-Y77 WeakPolarHBondContact O-CB 3.29Å; A74-Y77 PolarHBondContact O-N 3.18Å; Y77-W79 VanDerWaalsContact C-N 3.28Å; Y77-W79 PolarHBondContact O-N 3.18Å; Y77-I80 PolarHBondContact O-N 3.29Å; Y77-Y81 AromaticContact CD2-CD2 3.46Å; Y77-Y81 HydrophobicContact CD2-CD2 3.46Å; Y77-Y81 VanDerWaalsContact CD2-CD2 3.46Å; Y77-Y81 HydrophobicContact CD2-CE2 4.03Å; Y77-Y81 HydrophobicContact CD2-CG 4.35Å; Y77-Y81 AromaticContact CE2-CD2 3.65Å; Y77-Y81 HydrophobicContact CE2-CD2 3.65Å; Y77-Y81 HydrophobicContact CE2-CE2 4.33Å; Y77-Y81 HydrophobicContact CE2-CG 4.16Å; Y77-Y81 HydrophobicContact CG-CD2 4.09Å; Y77-Y81 PolarHBondContact O-N 3.15Å; Y77-D82 WeakPolarHBondContact CE1-OD2 3.4Å
78	R	91	Very high	93	Very high	126 Å²	126	70.8 Å²	70.8	48%	0.475	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-34.8	-177.7	-62.5	-175.7	177	165.8	-1.1	113.3	F76 D82 S83 E84	F76-R78 VanDerWaalsContact C-N 3.31Å; F76-R78 PolarHBondContact O-N 2.91Å; R78-D82 CarbonylContact O-C 3.39Å; R78-D82 WeakPolarHBondContact O-CA 3.42Å; R78-D82 VanDerWaalsContact O-CB 3.3Å; R78-D82 WeakPolarHBondContact O-CB 3.46Å; R78-D82 PolarHBondContact O-N 3.14Å; R78-D82 VanDerWaalsContact O-N 3.15Å; R78-S83 PolarHBondContact O-N 2.86Å; R78-E84 HydrophobicContact CB-CG 3.86Å; R78-E84 PolarHBondContact O-N 3.47Å
79	W	92.6	Very high	92.8	Very high	76 Å²	76	78.4 Å²	78.4	29%	0.288	38%	0.381	S	S	.	.	H	α-helix	trans	-83.3	-28.3	178.3	-61.8	-86.7	0	0	0	113.1	P75 F76 Y77 E84 M86 F87 P88	P75-W79 WeakPolarHBondContact O-CZ3 3.35Å; F76-W79 PolarHBondContact O-N 3.18Å; Y77-W79 VanDerWaalsContact C-N 3.28Å; Y77-W79 PolarHBondContact O-N 3.18Å; W79-E84 HydrophobicContact CG-CB 4.15Å; W79-M86 VanDerWaalsContact CD1-O 3.31Å; W79-M86 PolarHBondContact NE1-O 3.24Å; W79-F87 HydrophobicContact CB-CD2 3.65Å; W79-F87 HydrophobicContact CB-CE2 4.22Å; W79-F87 HydrophobicContact CG-CD2 4.49Å; W79-P88 HydrophobicContact CD2-CG 3.79Å; W79-P88 HydrophobicContact CE3-CG 4.04Å; W79-P88 VanDerWaalsContact CG-CD 3.44Å; W79-P88 HydrophobicContact CG-CG 4.26Å; W79-P88 HydrophobicContact CH2-CG 4.31Å; W79-P88 HydrophobicContact CZ2-CG 4.09Å; W79-P88 HydrophobicContact CZ3-CG 4.29Å
80	I	90.5	Very high	92.6	Very high	76 Å²	76	77.9 Å²	77.9	39%	0.39	38%	0.38	S	S	.	.	H	α-helix	trans	-81	-41.4	-179.9	-63.6	172.2	0	0	0	111	P73 F76 Y77 F87	P73-I80 HydrophobicContact CB-CD1 4.44Å; F76-I80 HydrophobicContact CB-CD1 3.76Å; F76-I80 HydrophobicContact CB-CG1 4.17Å; F76-I80 WeakPolarHBondContact O-CG1 3.15Å; F76-I80 PolarHBondContact O-N 3.05Å; Y77-I80 PolarHBondContact O-N 3.29Å; I80-F87 HydrophobicContact CG1-CE2 4Å
81	Y	90.2	Very high	92.4	Very high	138 Å²	138	77 Å²	77	54%	0.541	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-35.3	-168.3	-60.3	-71.4	0	0	0	113.7	Y77 S83	Y77-Y81 AromaticContact CD2-CD2 3.46Å; Y77-Y81 HydrophobicContact CD2-CD2 3.46Å; Y77-Y81 VanDerWaalsContact CD2-CD2 3.46Å; Y77-Y81 HydrophobicContact CD2-CE2 4.03Å; Y77-Y81 HydrophobicContact CD2-CG 4.35Å; Y77-Y81 AromaticContact CE2-CD2 3.65Å; Y77-Y81 HydrophobicContact CE2-CD2 3.65Å; Y77-Y81 HydrophobicContact CE2-CE2 4.33Å; Y77-Y81 HydrophobicContact CE2-CG 4.16Å; Y77-Y81 HydrophobicContact CG-CD2 4.09Å; Y77-Y81 PolarHBondContact O-N 3.15Å; Y81-S83 VanDerWaalsContact C-N 3.3Å; Y81-S83 PolarHBondContact O-N 3.37Å
82	D	87.9	Confident	92.4	Very high	90 Å²	90	79.5 Å²	79.5	48%	0.481	38%	0.381	S	S	.	.	S	Bend	trans	-89.1	5	-179	-54.7	-33.4	0	0	0	113	Y77 R78 E84	Y77-D82 WeakPolarHBondContact CE1-OD2 3.4Å; R78-D82 CarbonylContact O-C 3.39Å; R78-D82 WeakPolarHBondContact O-CA 3.42Å; R78-D82 VanDerWaalsContact O-CB 3.3Å; R78-D82 WeakPolarHBondContact O-CB 3.46Å; R78-D82 PolarHBondContact O-N 3.14Å; R78-D82 VanDerWaalsContact O-N 3.15Å; D82-E84 PolarHBondContact O-N 2.82Å
83	S	84.5	Confident	92.3	Very high	107 Å²	107	80.7 Å²	80.7	75%	0.748	39%	0.39	S	S	*	.			trans	55.8	32.8	177.4	-53.8	0	0	0	0	114.6	R78 Y81	R78-S83 PolarHBondContact O-N 2.86Å; Y81-S83 VanDerWaalsContact C-N 3.3Å; Y81-S83 PolarHBondContact O-N 3.37Å
84	E	86.1	Confident	92.4	Very high	95 Å²	95	79 Å²	79	44%	0.444	38%	0.378	S	S	.	.			trans	-54.2	138.8	170.7	-75.6	-79.4	-172.1	0	0	110.9	R78 W79 D82 M86	R78-E84 HydrophobicContact CB-CG 3.86Å; R78-E84 PolarHBondContact O-N 3.47Å; W79-E84 HydrophobicContact CG-CB 4.15Å; D82-E84 PolarHBondContact O-N 2.82Å; E84-M86 PolarHBondContact O-N 3.5Å
85	P	86	Confident	92.4	Very high	108 Å²	108	78.5 Å²	78.5	70%	0.701	37%	0.373	S	S	*	.	S	Bend	trans	-67	137.3	179.7	27.4	-32.5	0	0	0	111
86	M	91.9	Very high	92.6	Very high	169 Å²	169	80.6 Å²	80.6	83%	0.833	38%	0.383	S	S	*	.	S	Bend	trans	62.3	104.1	176.6	-168.5	178.9	-66	0	0	115	W79 E84	W79-M86 VanDerWaalsContact CD1-O 3.31Å; W79-M86 PolarHBondContact NE1-O 3.24Å; E84-M86 PolarHBondContact O-N 3.5Å
87	F	94.4	Very high	92.7	Very high	43 Å²	43	80.6 Å²	80.6	19%	0.189	38%	0.383	C	S	.	.			trans	-66.8	135.5	176.6	-175.1	-91.2	0	0	0	112.3	F76 W79 I80 Y89 F92	F76-F87 HydrophobicContact CB-CE2 4.09Å; F76-F87 HydrophobicContact CB-CZ 4.36Å; F76-F87 HydrophobicContact CD1-CE2 4.23Å; F76-F87 AromaticContact CD1-CZ 3.92Å; F76-F87 HydrophobicContact CD1-CZ 3.92Å; F76-F87 HydrophobicContact CG-CE2 4.4Å; F76-F87 HydrophobicContact CG-CZ 4.21Å; W79-F87 HydrophobicContact CB-CD2 3.65Å; W79-F87 HydrophobicContact CB-CE2 4.22Å; W79-F87 HydrophobicContact CG-CD2 4.49Å; I80-F87 HydrophobicContact CG1-CE2 4Å; F87-Y89 VanDerWaalsContact C-N 3.3Å; F87-Y89 HydrophobicContact CB-CD2 4.37Å; F87-Y89 HydrophobicContact CB-CE2 3.92Å; F87-Y89 AromaticContact CD1-CD1 3.62Å; F87-Y89 HydrophobicContact CD1-CD1 3.62Å; F87-Y89 HydrophobicContact CD1-CD2 4.03Å; F87-Y89 AromaticContact CD1-CE1 3.66Å; F87-Y89 HydrophobicContact CD1-CE1 3.66Å; F87-Y89 HydrophobicContact CD1-CE2 4.08Å; F87-Y89 AromaticContact CD1-CG 3.8Å; F87-Y89 HydrophobicContact CD1-CG 3.8Å; F87-Y89 AromaticContact CD1-CZ 3.9Å; F87-Y89 HydrophobicContact CE1-CD1 4.01Å; F87-Y89 HydrophobicContact CE1-CE1 4.21Å; F87-Y89 HydrophobicContact CE1-CG 4.45Å; F87-Y89 HydrophobicContact CG-CE1 4.49Å; F87-Y89 HydrophobicContact CG-CE2 4.47Å; F87-Y89 WeakPolarHBondContact O-CD2 3.45Å; F87-Y89 PolarHBondContact O-N 2.85Å; F87-F92 HydrophobicContact CE1-CB 3.62Å; F87-F92 HydrophobicContact CE1-CD1 4.11Å; F87-F92 HydrophobicContact CE1-CD2 4.3Å; F87-F92 AromaticContact CE1-CG 3.77Å; F87-F92 HydrophobicContact CE1-CG 3.77Å; F87-F92 HydrophobicContact CZ-CB 4Å; F87-F92 HydrophobicContact CZ-CD1 4.44Å; F87-F92 AromaticContact CZ-CD2 3.93Å; F87-F92 HydrophobicContact CZ-CD2 3.93Å; F87-F92 AromaticContact CZ-CG 3.87Å; F87-F92 HydrophobicContact CZ-CG 3.87Å
88	P	94	Very high	92.9	Very high	12 Å²	12	74.7 Å²	74.7	8%	0.078	36%	0.361	C	S	.	.			trans	-80.9	71.8	-176.6	34.1	-37.5	0	0	0	111.8	F76 W79 H90 R91 F92	F76-P88 HydrophobicContact CD1-CG 3.84Å; F76-P88 HydrophobicContact CE1-CG 4.04Å; W79-P88 HydrophobicContact CD2-CG 3.79Å; W79-P88 HydrophobicContact CE3-CG 4.04Å; W79-P88 VanDerWaalsContact CG-CD 3.44Å; W79-P88 HydrophobicContact CG-CG 4.26Å; W79-P88 HydrophobicContact CH2-CG 4.31Å; W79-P88 HydrophobicContact CZ2-CG 4.09Å; W79-P88 HydrophobicContact CZ3-CG 4.29Å; P88-H90 VanDerWaalsContact C-N 3.26Å; P88-H90 PolarHBondContact O-N 3.24Å; P88-R91 HydrophobicContact CB-CG 4.45Å; P88-R91 PolarHBondContact O-N 2.96Å; P88-F92 PolarHBondContact O-N 3.37Å; P88-F92 VanDerWaalsContact O-N 3.15Å
89	Y	94.5	Very high	93.2	Very high	159 Å²	159	69.2 Å²	69.2	62%	0.624	34%	0.341	S	S	*	.	H	α-helix	trans	-55.7	-36.4	-176.9	-71.2	-76.8	0	0	0	114	F87 F92 V93	F87-Y89 VanDerWaalsContact C-N 3.3Å; F87-Y89 HydrophobicContact CB-CD2 4.37Å; F87-Y89 HydrophobicContact CB-CE2 3.92Å; F87-Y89 AromaticContact CD1-CD1 3.62Å; F87-Y89 HydrophobicContact CD1-CD1 3.62Å; F87-Y89 HydrophobicContact CD1-CD2 4.03Å; F87-Y89 AromaticContact CD1-CE1 3.66Å; F87-Y89 HydrophobicContact CD1-CE1 3.66Å; F87-Y89 HydrophobicContact CD1-CE2 4.08Å; F87-Y89 AromaticContact CD1-CG 3.8Å; F87-Y89 HydrophobicContact CD1-CG 3.8Å; F87-Y89 AromaticContact CD1-CZ 3.9Å; F87-Y89 HydrophobicContact CE1-CD1 4.01Å; F87-Y89 HydrophobicContact CE1-CE1 4.21Å; F87-Y89 HydrophobicContact CE1-CG 4.45Å; F87-Y89 HydrophobicContact CG-CE1 4.49Å; F87-Y89 HydrophobicContact CG-CE2 4.47Å; F87-Y89 WeakPolarHBondContact O-CD2 3.45Å; F87-Y89 PolarHBondContact O-N 2.85Å; Y89-F92 PolarHBondContact O-N 2.81Å; Y89-V93 WeakPolarHBondContact O-CB 3.44Å; Y89-V93 VanDerWaalsContact O-CG2 3.29Å; Y89-V93 WeakPolarHBondContact O-CG2 3.4Å; Y89-V93 PolarHBondContact O-N 2.93Å
90	H	94.1	Very high	93.4	Very high	92 Å²	92	69.9 Å²	69.9	43%	0.426	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-49	179	64.3	-82	0	0	0	111.9	P88 F92 V93 E94 N140	P88-H90 VanDerWaalsContact C-N 3.26Å; P88-H90 PolarHBondContact O-N 3.24Å; H90-F92 VanDerWaalsContact C-N 3.33Å; H90-F92 PolarHBondContact O-N 3.32Å; H90-V93 PolarHBondContact O-N 3Å; H90-E94 WeakPolarHBondContact O-CG 3.3Å; H90-E94 PolarHBondContact O-N 3.1Å; H90-N140 PolarHBondContact O-ND2 3.06Å
91	R	94.8	Very high	93.7	Very high	75 Å²	75	66.3 Å²	66.3	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-65.6	-37.2	177	-58.2	-172.4	-178.2	172.1	-3.1	111.9	F76 P88 E94 F95	F76-R91 HydrophobicContact CE1-CB 4.01Å; F76-R91 HydrophobicContact CZ-CB 4.28Å; P88-R91 HydrophobicContact CB-CG 4.45Å; P88-R91 PolarHBondContact O-N 2.96Å; R91-E94 PolarHBondContact O-N 3.49Å; R91-F95 PolarHBondContact O-N 3.21Å
92	F	96.4	Very high	94.1	Very high	54 Å²	54	59.7 Å²	59.7	24%	0.237	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-45	177.6	-176	-110.5	0	0	0	111.7	I72 F76 F87 P88 Y89 H90 F95 L96	I72-F92 HydrophobicContact CG2-CE2 3.94Å; F76-F92 HydrophobicContact CD1-CB 4.43Å; F76-F92 HydrophobicContact CD1-CD2 4.48Å; F76-F92 AromaticContact CD2-CD2 4Å; F76-F92 HydrophobicContact CD2-CD2 4Å; F76-F92 HydrophobicContact CE1-CB 3.77Å; F76-F92 HydrophobicContact CE1-CD2 4.28Å; F76-F92 AromaticContact CE2-CD2 3.79Å; F76-F92 HydrophobicContact CE2-CD2 3.79Å; F76-F92 HydrophobicContact CG-CD2 4.36Å; F76-F92 VanDerWaalsContact CZ-CA 3.4Å; F76-F92 HydrophobicContact CZ-CB 3.87Å; F76-F92 AromaticContact CZ-CD2 3.96Å; F76-F92 HydrophobicContact CZ-CD2 3.96Å; F76-F92 HydrophobicContact CZ-CG 4.44Å; F87-F92 HydrophobicContact CE1-CB 3.62Å; F87-F92 HydrophobicContact CE1-CD1 4.11Å; F87-F92 HydrophobicContact CE1-CD2 4.3Å; F87-F92 AromaticContact CE1-CG 3.77Å; F87-F92 HydrophobicContact CE1-CG 3.77Å; F87-F92 HydrophobicContact CZ-CB 4Å; F87-F92 HydrophobicContact CZ-CD1 4.44Å; F87-F92 AromaticContact CZ-CD2 3.93Å; F87-F92 HydrophobicContact CZ-CD2 3.93Å; F87-F92 AromaticContact CZ-CG 3.87Å; F87-F92 HydrophobicContact CZ-CG 3.87Å; P88-F92 PolarHBondContact O-N 3.37Å; P88-F92 VanDerWaalsContact O-N 3.15Å; Y89-F92 PolarHBondContact O-N 2.81Å; H90-F92 VanDerWaalsContact C-N 3.33Å; H90-F92 PolarHBondContact O-N 3.32Å; F92-F95 PolarHBondContact O-N 2.94Å; F92-L96 HydrophobicContact CD1-CD1 3.93Å; F92-L96 HydrophobicContact CD1-CG 4.45Å; F92-L96 HydrophobicContact CE1-CD1 3.35Å; F92-L96 HydrophobicContact CE1-CG 4.13Å; F92-L96 HydrophobicContact CE2-CD1 4.35Å; F92-L96 HydrophobicContact CE2-CG 4.37Å; F92-L96 HydrophobicContact CZ-CD1 3.59Å; F92-L96 HydrophobicContact CZ-CD2 4.35Å; F92-L96 HydrophobicContact CZ-CG 4.09Å; F92-L96 WeakPolarHBondContact O-CG 3.38Å; F92-L96 PolarHBondContact O-N 3.29Å
93	V	96.8	Very high	94.5	Very high	61 Å²	61	58.2 Å²	58.2	37%	0.37	30%	0.301	S	S	.	.	H	α-helix	trans	-67.3	-36.1	177.6	171	0	0	0	0	111.8	Y89 H90 L96 S97 V136	Y89-V93 WeakPolarHBondContact O-CB 3.44Å; Y89-V93 VanDerWaalsContact O-CG2 3.29Å; Y89-V93 WeakPolarHBondContact O-CG2 3.4Å; Y89-V93 PolarHBondContact O-N 2.93Å; H90-V93 PolarHBondContact O-N 3Å; V93-L96 PolarHBondContact O-N 2.97Å; V93-S97 WeakPolarHBondContact O-CB 3.29Å; V93-S97 PolarHBondContact O-N 2.92Å; V93-V136 HydrophobicContact CG1-CB 4.44Å; V93-V136 HydrophobicContact CG1-CG1 4.03Å; V93-V136 HydrophobicContact CG1-CG2 3.54Å
94	E	96.1	Very high	95.1	Very high	11 Å²	11	55 Å²	55	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-59.1	-47.3	170.3	-79.5	162.1	-171	0	0	112.2	H90 R91 S97 G98 V136 N140 F222 L267	H90-E94 WeakPolarHBondContact O-CG 3.3Å; H90-E94 PolarHBondContact O-N 3.1Å; R91-E94 PolarHBondContact O-N 3.49Å; E94-S97 PolarHBondContact O-N 3.33Å; E94-G98 PolarHBondContact O-N 3.41Å; E94-V136 HydrophobicContact CB-CG1 4.4Å; E94-V136 HydrophobicContact CG-CG1 3.64Å; E94-N140 WeakPolarHBondContact CG-ND2 3.45Å; E94-N140 WeakPolarHBondContact OE1-CB 3.2Å; E94-N140 PolarHBondContact OE1-ND2 2.67Å; E94-F222 HydrophobicContact CB-CE2 4.29Å; E94-L267 HydrophobicContact CB-CD1 4.17Å; E94-L267 HydrophobicContact CG-CD1 4.36Å; E94-L267 HydrophobicContact CG-CD2 4.31Å
95	F	97.2	Very high	95.7	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-60.3	-50.7	176.7	-164.8	-82.4	0	0	0	111.6	L68 F71 I72 R91 F92 S97 G98 V99 F226	L68-F95 HydrophobicContact CD2-CZ 4.41Å; F71-F95 HydrophobicContact CD1-CE2 4.14Å; F71-F95 AromaticContact CD1-CZ 3.96Å; F71-F95 HydrophobicContact CD1-CZ 3.96Å; F71-F95 HydrophobicContact CE1-CE2 4.36Å; I72-F95 HydrophobicContact CB-CE1 4.49Å; I72-F95 HydrophobicContact CG1-CD1 4.03Å; I72-F95 HydrophobicContact CG1-CE1 3.56Å; R91-F95 PolarHBondContact O-N 3.21Å; F92-F95 PolarHBondContact O-N 2.94Å; F95-S97 VanDerWaalsContact C-N 3.34Å; F95-S97 PolarHBondContact O-N 3.45Å; F95-G98 PolarHBondContact O-N 3.4Å; F95-V99 HydrophobicContact CD1-CG2 3.92Å; F95-V99 HydrophobicContact CE1-CG2 3.66Å; F95-V99 HydrophobicContact CZ-CG2 4.45Å; F95-V99 VanDerWaalsContact O-CG2 3.31Å; F95-V99 WeakPolarHBondContact O-CG2 3.36Å; F95-V99 PolarHBondContact O-N 2.91Å; F95-F226 AromaticContact CD2-CE2 3.59Å; F95-F226 HydrophobicContact CD2-CE2 3.59Å; F95-F226 HydrophobicContact CD2-CZ 4.06Å; F95-F226 HydrophobicContact CE2-CD2 4.29Å; F95-F226 AromaticContact CE2-CE2 3.57Å; F95-F226 HydrophobicContact CE2-CE2 3.57Å; F95-F226 HydrophobicContact CE2-CZ 4.04Å; F95-F226 HydrophobicContact CG-CE2 4.27Å; F95-F226 HydrophobicContact CG-CZ 4.33Å; F95-F226 HydrophobicContact CZ-CE2 4.22Å; F95-F226 HydrophobicContact CZ-CZ 4.28Å
96	L	97.6	Very high	96.2	Very high	66 Å²	66	46.2 Å²	46.2	35%	0.346	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-37.4	179.2	-68.3	-173	0	0	0	112.8	I72 F92 V93 V99 L100	I72-L96 HydrophobicContact CD1-CD2 4.11Å; F92-L96 HydrophobicContact CD1-CD1 3.93Å; F92-L96 HydrophobicContact CD1-CG 4.45Å; F92-L96 HydrophobicContact CE1-CD1 3.35Å; F92-L96 HydrophobicContact CE1-CG 4.13Å; F92-L96 HydrophobicContact CE2-CD1 4.35Å; F92-L96 HydrophobicContact CE2-CG 4.37Å; F92-L96 HydrophobicContact CZ-CD1 3.59Å; F92-L96 HydrophobicContact CZ-CD2 4.35Å; F92-L96 HydrophobicContact CZ-CG 4.09Å; F92-L96 WeakPolarHBondContact O-CG 3.38Å; F92-L96 PolarHBondContact O-N 3.29Å; V93-L96 PolarHBondContact O-N 2.97Å; L96-V99 PolarHBondContact O-N 3.24Å; L96-L100 VanDerWaalsContact O-CB 3.28Å; L96-L100 WeakPolarHBondContact O-CB 3.31Å; L96-L100 PolarHBondContact O-N 2.89Å
97	S	96.8	Very high	96.5	Very high	7 Å²	7	45.3 Å²	45.3	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-66.8	-40.3	176.3	179.2	0	0	0	0	112.4	V93 E94 F95 L100 S101 P132 L133 V136	V93-S97 WeakPolarHBondContact O-CB 3.29Å; V93-S97 PolarHBondContact O-N 2.92Å; E94-S97 PolarHBondContact O-N 3.33Å; F95-S97 VanDerWaalsContact C-N 3.34Å; F95-S97 PolarHBondContact O-N 3.45Å; S97-L100 PolarHBondContact O-N 2.92Å; S97-S101 WeakPolarHBondContact O-CB 3.37Å; S97-S101 PolarHBondContact O-N 3.4Å; S97-S101 PolarHBondContact O-OG 3.16Å; S97-P132 VanDerWaalsContact OG-C 3.3Å; S97-P132 PolarHBondContact OG-O 2.92Å; S97-P132 VanDerWaalsContact OG-O 3.05Å; S97-L133 WeakPolarHBondContact OG-CA 3.44Å; S97-L133 PolarHBondContact OG-N 3.39Å; S97-V136 VanDerWaalsContact CB-CG2 3.49Å; S97-V136 WeakPolarHBondContact OG-CG2 3.46Å
98	G	97.2	Very high	96.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-49.1	171.4	0	0	0	0	0	112.3	E94 F95 L100 S101 I102 V263	E94-G98 PolarHBondContact O-N 3.41Å; F95-G98 PolarHBondContact O-N 3.4Å; G98-L100 PolarHBondContact O-N 2.9Å; G98-S101 PolarHBondContact O-N 3.36Å; G98-I102 WeakPolarHBondContact O-CB 3.48Å; G98-I102 VanDerWaalsContact O-CG1 3.28Å; G98-I102 WeakPolarHBondContact O-CG1 3.46Å; G98-I102 PolarHBondContact O-N 3.19Å; G98-V263 VanDerWaalsContact CA-CG1 3.45Å
99	V	97.7	Very high	96.7	Very high	10 Å²	10	43.4 Å²	43.4	6%	0.061	21%	0.212	C	C	.	.	H	α-helix	trans	-58.2	-47.2	175.7	168.9	0	0	0	0	111.5	M65 L68 F69 F95 L96 I102 C103 F226	M65-V99 HydrophobicContact CE-CG1 3.67Å; L68-V99 HydrophobicContact CB-CG2 4.41Å; L68-V99 HydrophobicContact CD1-CG2 4.02Å; F69-V99 HydrophobicContact CD1-CG1 4.1Å; F69-V99 HydrophobicContact CE1-CG1 3.5Å; F69-V99 VanDerWaalsContact CE1-CG1 3.5Å; F95-V99 HydrophobicContact CD1-CG2 3.92Å; F95-V99 HydrophobicContact CE1-CG2 3.66Å; F95-V99 HydrophobicContact CZ-CG2 4.45Å; F95-V99 VanDerWaalsContact O-CG2 3.31Å; F95-V99 WeakPolarHBondContact O-CG2 3.36Å; F95-V99 PolarHBondContact O-N 2.91Å; L96-V99 PolarHBondContact O-N 3.24Å; V99-I102 PolarHBondContact O-N 2.92Å; V99-C103 VanDerWaalsContact O-CB 3.29Å; V99-C103 WeakPolarHBondContact O-CB 3.36Å; V99-C103 PolarHBondContact O-N 2.91Å; V99-F226 HydrophobicContact CG2-CE1 4.11Å; V99-F226 HydrophobicContact CG2-CZ 4.07Å
100	L	97.2	Very high	96.9	Very high	91 Å²	91	39 Å²	39	48%	0.476	20%	0.196	S	C	.	.	H	α-helix	trans	-61.4	-48.6	179.3	177.1	61.1	0	0	0	111.3	L96 S97 G98 I102 C103 S104 P132	L96-L100 VanDerWaalsContact O-CB 3.28Å; L96-L100 WeakPolarHBondContact O-CB 3.31Å; L96-L100 PolarHBondContact O-N 2.89Å; S97-L100 PolarHBondContact O-N 2.92Å; G98-L100 PolarHBondContact O-N 2.9Å; L100-I102 VanDerWaalsContact C-N 3.34Å; L100-I102 PolarHBondContact O-N 3.5Å; L100-C103 WeakPolarHBondContact O-CB 3.47Å; L100-C103 PolarHBondContact O-N 2.86Å; L100-S104 PolarHBondContact O-N 3.06Å; L100-S104 PolarHBondContact O-OG 3.17Å; L100-S104 VanDerWaalsContact O-OG 3.09Å; L100-P132 HydrophobicContact CD2-CB 4.01Å; L100-P132 HydrophobicContact CD2-CG 4.12Å
101	S	97.1	Very high	97	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.4	-43.6	-179	-56.7	0	0	0	0	111.4	S97 G98 S104 M105	S97-S101 WeakPolarHBondContact O-CB 3.37Å; S97-S101 PolarHBondContact O-N 3.4Å; S97-S101 PolarHBondContact O-OG 3.16Å; G98-S101 PolarHBondContact O-N 3.36Å; S101-S104 PolarHBondContact O-N 3.3Å; S101-M105 PolarHBondContact O-N 3.46Å; S101-M105 VanDerWaalsContact O-N 3.09Å
102	I	97.8	Very high	97	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-47.4	175.2	-70.1	168.2	0	0	0	110.8	Y64 M65 G98 V99 L100 S104 M105 I106 F226 F256 M259 L260 V263	Y64-I102 HydrophobicContact CE1-CD1 4.41Å; Y64-I102 HydrophobicContact CE1-CG2 4.23Å; M65-I102 HydrophobicContact SD-CG2 3.74Å; G98-I102 WeakPolarHBondContact O-CB 3.48Å; G98-I102 VanDerWaalsContact O-CG1 3.28Å; G98-I102 WeakPolarHBondContact O-CG1 3.46Å; G98-I102 PolarHBondContact O-N 3.19Å; V99-I102 PolarHBondContact O-N 2.92Å; L100-I102 VanDerWaalsContact C-N 3.34Å; L100-I102 PolarHBondContact O-N 3.5Å; I102-S104 VanDerWaalsContact C-N 3.35Å; I102-S104 PolarHBondContact O-N 2.92Å; I102-M105 PolarHBondContact O-N 3.23Å; I102-M105 VanDerWaalsContact O-N 3.08Å; I102-I106 HydrophobicContact CG2-CD1 3.7Å; I102-I106 HydrophobicContact CG2-CG1 4.3Å; I102-I106 WeakPolarHBondContact O-CG1 3.41Å; I102-I106 PolarHBondContact O-N 3.46Å; I102-F226 HydrophobicContact CD1-CD1 3.58Å; I102-F226 HydrophobicContact CD1-CE1 3.73Å; I102-F256 HydrophobicContact CG2-CD2 3.74Å; I102-F256 HydrophobicContact CG2-CE2 3.81Å; I102-M259 HydrophobicContact CG1-CG 4.01Å; I102-L260 HydrophobicContact CD1-CB 4.08Å; I102-L260 HydrophobicContact CD1-CG 4.2Å; I102-L260 HydrophobicContact CG1-CB 4.37Å; I102-V263 HydrophobicContact CG1-CG2 4.22Å
103	C	97.2	Very high	97	Very high	58 Å²	58	31 Å²	31	39%	0.392	17%	0.167	S	C	.	.	H	α-helix	trans	-58.2	-46.1	178.3	-169.6	0	0	0	0	111.8	M65 V99 L100 M105 I106 F107	M65-C103 HydrophobicContact CE-CB 3.81Å; V99-C103 VanDerWaalsContact O-CB 3.29Å; V99-C103 WeakPolarHBondContact O-CB 3.36Å; V99-C103 PolarHBondContact O-N 2.91Å; L100-C103 WeakPolarHBondContact O-CB 3.47Å; L100-C103 PolarHBondContact O-N 2.86Å; C103-M105 VanDerWaalsContact C-N 3.26Å; C103-M105 PolarHBondContact O-N 3.46Å; C103-I106 PolarHBondContact O-N 3.47Å; C103-F107 PolarHBondContact O-N 2.93Å
104	S	96.8	Very high	96.9	Very high	40 Å²	40	32.2 Å²	32.2	28%	0.28	17%	0.17	S	C	.	.	H	α-helix	trans	-59.4	-36.8	175.4	-61.4	0	0	0	0	112.3	L100 S101 I102 L108	L100-S104 PolarHBondContact O-N 3.06Å; L100-S104 PolarHBondContact O-OG 3.17Å; L100-S104 VanDerWaalsContact O-OG 3.09Å; S101-S104 PolarHBondContact O-N 3.3Å; I102-S104 VanDerWaalsContact C-N 3.35Å; I102-S104 PolarHBondContact O-N 2.92Å; S104-L108 WeakPolarHBondContact O-CB 3.28Å; S104-L108 PolarHBondContact O-N 3.42Å
105	M	97.2	Very high	96.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-78.6	-31.7	179.9	-124.6	34.3	48.2	0	0	113.5	S101 I102 C103 L108 G109 P126 A129 T178 Y255 M259	S101-M105 PolarHBondContact O-N 3.46Å; S101-M105 VanDerWaalsContact O-N 3.09Å; I102-M105 PolarHBondContact O-N 3.23Å; I102-M105 VanDerWaalsContact O-N 3.08Å; C103-M105 VanDerWaalsContact C-N 3.26Å; C103-M105 PolarHBondContact O-N 3.46Å; M105-L108 HydrophobicContact SD-CB 4.29Å; M105-L108 HydrophobicContact SD-CD2 3.71Å; M105-G109 PolarHBondContact O-N 2.96Å; M105-P126 HydrophobicContact SD-CB 4.01Å; M105-P126 HydrophobicContact SD-CG 4.18Å; M105-A129 HydrophobicContact CE-CB 3.11Å; M105-T178 HydrophobicContact CG-CG2 3.64Å; M105-T178 HydrophobicContact SD-CG2 4.3Å; M105-Y255 HydrophobicContact CG-CD1 4.3Å; M105-Y255 HydrophobicContact SD-CD1 4.18Å; M105-M259 HydrophobicContact CB-CB 3.65Å; M105-M259 HydrophobicContact CB-CE 4.19Å; M105-M259 HydrophobicContact CB-CG 3.89Å; M105-M259 HydrophobicContact CE-CE 3.52Å; M105-M259 HydrophobicContact CG-CB 3.71Å; M105-M259 HydrophobicContact CG-CE 3.7Å; M105-M259 HydrophobicContact CG-CG 4.15Å; M105-M259 HydrophobicContact SD-CE 4.06Å
106	I	98	Very high	96.6	Very high	18 Å²	18	42.4 Å²	42.4	9%	0.092	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-47.8	168.5	-68.1	163.5	0	0	0	109.5	A61 M65 I102 C103 G109 F110 T252 F256	A61-I106 HydrophobicContact CB-CD1 3.81Å; A61-I106 HydrophobicContact CB-CG1 3.91Å; A61-I106 HydrophobicContact CB-CG2 4.04Å; M65-I106 HydrophobicContact CG-CD1 3.57Å; M65-I106 HydrophobicContact SD-CD1 3.78Å; I102-I106 HydrophobicContact CG2-CD1 3.7Å; I102-I106 HydrophobicContact CG2-CG1 4.3Å; I102-I106 WeakPolarHBondContact O-CG1 3.41Å; I102-I106 PolarHBondContact O-N 3.46Å; C103-I106 PolarHBondContact O-N 3.47Å; I106-G109 PolarHBondContact O-N 3.09Å; I106-F110 WeakPolarHBondContact O-CB 3.38Å; I106-F110 PolarHBondContact O-N 2.87Å; I106-T252 HydrophobicContact CG2-CG2 4.16Å; I106-F256 HydrophobicContact CD1-CD2 4Å; I106-F256 HydrophobicContact CD1-CE2 4.43Å; I106-F256 HydrophobicContact CD1-CG 4.43Å; I106-F256 HydrophobicContact CG1-CB 3.9Å; I106-F256 HydrophobicContact CG1-CD2 3.96Å; I106-F256 HydrophobicContact CG1-CG 4.05Å
107	F	97.1	Very high	96.4	Very high	150 Å²	150	40.8 Å²	40.8	66%	0.658	22%	0.216	S	C	*	.	H	α-helix	trans	-60.6	-47.7	177.3	175.9	-102.4	0	0	0	111.8	C103 G109 F110 A111	C103-F107 PolarHBondContact O-N 2.93Å; F107-G109 PolarHBondContact O-N 3.35Å; F107-F110 PolarHBondContact O-N 3.08Å; F107-A111 WeakPolarHBondContact O-CB 3.18Å; F107-A111 PolarHBondContact O-N 2.83Å
108	L	96.4	Very high	96.1	Very high	16 Å²	16	46.3 Å²	46.3	8%	0.084	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-43.2	178.8	179.2	61	0	0	0	112.1	S104 M105 F110 A111 D112 L117 L125 P126 Y255	S104-L108 WeakPolarHBondContact O-CB 3.28Å; S104-L108 PolarHBondContact O-N 3.42Å; M105-L108 HydrophobicContact SD-CB 4.29Å; M105-L108 HydrophobicContact SD-CD2 3.71Å; L108-F110 VanDerWaalsContact C-N 3.32Å; L108-F110 PolarHBondContact O-N 3.27Å; L108-A111 PolarHBondContact O-N 3.41Å; L108-D112 WeakPolarHBondContact O-CB 3.37Å; L108-D112 PolarHBondContact O-N 3.49Å; L108-L117 HydrophobicContact CD1-CD1 3.92Å; L108-L125 HydrophobicContact CD1-CB 3.85Å; L108-L125 HydrophobicContact CD1-CD1 3.52Å; L108-L125 HydrophobicContact CD1-CG 4.33Å; L108-L125 HydrophobicContact CD2-CB 3.59Å; L108-L125 HydrophobicContact CG-CB 4.4Å; L108-P126 HydrophobicContact CD2-CG 3.72Å; L108-Y255 HydrophobicContact CD2-CD1 4.17Å; L108-Y255 HydrophobicContact CD2-CE1 3.91Å; L108-Y255 HydrophobicContact CG-CD1 4.23Å; L108-Y255 HydrophobicContact CG-CE1 4.02Å
109	G	97.1	Very high	95.6	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-38.3	177.2	0	0	0	0	0	112.2	M105 I106 F107 D112 D113 T252	M105-G109 PolarHBondContact O-N 2.96Å; I106-G109 PolarHBondContact O-N 3.09Å; F107-G109 PolarHBondContact O-N 3.35Å; G109-D112 WeakPolarHBondContact O-CB 3.43Å; G109-D112 PolarHBondContact O-N 2.97Å; G109-D113 PolarHBondContact O-N 2.89Å; G109-T252 PolarHBondContact O-OG1 3.29Å
110	F	97.6	Very high	95.3	Very high	65 Å²	65	60.5 Å²	60.5	29%	0.285	29%	0.292	S	S	.	.	H	α-helix	trans	-66.9	-40.7	173.1	-175.8	-111	0	0	0	112.2	F34 P55 V58 I106 F107 L108 D112 D113 I114 T252	F34-F110 HydrophobicContact CE1-CE2 4.37Å; P55-F110 HydrophobicContact CG-CD2 3.87Å; P55-F110 HydrophobicContact CG-CE2 4.03Å; V58-F110 HydrophobicContact CB-CD2 4.15Å; V58-F110 HydrophobicContact CG1-CD2 4.45Å; V58-F110 HydrophobicContact CG1-CE2 4.47Å; V58-F110 HydrophobicContact CG2-CB 4.42Å; V58-F110 HydrophobicContact CG2-CD2 3.85Å; V58-F110 HydrophobicContact CG2-CE2 4.41Å; V58-F110 HydrophobicContact CG2-CG 4.21Å; I106-F110 WeakPolarHBondContact O-CB 3.38Å; I106-F110 PolarHBondContact O-N 2.87Å; F107-F110 PolarHBondContact O-N 3.08Å; L108-F110 VanDerWaalsContact C-N 3.32Å; L108-F110 PolarHBondContact O-N 3.27Å; F110-D112 VanDerWaalsContact C-N 3.28Å; F110-D112 PolarHBondContact O-N 3.48Å; F110-D113 PolarHBondContact O-N 2.92Å; F110-I114 HydrophobicContact CE1-CG1 4.18Å; F110-I114 HydrophobicContact CE2-CD1 4.28Å; F110-I114 HydrophobicContact CE2-CG1 4.16Å; F110-I114 HydrophobicContact CZ-CD1 4.19Å; F110-I114 HydrophobicContact CZ-CG1 3.96Å; F110-I114 WeakPolarHBondContact O-CG1 3.37Å; F110-I114 PolarHBondContact O-N 3.41Å; F110-I114 VanDerWaalsContact O-N 3.14Å; F110-T252 WeakPolarHBondContact CA-OG1 3.4Å; F110-T252 HydrophobicContact CB-CG2 4.45Å; F110-T252 PolarHBondContact N-OG1 3.47Å; F110-T252 VanDerWaalsContact N-OG1 3.14Å
111	A	96.8	Very high	95	Very high	20 Å²	20	59.3 Å²	59.3	17%	0.165	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-37	173.1	0	0	0	0	0	111.6	F107 L108 I114 L115	F107-A111 WeakPolarHBondContact O-CB 3.18Å; F107-A111 PolarHBondContact O-N 2.83Å; L108-A111 PolarHBondContact O-N 3.41Å; A111-I114 PolarHBondContact O-N 3.37Å; A111-L115 HydrophobicContact CB-CD1 4.49Å; A111-L115 WeakPolarHBondContact O-CB 3.42Å; A111-L115 WeakPolarHBondContact O-CG 3.48Å; A111-L115 PolarHBondContact O-N 3.47Å
112	D	95.7	Very high	94.7	Very high	2 Å²	2	61 Å²	61	1%	0.011	29%	0.291	C	S	.	.	H	α-helix	trans	-65.6	-44.1	175.2	-163.7	14.3	0	0	0	112.1	L108 G109 F110 I114 N116 L117 K122 D251 Y255	L108-D112 WeakPolarHBondContact O-CB 3.37Å; L108-D112 PolarHBondContact O-N 3.49Å; G109-D112 WeakPolarHBondContact O-CB 3.43Å; G109-D112 PolarHBondContact O-N 2.97Å; F110-D112 VanDerWaalsContact C-N 3.28Å; F110-D112 PolarHBondContact O-N 3.48Å; D112-I114 VanDerWaalsContact C-N 3.26Å; D112-I114 PolarHBondContact O-N 3.28Å; D112-N116 WeakPolarHBondContact O-CA 3.49Å; D112-N116 PolarHBondContact O-N 2.82Å; D112-L117 HydrophobicContact CB-CD1 4.08Å; D112-L117 HydrophobicContact CB-CG 4.36Å; D112-L117 WeakPolarHBondContact OD1-CB 3.44Å; D112-L117 PolarHBondContact OD1-N 3.04Å; D112-K122 WeakPolarHBondContact OD1-CE 3.43Å; D112-K122 IonicContact OD1-NZ 2.96Å; D112-K122 PolarHBondContact OD1-NZ 3.03Å; D112-K122 WeakPolarHBondContact OD2-CD 3.27Å; D112-K122 WeakPolarHBondContact OD2-CE 3.27Å; D112-K122 IonicContact OD2-NZ 2.7Å; D112-K122 PolarHBondContact OD2-NZ 3.41Å; D112-D251 HydrophobicContact CB-CB 4.33Å; D112-Y255 PolarHBondContact OD2-OH 3.15Å
113	D	95.4	Very high	94.4	Very high	33 Å²	33	64.9 Å²	64.9	18%	0.176	31%	0.312	C	S	.	.	H	α-helix	trans	-59.8	-35	175.9	-78.7	-50.5	0	0	0	112.9	P55 G109 F110 G250 D251 T252	P55-D113 HydrophobicContact CB-CB 4.02Å; P55-D113 VanDerWaalsContact CB-CG 3.45Å; P55-D113 WeakPolarHBondContact CB-OD2 3.42Å; P55-D113 HydrophobicContact CG-CB 3.72Å; P55-D113 WeakPolarHBondContact CG-OD2 3.38Å; G109-D113 PolarHBondContact O-N 2.89Å; F110-D113 PolarHBondContact O-N 2.92Å; D113-G250 VanDerWaalsContact OD1-CA 3.31Å; D113-G250 WeakPolarHBondContact OD1-CA 3.21Å; D113-D251 VanDerWaalsContact CG-N 3.33Å; D113-D251 PolarHBondContact OD1-N 3.42Å; D113-D251 PolarHBondContact OD2-N 2.89Å; D113-D251 VanDerWaalsContact OD2-N 3.17Å; D113-T252 WeakPolarHBondContact OD2-CB 3.43Å; D113-T252 PolarHBondContact OD2-N 3.32Å; D113-T252 PolarHBondContact OD2-OG1 3.41Å
114	I	95.5	Very high	94.2	Very high	85 Å²	85	66.7 Å²	66.7	44%	0.436	32%	0.317	S	S	.	.	H	α-helix	trans	-87.2	-42.5	-178.5	-61.4	-60.8	0	0	0	112.5	M39 F110 A111 D112	M39-I114 HydrophobicContact SD-CD1 3.63Å; F110-I114 HydrophobicContact CE1-CG1 4.18Å; F110-I114 HydrophobicContact CE2-CD1 4.28Å; F110-I114 HydrophobicContact CE2-CG1 4.16Å; F110-I114 HydrophobicContact CZ-CD1 4.19Å; F110-I114 HydrophobicContact CZ-CG1 3.96Å; F110-I114 WeakPolarHBondContact O-CG1 3.37Å; F110-I114 PolarHBondContact O-N 3.41Å; F110-I114 VanDerWaalsContact O-N 3.14Å; A111-I114 PolarHBondContact O-N 3.37Å; D112-I114 VanDerWaalsContact C-N 3.26Å; D112-I114 PolarHBondContact O-N 3.28Å
115	L	95.1	Very high	94.1	Very high	119 Å²	119	67.8 Å²	67.8	62%	0.623	32%	0.319	S	S	*	.	H	α-helix	trans	-97.3	-11.1	-171.6	-57.3	175.9	0	0	0	113.4	A111 L117	A111-L115 HydrophobicContact CB-CD1 4.49Å; A111-L115 WeakPolarHBondContact O-CB 3.42Å; A111-L115 WeakPolarHBondContact O-CG 3.48Å; A111-L115 PolarHBondContact O-N 3.47Å; L115-L117 HydrophobicContact CB-CD2 3.97Å; L115-L117 HydrophobicContact CB-CG 4.47Å; L115-L117 HydrophobicContact CD1-CD2 4.36Å
116	N	91.7	Very high	93.8	Very high	110 Å²	110	67.8 Å²	67.8	59%	0.588	32%	0.319	S	S	*	.			trans	48.5	68.8	-175.4	-175.9	26.9	0	0	0	111.7	D112	D112-N116 WeakPolarHBondContact O-CA 3.49Å; D112-N116 PolarHBondContact O-N 2.82Å
117	L	93	Very high	93.6	Very high	32 Å²	32	69.2 Å²	69.2	17%	0.168	33%	0.331	C	S	.	.			trans	-66.5	147	-169	-62.9	174.2	0	0	0	111.8	L108 D112 L115 H121 K122 L125	L108-L117 HydrophobicContact CD1-CD1 3.92Å; D112-L117 HydrophobicContact CB-CD1 4.08Å; D112-L117 HydrophobicContact CB-CG 4.36Å; D112-L117 WeakPolarHBondContact OD1-CB 3.44Å; D112-L117 PolarHBondContact OD1-N 3.04Å; L115-L117 HydrophobicContact CB-CD2 3.97Å; L115-L117 HydrophobicContact CB-CG 4.47Å; L115-L117 HydrophobicContact CD1-CD2 4.36Å; L117-H121 HydrophobicContact CB-CB 4.33Å; L117-K122 HydrophobicContact CB-CG 4.3Å; L117-K122 WeakPolarHBondContact O-CE 3.41Å; L117-L125 HydrophobicContact CD1-CD1 4.24Å
118	K	91.2	Very high	93.5	Very high	124 Å²	124	66.6 Å²	66.6	54%	0.539	32%	0.323	S	S	.	.			trans	-67.7	148.6	173.7	-63.7	179.7	178.4	180	0	110.6	R120 H121 K122	K118-R120 HydrophobicContact CB-CG 4.29Å; K118-R120 PolarHBondContact O-N 3.37Å; K118-H121 WeakPolarHBondContact O-CB 3.43Å; K118-H121 PolarHBondContact O-N 3.47Å; K118-K122 PolarHBondContact O-N 2.95Å
119	W	85.7	Confident	93.2	Very high	181 Å²	181	66.8 Å²	66.8	69%	0.686	33%	0.327	S	S	*	.	H	α-helix	trans	-48.2	-38.8	-177.7	70.4	-96.4	0	0	0	114.2	H121 K122 L123	W119-H121 VanDerWaalsContact C-N 3.29Å; W119-H121 PolarHBondContact O-N 2.9Å; W119-K122 WeakPolarHBondContact O-CB 3.29Å; W119-K122 PolarHBondContact O-N 3.3Å; W119-K122 VanDerWaalsContact O-N 3.14Å; W119-L123 HydrophobicContact CE3-CD1 3.79Å; W119-L123 HydrophobicContact CZ3-CD1 3.88Å; W119-L123 PolarHBondContact O-N 2.96Å; W119-L123 VanDerWaalsContact O-N 3.08Å
120	R	91.2	Very high	93	Very high	126 Å²	126	66.9 Å²	66.9	48%	0.475	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-37.5	177.4	66.3	-175.3	176.2	-138.7	10.4	113.1	K118 L123 L124	K118-R120 HydrophobicContact CB-CG 4.29Å; K118-R120 PolarHBondContact O-N 3.37Å; R120-L123 PolarHBondContact O-N 3.35Å; R120-L124 VanDerWaalsContact O-CB 3.28Å; R120-L124 WeakPolarHBondContact O-CB 3.47Å; R120-L124 PolarHBondContact O-N 3.21Å
121	H	91.9	Very high	92.9	Very high	66 Å²	66	68.1 Å²	68.1	31%	0.306	34%	0.337	S	S	.	.	H	α-helix	trans	-76.1	-34.9	178	-59	-58.1	0	0	0	110.3	L117 K118 W119 L123 L124 L125	L117-H121 HydrophobicContact CB-CB 4.33Å; K118-H121 WeakPolarHBondContact O-CB 3.43Å; K118-H121 PolarHBondContact O-N 3.47Å; W119-H121 VanDerWaalsContact C-N 3.29Å; W119-H121 PolarHBondContact O-N 2.9Å; H121-L123 PolarHBondContact O-N 2.99Å; H121-L124 PolarHBondContact O-N 3.28Å; H121-L125 HydrophobicContact CB-CD1 4.06Å; H121-L125 HydrophobicContact CB-CG 4.45Å; H121-L125 VanDerWaalsContact O-CB 3.28Å; H121-L125 WeakPolarHBondContact O-CB 3.49Å; H121-L125 WeakPolarHBondContact O-CG 3.44Å; H121-L125 PolarHBondContact O-N 3.28Å
122	K	91	Very high	92.6	Very high	36 Å²	36	69.2 Å²	69.2	16%	0.157	34%	0.342	C	S	.	.	H	α-helix	trans	-62.7	-23.4	172.4	-55.5	-164.9	-177	-139.3	0	113.4	D112 L117 K118 W119 P126 N179 D251 Y255	D112-K122 WeakPolarHBondContact OD1-CE 3.43Å; D112-K122 IonicContact OD1-NZ 2.96Å; D112-K122 PolarHBondContact OD1-NZ 3.03Å; D112-K122 WeakPolarHBondContact OD2-CD 3.27Å; D112-K122 WeakPolarHBondContact OD2-CE 3.27Å; D112-K122 IonicContact OD2-NZ 2.7Å; D112-K122 PolarHBondContact OD2-NZ 3.41Å; L117-K122 HydrophobicContact CB-CG 4.3Å; L117-K122 WeakPolarHBondContact O-CE 3.41Å; K118-K122 PolarHBondContact O-N 2.95Å; W119-K122 WeakPolarHBondContact O-CB 3.29Å; W119-K122 PolarHBondContact O-N 3.3Å; W119-K122 VanDerWaalsContact O-N 3.14Å; K122-P126 WeakPolarHBondContact O-CD 3.42Å; K122-P126 WeakPolarHBondContact O-CG 3.16Å; K122-N179 PolarHBondContact O-ND2 3.44Å; K122-N179 PolarHBondContact O-OD1 3.21Å; K122-D251 IonicContact NZ-OD2 3.01Å; K122-D251 PolarHBondContact NZ-OD2 3.04Å; K122-Y255 WeakPolarHBondContact CB-OH 3.25Å; K122-Y255 WeakPolarHBondContact CD-OH 3.47Å; K122-Y255 WeakPolarHBondContact CG-OH 3.37Å
123	L	90.8	Very high	92.6	Very high	81 Å²	81	69.1 Å²	69.1	42%	0.424	34%	0.341	S	S	.	.	H	α-helix	trans	-92.7	-44.3	173.1	-64.9	178.3	0	0	0	113	W119 R120 H121 S127 V175	W119-L123 HydrophobicContact CE3-CD1 3.79Å; W119-L123 HydrophobicContact CZ3-CD1 3.88Å; W119-L123 PolarHBondContact O-N 2.96Å; W119-L123 VanDerWaalsContact O-N 3.08Å; R120-L123 PolarHBondContact O-N 3.35Å; H121-L123 PolarHBondContact O-N 2.99Å; L123-S127 PolarHBondContact O-OG 3.23Å; L123-V175 HydrophobicContact CD2-CG1 4.39Å
124	L	93.5	Very high	92.6	Very high	97 Å²	97	68.4 Å²	68.4	51%	0.508	34%	0.338	S	S	.	.	H	α-helix	trans	-71.6	-44.4	-174.9	-178.7	62.8	0	0	0	112.8	R120 H121 S127 I128	R120-L124 VanDerWaalsContact O-CB 3.28Å; R120-L124 WeakPolarHBondContact O-CB 3.47Å; R120-L124 PolarHBondContact O-N 3.21Å; H121-L124 PolarHBondContact O-N 3.28Å; L124-S127 VanDerWaalsContact O-CB 3.31Å; L124-S127 WeakPolarHBondContact O-CB 3.43Å; L124-S127 PolarHBondContact O-N 3.38Å; L124-I128 HydrophobicContact CD1-CD1 4.3Å; L124-I128 HydrophobicContact CG-CD1 4.14Å; L124-I128 PolarHBondContact O-N 3.13Å; L124-I128 VanDerWaalsContact O-N 3.12Å
125	L	93.6	Very high	92.6	Very high	62 Å²	62	69.5 Å²	69.5	33%	0.325	34%	0.342	S	S	.	.	H	α-helix	trans	-68.1	-42.3	-173.3	-64.6	174.5	0	0	0	112.7	L108 L117 H121 S127 I128 A129	L108-L125 HydrophobicContact CD1-CB 3.85Å; L108-L125 HydrophobicContact CD1-CD1 3.52Å; L108-L125 HydrophobicContact CD1-CG 4.33Å; L108-L125 HydrophobicContact CD2-CB 3.59Å; L108-L125 HydrophobicContact CG-CB 4.4Å; L117-L125 HydrophobicContact CD1-CD1 4.24Å; H121-L125 HydrophobicContact CB-CD1 4.06Å; H121-L125 HydrophobicContact CB-CG 4.45Å; H121-L125 VanDerWaalsContact O-CB 3.28Å; H121-L125 WeakPolarHBondContact O-CB 3.49Å; H121-L125 WeakPolarHBondContact O-CG 3.44Å; H121-L125 PolarHBondContact O-N 3.28Å; L125-S127 VanDerWaalsContact C-N 3.27Å; L125-S127 PolarHBondContact O-N 2.72Å; L125-I128 PolarHBondContact O-N 3.44Å; L125-A129 WeakPolarHBondContact O-CB 3.49Å; L125-A129 PolarHBondContact O-N 3.19Å
126	P	92.5	Very high	92.7	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-38.3	171	-26.4	38	0	0	0	112.2	M105 L108 K122 I128 A129 T130 V175 Y255	M105-P126 HydrophobicContact SD-CB 4.01Å; M105-P126 HydrophobicContact SD-CG 4.18Å; L108-P126 HydrophobicContact CD2-CG 3.72Å; K122-P126 WeakPolarHBondContact O-CD 3.42Å; K122-P126 WeakPolarHBondContact O-CG 3.16Å; P126-I128 VanDerWaalsContact C-N 3.34Å; P126-I128 PolarHBondContact O-N 3.01Å; P126-A129 PolarHBondContact O-N 3.22Å; P126-T130 WeakPolarHBondContact O-CG2 3.38Å; P126-T130 PolarHBondContact O-N 3.02Å; P126-T130 PolarHBondContact O-OG1 3.43Å; P126-V175 HydrophobicContact CB-CG2 4.43Å; P126-Y255 HydrophobicContact CG-CE1 4.15Å
127	S	93.6	Very high	92.9	Very high	49 Å²	49	59.6 Å²	59.6	34%	0.343	29%	0.29	S	S	.	.	H	α-helix	trans	-57.2	-47.8	177.6	-55.8	0	0	0	0	111.4	L123 L124 L125 T130 V175	L123-S127 PolarHBondContact O-OG 3.23Å; L124-S127 VanDerWaalsContact O-CB 3.31Å; L124-S127 WeakPolarHBondContact O-CB 3.43Å; L124-S127 PolarHBondContact O-N 3.38Å; L125-S127 VanDerWaalsContact C-N 3.27Å; L125-S127 PolarHBondContact O-N 2.72Å; S127-T130 PolarHBondContact O-N 2.78Å; S127-T130 PolarHBondContact O-OG1 2.88Å; S127-V175 VanDerWaalsContact OG-CG2 3.31Å; S127-V175 WeakPolarHBondContact OG-CG2 3.46Å
128	I	93.5	Very high	93	Very high	94 Å²	94	59 Å²	59	48%	0.482	29%	0.29	S	S	.	.	H	α-helix	trans	-64.8	-44.8	177.4	-64.8	170.9	0	0	0	111	L124 L125 P126 T130 L131	L124-I128 HydrophobicContact CD1-CD1 4.3Å; L124-I128 HydrophobicContact CG-CD1 4.14Å; L124-I128 PolarHBondContact O-N 3.13Å; L124-I128 VanDerWaalsContact O-N 3.12Å; L125-I128 PolarHBondContact O-N 3.44Å; P126-I128 VanDerWaalsContact C-N 3.34Å; P126-I128 PolarHBondContact O-N 3.01Å; I128-T130 PolarHBondContact O-N 3.27Å; I128-L131 HydrophobicContact CG2-CD1 4.47Å; I128-L131 VanDerWaalsContact O-CB 3.28Å; I128-L131 WeakPolarHBondContact O-CB 3.49Å; I128-L131 VanDerWaalsContact O-CG 3.23Å; I128-L131 WeakPolarHBondContact O-CG 3.27Å; I128-L131 PolarHBondContact O-N 2.98Å; I128-L131 VanDerWaalsContact O-N 3.09Å
129	A	92	Very high	93.2	Very high	21 Å²	21	58.7 Å²	58.7	17%	0.174	30%	0.298	C	S	.	.	H	α-helix	trans	-74.3	-10.4	-176.5	0	0	0	0	0	114	M105 L125 P126 P132	M105-A129 HydrophobicContact CE-CB 3.11Å; L125-A129 WeakPolarHBondContact O-CB 3.49Å; L125-A129 PolarHBondContact O-N 3.19Å; P126-A129 PolarHBondContact O-N 3.22Å; A129-P132 WeakPolarHBondContact O-CD 3.5Å
130	T	93	Very high	93.5	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.012	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-11.2	168.4	63	0	0	0	0	113.6	P126 S127 I128 L133 L134 A174 M259	P126-T130 WeakPolarHBondContact O-CG2 3.38Å; P126-T130 PolarHBondContact O-N 3.02Å; P126-T130 PolarHBondContact O-OG1 3.43Å; S127-T130 PolarHBondContact O-N 2.78Å; S127-T130 PolarHBondContact O-OG1 2.88Å; I128-T130 PolarHBondContact O-N 3.27Å; T130-L133 WeakPolarHBondContact O-CB 3.28Å; T130-L133 PolarHBondContact O-N 2.9Å; T130-L133 VanDerWaalsContact O-N 3.11Å; T130-L134 WeakPolarHBondContact O-CG 3.22Å; T130-L134 PolarHBondContact O-N 2.96Å; T130-A174 HydrophobicContact CG2-CB 3.42Å; T130-A174 VanDerWaalsContact CG2-CB 3.42Å; T130-M259 HydrophobicContact CG2-CE 3.62Å
131	L	93.5	Very high	93.4	Very high	90 Å²	90	48.3 Å²	48.3	47%	0.471	27%	0.268	S	S	.	.	H	α-helix	trans	-56.2	-41.7	-177.8	-69.2	174.5	0	0	0	114	I128 L133 L134 M135	I128-L131 HydrophobicContact CG2-CD1 4.47Å; I128-L131 VanDerWaalsContact O-CB 3.28Å; I128-L131 WeakPolarHBondContact O-CB 3.49Å; I128-L131 VanDerWaalsContact O-CG 3.23Å; I128-L131 WeakPolarHBondContact O-CG 3.27Å; I128-L131 PolarHBondContact O-N 2.98Å; I128-L131 VanDerWaalsContact O-N 3.09Å; L131-L133 VanDerWaalsContact C-N 3.31Å; L131-L133 PolarHBondContact O-N 3.09Å; L131-L134 PolarHBondContact O-N 2.94Å; L131-M135 WeakPolarHBondContact O-CB 3.37Å; L131-M135 VanDerWaalsContact O-CG 3.25Å; L131-M135 WeakPolarHBondContact O-CG 3.35Å; L131-M135 PolarHBondContact O-N 3.25Å
132	P	92.3	Very high	93.4	Very high	43 Å²	43	50.2 Å²	50.2	28%	0.279	28%	0.281	S	S	.	.	H	α-helix	trans	-58.4	-41.8	175.9	-24.9	35.5	0	0	0	113.2	S97 L100 A129 M135 V136	S97-P132 VanDerWaalsContact OG-C 3.3Å; S97-P132 PolarHBondContact OG-O 2.92Å; S97-P132 VanDerWaalsContact OG-O 3.05Å; L100-P132 HydrophobicContact CD2-CB 4.01Å; L100-P132 HydrophobicContact CD2-CG 4.12Å; A129-P132 WeakPolarHBondContact O-CD 3.5Å; P132-M135 PolarHBondContact O-N 2.88Å; P132-V136 WeakPolarHBondContact O-CG2 3.3Å; P132-V136 PolarHBondContact O-N 2.66Å; P132-V136 VanDerWaalsContact O-N 3.08Å
133	L	94.9	Very high	93.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-47.4	174.7	173.7	62.6	0	0	0	111.2	S97 T130 L131 M135 Y137 V263 I266 L267	S97-L133 WeakPolarHBondContact OG-CA 3.44Å; S97-L133 PolarHBondContact OG-N 3.39Å; T130-L133 WeakPolarHBondContact O-CB 3.28Å; T130-L133 PolarHBondContact O-N 2.9Å; T130-L133 VanDerWaalsContact O-N 3.11Å; L131-L133 VanDerWaalsContact C-N 3.31Å; L131-L133 PolarHBondContact O-N 3.09Å; L133-M135 PolarHBondContact O-N 2.9Å; L133-Y137 PolarHBondContact O-N 2.95Å; L133-Y137 VanDerWaalsContact O-N 3.09Å; L133-V263 HydrophobicContact CD1-CG2 4.28Å; L133-V263 HydrophobicContact CD2-CG2 4.08Å; L133-I266 HydrophobicContact CD1-CB 4.49Å; L133-I266 HydrophobicContact CD1-CG2 4.27Å; L133-I266 HydrophobicContact CD2-CD1 3.81Å; L133-I266 HydrophobicContact CG-CG2 4.4Å; L133-L267 HydrophobicContact CD1-CD1 3.67Å; L133-L267 HydrophobicContact CD1-CD2 3.89Å; L133-L267 HydrophobicContact CD1-CG 3.51Å
134	L	95.7	Very high	93.5	Very high	18 Å²	18	47.9 Å²	47.9	9%	0.094	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-38	179.8	-62.1	-177.2	0	0	0	112.7	T130 L131 Y137 A138 I170	T130-L134 WeakPolarHBondContact O-CG 3.22Å; T130-L134 PolarHBondContact O-N 2.96Å; L131-L134 PolarHBondContact O-N 2.94Å; L134-Y137 PolarHBondContact O-N 3.16Å; L134-A138 WeakPolarHBondContact O-CB 3.4Å; L134-A138 PolarHBondContact O-N 3.5Å; L134-I170 HydrophobicContact CD2-CB 4.31Å; L134-I170 HydrophobicContact CD2-CD1 3.46Å; L134-I170 VanDerWaalsContact CD2-CD1 3.46Å; L134-I170 HydrophobicContact CD2-CG1 3.51Å
135	M	95.7	Very high	93.5	Very high	108 Å²	108	46 Å²	46	53%	0.532	27%	0.27	S	S	.	.	H	α-helix	trans	-68.9	-41.5	179.1	-68.3	-66.1	78.4	0	0	112.4	L131 P132 L133 Y137 A138 V139	L131-M135 WeakPolarHBondContact O-CB 3.37Å; L131-M135 VanDerWaalsContact O-CG 3.25Å; L131-M135 WeakPolarHBondContact O-CG 3.35Å; L131-M135 PolarHBondContact O-N 3.25Å; P132-M135 PolarHBondContact O-N 2.88Å; L133-M135 PolarHBondContact O-N 2.9Å; M135-Y137 VanDerWaalsContact C-N 3.34Å; M135-A138 HydrophobicContact CE-CB 4.08Å; M135-A138 PolarHBondContact O-N 2.88Å; M135-V139 WeakPolarHBondContact O-CG2 3.2Å; M135-V139 PolarHBondContact O-N 2.87Å
136	V	96.3	Very high	93.4	Very high	18 Å²	18	44.3 Å²	44.3	11%	0.109	26%	0.262	C	S	.	.	H	α-helix	trans	-65.6	-40.6	175	173	0	0	0	0	111.4	V93 E94 S97 P132 A138 V139 N140	V93-V136 HydrophobicContact CG1-CB 4.44Å; V93-V136 HydrophobicContact CG1-CG1 4.03Å; V93-V136 HydrophobicContact CG1-CG2 3.54Å; E94-V136 HydrophobicContact CB-CG1 4.4Å; E94-V136 HydrophobicContact CG-CG1 3.64Å; S97-V136 VanDerWaalsContact CB-CG2 3.49Å; S97-V136 WeakPolarHBondContact OG-CG2 3.46Å; P132-V136 WeakPolarHBondContact O-CG2 3.3Å; P132-V136 PolarHBondContact O-N 2.66Å; P132-V136 VanDerWaalsContact O-N 3.08Å; V136-A138 VanDerWaalsContact C-N 3.32Å; V136-A138 PolarHBondContact O-N 3.31Å; V136-V139 PolarHBondContact O-N 3.5Å; V136-N140 WeakPolarHBondContact O-CB 3.16Å; V136-N140 PolarHBondContact O-N 3.34Å
137	Y	95.9	Very high	93.2	Very high	3 Å²	3	46.6 Å²	46.6	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-45	172.2	-174.3	-87.3	0	0	0	112	L133 L134 M135 V139 S141 N142 S143 Y166 Y167 I170 I266 H269	L133-Y137 PolarHBondContact O-N 2.95Å; L133-Y137 VanDerWaalsContact O-N 3.09Å; L134-Y137 PolarHBondContact O-N 3.16Å; M135-Y137 VanDerWaalsContact C-N 3.34Å; Y137-V139 PolarHBondContact O-N 3.45Å; Y137-S141 WeakPolarHBondContact O-CB 3.33Å; Y137-S141 PolarHBondContact O-N 2.89Å; Y137-N142 PolarHBondContact O-N 2.94Å; Y137-S143 PolarHBondContact OH-O 2.95Å; Y137-Y166 HydrophobicContact CE1-CD1 4.13Å; Y137-Y166 AromaticContact CE1-CE1 3.56Å; Y137-Y166 HydrophobicContact CE1-CE1 3.56Å; Y137-Y166 AromaticContact CZ-CE1 3.62Å; Y137-Y166 VanDerWaalsContact OH-CE1 3.28Å; Y137-Y166 WeakPolarHBondContact OH-CE1 3.3Å; Y137-Y166 PolarHBondContact OH-OH 2.91Å; Y137-Y167 HydrophobicContact CD1-CE1 4.04Å; Y137-I170 HydrophobicContact CD1-CD1 3.83Å; Y137-I170 HydrophobicContact CE1-CD1 4.25Å; Y137-I170 HydrophobicContact CG-CD1 4.07Å; Y137-I266 HydrophobicContact CD2-CG2 3.82Å; Y137-I266 HydrophobicContact CE2-CG2 4.43Å; Y137-I266 HydrophobicContact CG-CG2 4.33Å; Y137-H269 AromaticContact CE2-CE1 3.59Å
138	A	95.2	Very high	93.2	Very high	19 Å²	19	44.7 Å²	44.7	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-40.3	-179.9	0	0	0	0	0	112.8	L134 M135 V136 N142 Y167	L134-A138 WeakPolarHBondContact O-CB 3.4Å; L134-A138 PolarHBondContact O-N 3.5Å; M135-A138 HydrophobicContact CE-CB 4.08Å; M135-A138 PolarHBondContact O-N 2.88Å; V136-A138 VanDerWaalsContact C-N 3.32Å; V136-A138 PolarHBondContact O-N 3.31Å; A138-N142 WeakPolarHBondContact O-CA 3.49Å; A138-N142 WeakPolarHBondContact O-CB 3.45Å; A138-N142 PolarHBondContact O-N 3.35Å; A138-Y167 HydrophobicContact CB-CE1 3.57Å
139	V	94.7	Very high	93.1	Very high	119 Å²	119	42.1 Å²	42.1	72%	0.721	26%	0.257	S	S	*	.	H	α-helix	trans	-77.6	-44.2	-177.5	172.2	0	0	0	0	112	M135 V136 Y137	M135-V139 WeakPolarHBondContact O-CG2 3.2Å; M135-V139 PolarHBondContact O-N 2.87Å; V136-V139 PolarHBondContact O-N 3.5Å; Y137-V139 PolarHBondContact O-N 3.45Å
140	N	93	Very high	93.1	Very high	51 Å²	51	44 Å²	44	27%	0.273	26%	0.264	S	S	.	.	H	α-helix	trans	-83.9	-40.8	-173.1	-72.9	3.7	0	0	0	113.1	H90 E94 V136	H90-N140 PolarHBondContact O-ND2 3.06Å; E94-N140 WeakPolarHBondContact CG-ND2 3.45Å; E94-N140 WeakPolarHBondContact OE1-CB 3.2Å; E94-N140 PolarHBondContact OE1-ND2 2.67Å; V136-N140 WeakPolarHBondContact O-CB 3.16Å; V136-N140 PolarHBondContact O-N 3.34Å
141	S	89.8	Confident	93.1	Very high	37 Å²	37	49.2 Å²	49.2	26%	0.259	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-46	-173.6	-66.7	0	0	0	0	112.6	Y137 S143 H269	Y137-S141 WeakPolarHBondContact O-CB 3.33Å; Y137-S141 PolarHBondContact O-N 2.89Å; S141-S143 PolarHBondContact O-N 3.48Å; S141-H269 PolarHBondContact OG-CE1 3.45Å; S141-H269 PolarHBondContact OG-NE2 3.48Å
142	N	90.9	Very high	93.1	Very high	106 Å²	106	48.7 Å²	48.7	57%	0.567	29%	0.285	S	S	*	.			trans	46.8	21.3	-175.7	-156	23.5	0	0	0	115	Y137 A138 T144 Y167	Y137-N142 PolarHBondContact O-N 2.94Å; A138-N142 WeakPolarHBondContact O-CA 3.49Å; A138-N142 WeakPolarHBondContact O-CB 3.45Å; A138-N142 PolarHBondContact O-N 3.35Å; N142-T144 PolarHBondContact O-N 3.29Å; N142-Y167 PolarHBondContact OD1-OH 2.85Å
143	S	90.9	Very high	93.2	Very high	55 Å²	55	48.6 Å²	48.6	39%	0.385	28%	0.281	S	S	.	.			trans	-90.5	111.1	-174.5	-174.3	0	0	0	0	109.3	Y137 S141 Y166	Y137-S143 PolarHBondContact OH-O 2.95Å; S141-S143 PolarHBondContact O-N 3.48Å; S143-Y166 WeakPolarHBondContact O-CE1 3.18Å
144	T	93.7	Very high	93.1	Very high	14 Å²	14	54.2 Å²	54.2	9%	0.086	32%	0.317	C	S	.	.			trans	-114.3	9.3	-179.6	51.7	0	0	0	0	112.3	N142 N161 L162 Y166 Y167	N142-T144 PolarHBondContact O-N 3.29Å; T144-N161 PolarHBondContact OG1-OD1 3.43Å; T144-L162 PolarHBondContact O-N 3.06Å; T144-Y166 HydrophobicContact CG2-CD1 4.16Å; T144-Y166 HydrophobicContact CG2-CG 4.36Å; T144-Y167 HydrophobicContact CG2-CD2 4.07Å; T144-Y167 HydrophobicContact CG2-CE2 3.43Å; T144-Y167 VanDerWaalsContact CG2-CE2 3.43Å
145	S	92.7	Very high	93.1	Very high	57 Å²	57	59.4 Å²	59.4	40%	0.399	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	129.8	179.5	-70.9	0	0	0	0	110.9	F160	S145-F160 WeakPolarHBondContact CA-O 3.21Å
146	V	91.2	Very high	93	Very high	26 Å²	26	58.9 Å²	58.9	16%	0.158	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.9	176.4	-63.3	0	0	0	0	111	V148 V159 F160 L162 Y166	V146-V148 PolarHBondContact O-N 3.47Å; V146-V159 WeakPolarHBondContact O-CA 3.3Å; V146-F160 HydrophobicContact CG2-CB 4.41Å; V146-F160 WeakPolarHBondContact CG2-O 3.4Å; V146-F160 PolarHBondContact N-O 3.46Å; V146-F160 PolarHBondContact O-N 3.4Å; V146-L162 HydrophobicContact CB-CD1 4.41Å; V146-L162 HydrophobicContact CG1-CD1 3.71Å; V146-L162 HydrophobicContact CG2-CD1 3.76Å; V146-L162 HydrophobicContact CG2-CG 3.99Å; V146-Y166 HydrophobicContact CG1-CD2 3.96Å; V146-Y166 HydrophobicContact CG1-CE2 3.93Å
147	A	89.7	Confident	92.8	Very high	48 Å²	48	59.6 Å²	59.6	40%	0.397	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	129.3	166.4	0	0	0	0	0	110	F405	A147-F405 HydrophobicContact CB-CD1 3.99Å; A147-F405 HydrophobicContact CB-CE1 4.29Å; A147-F405 WeakPolarHBondContact O-CE1 3.42Å
148	V	91.8	Very high	92.6	Very high	10 Å²	10	62 Å²	62	6%	0.061	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-93.6	135.6	-179.3	178.3	0	0	0	0	109.6	V146 L152 Q153 F156 G157 A158 F160	V146-V148 PolarHBondContact O-N 3.47Å; V148-L152 HydrophobicContact CG1-CB 3.59Å; V148-Q153 HydrophobicContact CB-CG 4.32Å; V148-Q153 HydrophobicContact CG1-CG 4.25Å; V148-Q153 PolarHBondContact O-NE2 3.44Å; V148-Q153 VanDerWaalsContact O-NE2 3.14Å; V148-F156 HydrophobicContact CG1-CB 4.1Å; V148-F156 HydrophobicContact CG2-CB 4.09Å; V148-G157 WeakPolarHBondContact CB-O 3.45Å; V148-G157 WeakPolarHBondContact CG2-O 3.27Å; V148-A158 PolarHBondContact N-O 3.04Å; V148-F160 HydrophobicContact CG2-CB 3.53Å
149	P	92	Very high	92.5	Very high	39 Å²	39	65.5 Å²	65.5	25%	0.253	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-55.9	140.8	174.6	-25.4	34.1	0	0	0	112.4	Q151 L152 Q153 F404 F405	P149-Q151 PolarHBondContact O-N 3.27Å; P149-L152 HydrophobicContact CG-CD1 4.39Å; P149-L152 WeakPolarHBondContact O-CA 3.22Å; P149-L152 PolarHBondContact O-N 2.95Å; P149-Q153 WeakPolarHBondContact O-CG 3.44Å; P149-Q153 PolarHBondContact O-N 3.47Å; P149-F404 CarbonylContact C-O 3.48Å; P149-F404 WeakPolarHBondContact CA-O 3.4Å; P149-F405 HydrophobicContact CB-CE1 4.44Å; P149-F405 HydrophobicContact CG-CE1 3.95Å; P149-F405 HydrophobicContact CG-CZ 4.1Å
150	I	92.5	Very high	92.5	Very high	61 Å²	61	63.6 Å²	63.6	31%	0.313	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-47.3	-39.8	-176.1	-67.3	161.5	0	0	0	112	L152 Q153 F404 N406	I150-L152 PolarHBondContact O-N 2.88Å; I150-Q153 PolarHBondContact O-N 2.86Å; I150-F404 WeakPolarHBondContact CG1-O 3.43Å; I150-F404 PolarHBondContact N-O 3.37Å; I150-N406 WeakPolarHBondContact CD1-OD1 3.33Å; I150-N406 WeakPolarHBondContact CG1-OD1 3.48Å
151	Q	92.4	Very high	92.6	Very high	112 Å²	112	65.7 Å²	65.7	52%	0.523	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-65.4	-24.1	-179.2	-56.4	80.5	4.3	0	0	113.3	P149 F403	P149-Q151 PolarHBondContact O-N 3.27Å; Q151-F403 PolarHBondContact NE2-O 3.07Å
152	L	93.6	Very high	92.8	Very high	78 Å²	78	66.4 Å²	66.4	41%	0.408	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-105	-8.6	-177.9	-63.5	179.9	0	0	0	113.1	V148 P149 I150 P154 I155 F156	V148-L152 HydrophobicContact CG1-CB 3.59Å; P149-L152 HydrophobicContact CG-CD1 4.39Å; P149-L152 WeakPolarHBondContact O-CA 3.22Å; P149-L152 PolarHBondContact O-N 2.95Å; I150-L152 PolarHBondContact O-N 2.88Å; L152-P154 VanDerWaalsContact C-CD 3.4Å; L152-I155 PolarHBondContact O-N 3.5Å; L152-I155 VanDerWaalsContact O-N 3.09Å; L152-F156 HydrophobicContact CB-CD2 4.2Å; L152-F156 PolarHBondContact O-N 3.37Å; L152-F156 VanDerWaalsContact O-N 3.09Å
153	Q	93.9	Very high	93	Very high	41 Å²	41	62.5 Å²	62.5	19%	0.192	37%	0.369	C	S	.	.	H	α-helix	trans	-59	-34.2	179.6	-65.6	-177.4	3.4	0	0	114.5	V148 P149 I150 I155 G157 N406	V148-Q153 HydrophobicContact CB-CG 4.32Å; V148-Q153 HydrophobicContact CG1-CG 4.25Å; V148-Q153 PolarHBondContact O-NE2 3.44Å; V148-Q153 VanDerWaalsContact O-NE2 3.14Å; P149-Q153 WeakPolarHBondContact O-CG 3.44Å; P149-Q153 PolarHBondContact O-N 3.47Å; I150-Q153 PolarHBondContact O-N 2.86Å; Q153-I155 PolarHBondContact O-N 3.18Å; Q153-I155 VanDerWaalsContact O-N 3.12Å; Q153-G157 WeakPolarHBondContact CA-O 3.33Å; Q153-G157 VanDerWaalsContact O-CA 3.25Å; Q153-G157 WeakPolarHBondContact O-CA 3.26Å; Q153-G157 PolarHBondContact O-N 3.22Å; Q153-N406 PolarHBondContact NE2-ND2 3.06Å; Q153-N406 PolarHBondContact OE1-ND2 3.16Å
154	P	94.5	Very high	93.2	Very high	118 Å²	118	66.2 Å²	66.2	77%	0.766	38%	0.383	S	S	*	.	H	α-helix	trans	-59.6	-22.5	175.3	-26.5	36.1	0	0	0	114.2	L152	L152-P154 VanDerWaalsContact C-CD 3.4Å
155	I	95.3	Very high	93.3	Very high	128 Å²	128	71 Å²	71	66%	0.656	41%	0.407	S	S	*	.	H	α-helix	trans	-99.8	-43.6	-178.1	-58.1	174.4	0	0	0	111.1	L152 Q153	L152-I155 PolarHBondContact O-N 3.5Å; L152-I155 VanDerWaalsContact O-N 3.09Å; Q153-I155 PolarHBondContact O-N 3.18Å; Q153-I155 VanDerWaalsContact O-N 3.12Å
156	F	93.5	Very high	93.5	Very high	96 Å²	96	69.3 Å²	69.3	42%	0.421	39%	0.392	S	S	.	.	H	α-helix	trans	-110.4	-3.1	-170.2	-62.6	-75.9	0	0	0	114.5	V148 L152 F160	V148-F156 HydrophobicContact CG1-CB 4.1Å; V148-F156 HydrophobicContact CG2-CB 4.09Å; L152-F156 HydrophobicContact CB-CD2 4.2Å; L152-F156 PolarHBondContact O-N 3.37Å; L152-F156 VanDerWaalsContact O-N 3.09Å; F156-F160 HydrophobicContact CB-CB 4.45Å; F156-F160 HydrophobicContact CB-CD2 3.96Å; F156-F160 HydrophobicContact CB-CG 4.4Å; F156-F160 AromaticContact CD1-CD2 3.88Å; F156-F160 HydrophobicContact CD1-CD2 3.88Å; F156-F160 AromaticContact CD1-CE2 3.76Å; F156-F160 HydrophobicContact CD1-CE2 3.76Å; F156-F160 HydrophobicContact CD1-CG 4.47Å; F156-F160 HydrophobicContact CD1-CZ 4.25Å; F156-F160 HydrophobicContact CG-CD2 4.38Å
157	G	92.6	Very high	93.6	Very high	33 Å²	33	69.9 Å²	69.9	34%	0.34	39%	0.392	S	S	.	.			trans	75.1	178.8	-168.9	0	0	0	0	0	112.9	V148 Q153	V148-G157 WeakPolarHBondContact CB-O 3.45Å; V148-G157 WeakPolarHBondContact CG2-O 3.27Å; Q153-G157 WeakPolarHBondContact CA-O 3.33Å; Q153-G157 VanDerWaalsContact O-CA 3.25Å; Q153-G157 WeakPolarHBondContact O-CA 3.26Å; Q153-G157 PolarHBondContact O-N 3.22Å
158	A	91.7	Very high	93.9	Very high	54 Å²	54	70 Å²	70	45%	0.446	39%	0.392	S	S	.	.	S	Bend	trans	-71.5	-30.3	179.8	0	0	0	0	0	113.3	V148	V148-A158 PolarHBondContact N-O 3.04Å
159	V	92.4	Very high	94.1	Very high	92 Å²	92	72.4 Å²	72.4	56%	0.558	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131	127.4	-180	180	0	0	0	0	107.9	V146	V146-V159 WeakPolarHBondContact O-CA 3.3Å
160	F	93.9	Very high	94.3	Very high	79 Å²	79	70.5 Å²	70.5	35%	0.346	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.1	179.6	-171.3	-100.4	0	0	0	110.6	S145 V146 V148 F156 L162	S145-F160 WeakPolarHBondContact CA-O 3.21Å; V146-F160 HydrophobicContact CG2-CB 4.41Å; V146-F160 WeakPolarHBondContact CG2-O 3.4Å; V146-F160 PolarHBondContact N-O 3.46Å; V146-F160 PolarHBondContact O-N 3.4Å; V148-F160 HydrophobicContact CG2-CB 3.53Å; F156-F160 HydrophobicContact CB-CB 4.45Å; F156-F160 HydrophobicContact CB-CD2 3.96Å; F156-F160 HydrophobicContact CB-CG 4.4Å; F156-F160 AromaticContact CD1-CD2 3.88Å; F156-F160 HydrophobicContact CD1-CD2 3.88Å; F156-F160 AromaticContact CD1-CE2 3.76Å; F156-F160 HydrophobicContact CD1-CE2 3.76Å; F156-F160 HydrophobicContact CD1-CG 4.47Å; F156-F160 HydrophobicContact CD1-CZ 4.25Å; F156-F160 HydrophobicContact CG-CD2 4.38Å; F160-L162 HydrophobicContact CD1-CD2 3.78Å; F160-L162 HydrophobicContact CD1-CG 4.17Å; F160-L162 HydrophobicContact CE1-CD2 3.84Å
161	N	95.2	Very high	94.4	Very high	95 Å²	95	68.1 Å²	68.1	51%	0.508	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	113.1	176.7	-172.9	-30.6	0	0	0	109.7	T144 G163	T144-N161 PolarHBondContact OG1-OD1 3.43Å; N161-G163 WeakPolarHBondContact OD1-CA 3.47Å; N161-G163 PolarHBondContact OD1-N 2.79Å
162	L	95.1	Very high	94.6	Very high	53 Å²	53	68.8 Å²	68.8	28%	0.277	38%	0.384	S	S	.	.			trans	-83.5	-13.8	178.8	-72.9	172.6	0	0	0	113.1	T144 V146 F160 I164 L165 Y166	T144-L162 PolarHBondContact O-N 3.06Å; V146-L162 HydrophobicContact CB-CD1 4.41Å; V146-L162 HydrophobicContact CG1-CD1 3.71Å; V146-L162 HydrophobicContact CG2-CD1 3.76Å; V146-L162 HydrophobicContact CG2-CG 3.99Å; F160-L162 HydrophobicContact CD1-CD2 3.78Å; F160-L162 HydrophobicContact CD1-CG 4.17Å; F160-L162 HydrophobicContact CE1-CD2 3.84Å; L162-I164 PolarHBondContact O-N 3.05Å; L162-L165 HydrophobicContact CB-CB 4.34Å; L162-L165 WeakPolarHBondContact O-CB 3.49Å; L162-L165 PolarHBondContact O-N 3.05Å; L162-L165 VanDerWaalsContact O-N 3.11Å; L162-Y166 HydrophobicContact CD1-CD2 4.22Å
163	G	94.7	Very high	94.8	Very high	24 Å²	24	65.4 Å²	65.4	25%	0.247	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	-129.3	-177.3	0	0	0	0	0	112.3	N161 L165 Y166	N161-G163 WeakPolarHBondContact OD1-CA 3.47Å; N161-G163 PolarHBondContact OD1-N 2.79Å; G163-L165 PolarHBondContact O-N 3.11Å; G163-L165 VanDerWaalsContact O-N 3.14Å; G163-Y166 WeakPolarHBondContact O-CB 3.4Å; G163-Y166 PolarHBondContact O-N 3.47Å
164	I	95.1	Very high	94.9	Very high	132 Å²	132	63.4 Å²	63.4	68%	0.677	36%	0.357	S	S	*	.	H	α-helix	trans	-58	-28.1	-179.4	-167.6	60	0	0	0	113.5	L162 Y166 Y167 A168	L162-I164 PolarHBondContact O-N 3.05Å; I164-Y166 PolarHBondContact O-N 3.23Å; I164-Y167 HydrophobicContact CD1-CD2 4.28Å; I164-Y167 PolarHBondContact O-N 3.36Å; I164-A168 PolarHBondContact O-N 3.14Å
165	L	96	Very high	95	Very high	116 Å²	116	58.7 Å²	58.7	61%	0.607	33%	0.326	S	S	*	.	H	α-helix	trans	-66	-26.6	178.4	-60.1	176.2	0	0	0	111.9	L162 G163 A168 Y169	L162-L165 HydrophobicContact CB-CB 4.34Å; L162-L165 WeakPolarHBondContact O-CB 3.49Å; L162-L165 PolarHBondContact O-N 3.05Å; L162-L165 VanDerWaalsContact O-N 3.11Å; G163-L165 PolarHBondContact O-N 3.11Å; G163-L165 VanDerWaalsContact O-N 3.14Å; L165-A168 PolarHBondContact O-N 3.42Å; L165-Y169 WeakPolarHBondContact O-CB 3.25Å; L165-Y169 PolarHBondContact O-N 2.76Å
166	Y	95.6	Very high	95.1	Very high	20 Å²	20	54.2 Å²	54.2	8%	0.078	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-43.3	173.9	-171.5	-98.7	0	0	0	111.4	Y137 S143 T144 V146 L162 G163 I164 A168 Y169 I170	Y137-Y166 HydrophobicContact CE1-CD1 4.13Å; Y137-Y166 AromaticContact CE1-CE1 3.56Å; Y137-Y166 HydrophobicContact CE1-CE1 3.56Å; Y137-Y166 AromaticContact CZ-CE1 3.62Å; Y137-Y166 VanDerWaalsContact OH-CE1 3.28Å; Y137-Y166 WeakPolarHBondContact OH-CE1 3.3Å; Y137-Y166 PolarHBondContact OH-OH 2.91Å; S143-Y166 WeakPolarHBondContact O-CE1 3.18Å; T144-Y166 HydrophobicContact CG2-CD1 4.16Å; T144-Y166 HydrophobicContact CG2-CG 4.36Å; V146-Y166 HydrophobicContact CG1-CD2 3.96Å; V146-Y166 HydrophobicContact CG1-CE2 3.93Å; L162-Y166 HydrophobicContact CD1-CD2 4.22Å; G163-Y166 WeakPolarHBondContact O-CB 3.4Å; G163-Y166 PolarHBondContact O-N 3.47Å; I164-Y166 PolarHBondContact O-N 3.23Å; Y166-A168 VanDerWaalsContact C-N 3.34Å; Y166-A168 PolarHBondContact O-N 3.28Å; Y166-Y169 HydrophobicContact CD2-CD1 4.26Å; Y166-Y169 HydrophobicContact CE2-CD1 4.16Å; Y166-Y169 HydrophobicContact CE2-CE1 4.4Å; Y166-Y169 WeakPolarHBondContact O-CB 3.47Å; Y166-Y169 PolarHBondContact O-N 3.01Å; Y166-Y169 VanDerWaalsContact O-N 3.16Å; Y166-I170 HydrophobicContact CD1-CG2 4.41Å; Y166-I170 HydrophobicContact CE1-CD1 4.32Å; Y166-I170 HydrophobicContact CE1-CG2 3.84Å; Y166-I170 WeakPolarHBondContact O-CG1 3.37Å; Y166-I170 PolarHBondContact O-N 3.47Å
167	Y	95.4	Very high	95.3	Very high	38 Å²	38	49.7 Å²	49.7	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-40.6	174.7	-66.4	-77.9	0	0	0	112	Y137 A138 N142 T144 I164 Y169 I170 G171	Y137-Y167 HydrophobicContact CD1-CE1 4.04Å; A138-Y167 HydrophobicContact CB-CE1 3.57Å; N142-Y167 PolarHBondContact OD1-OH 2.85Å; T144-Y167 HydrophobicContact CG2-CD2 4.07Å; T144-Y167 HydrophobicContact CG2-CE2 3.43Å; T144-Y167 VanDerWaalsContact CG2-CE2 3.43Å; I164-Y167 HydrophobicContact CD1-CD2 4.28Å; I164-Y167 PolarHBondContact O-N 3.36Å; Y167-Y169 VanDerWaalsContact C-N 3.31Å; Y167-Y169 PolarHBondContact O-N 3.4Å; Y167-I170 HydrophobicContact CD1-CD1 4.23Å; Y167-I170 WeakPolarHBondContact O-CG1 3.43Å; Y167-I170 PolarHBondContact O-N 3.35Å; Y167-G171 PolarHBondContact O-N 2.89Å
168	A	95.2	Very high	95.4	Very high	50 Å²	50	48.1 Å²	48.1	41%	0.413	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-43.2	172.3	0	0	0	0	0	111.3	I164 L165 Y166 G171 M172	I164-A168 PolarHBondContact O-N 3.14Å; L165-A168 PolarHBondContact O-N 3.42Å; Y166-A168 VanDerWaalsContact C-N 3.34Å; Y166-A168 PolarHBondContact O-N 3.28Å; A168-G171 PolarHBondContact O-N 3.29Å; A168-M172 WeakPolarHBondContact O-CB 3.44Å; A168-M172 VanDerWaalsContact O-CG 3.3Å; A168-M172 WeakPolarHBondContact O-CG 3.5Å; A168-M172 PolarHBondContact O-N 2.84Å
169	Y	95.4	Very high	95.6	Very high	61 Å²	61	46.2 Å²	46.2	24%	0.239	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-52.7	175.9	160.1	-104.5	0	0	0	112.9	L165 Y166 Y167 G171 M172 L173 L275	L165-Y169 WeakPolarHBondContact O-CB 3.25Å; L165-Y169 PolarHBondContact O-N 2.76Å; Y166-Y169 HydrophobicContact CD2-CD1 4.26Å; Y166-Y169 HydrophobicContact CE2-CD1 4.16Å; Y166-Y169 HydrophobicContact CE2-CE1 4.4Å; Y166-Y169 WeakPolarHBondContact O-CB 3.47Å; Y166-Y169 PolarHBondContact O-N 3.01Å; Y166-Y169 VanDerWaalsContact O-N 3.16Å; Y167-Y169 VanDerWaalsContact C-N 3.31Å; Y167-Y169 PolarHBondContact O-N 3.4Å; Y169-G171 VanDerWaalsContact C-N 3.29Å; Y169-G171 PolarHBondContact O-N 3.48Å; Y169-M172 PolarHBondContact O-N 3.42Å; Y169-L173 WeakPolarHBondContact O-CB 3.1Å; Y169-L173 PolarHBondContact O-N 2.99Å; Y169-L275 HydrophobicContact CE2-CD1 4.04Å; Y169-L275 WeakPolarHBondContact OH-CD1 3.2Å
170	I	95.8	Very high	95.8	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-29.3	-179.5	57.5	167.1	0	0	0	112.2	L134 Y137 Y166 Y167 L173 A174 I266	L134-I170 HydrophobicContact CD2-CB 4.31Å; L134-I170 HydrophobicContact CD2-CD1 3.46Å; L134-I170 VanDerWaalsContact CD2-CD1 3.46Å; L134-I170 HydrophobicContact CD2-CG1 3.51Å; Y137-I170 HydrophobicContact CD1-CD1 3.83Å; Y137-I170 HydrophobicContact CE1-CD1 4.25Å; Y137-I170 HydrophobicContact CG-CD1 4.07Å; Y166-I170 HydrophobicContact CD1-CG2 4.41Å; Y166-I170 HydrophobicContact CE1-CD1 4.32Å; Y166-I170 HydrophobicContact CE1-CG2 3.84Å; Y166-I170 WeakPolarHBondContact O-CG1 3.37Å; Y166-I170 PolarHBondContact O-N 3.47Å; Y167-I170 HydrophobicContact CD1-CD1 4.23Å; Y167-I170 WeakPolarHBondContact O-CG1 3.43Å; Y167-I170 PolarHBondContact O-N 3.35Å; I170-L173 WeakPolarHBondContact O-CB 3.28Å; I170-L173 PolarHBondContact O-N 3.44Å; I170-A174 PolarHBondContact O-N 2.89Å; I170-I266 HydrophobicContact CB-CD1 4.11Å; I170-I266 HydrophobicContact CB-CG1 4.29Å; I170-I266 HydrophobicContact CD1-CG2 4.28Å; I170-I266 HydrophobicContact CG2-CG1 4.47Å
171	G	96.2	Very high	96	Very high	10 Å²	10	38.2 Å²	38.2	10%	0.103	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-48.9	170.1	0	0	0	0	0	112	Y167 A168 Y169 L173 A174 V175	Y167-G171 PolarHBondContact O-N 2.89Å; A168-G171 PolarHBondContact O-N 3.29Å; Y169-G171 VanDerWaalsContact C-N 3.29Å; Y169-G171 PolarHBondContact O-N 3.48Å; G171-L173 VanDerWaalsContact C-N 3.29Å; G171-L173 PolarHBondContact O-N 2.83Å; G171-A174 PolarHBondContact O-N 3.32Å; G171-V175 WeakPolarHBondContact O-CG2 3.37Å; G171-V175 PolarHBondContact O-N 3.32Å
172	M	96	Very high	96	Very high	127 Å²	127	35.5 Å²	35.5	63%	0.626	19%	0.191	S	C	*	.	H	α-helix	trans	-61.3	-37.8	174.2	-74.2	-172.2	-63.4	0	0	112.1	A168 Y169 V175 F176	A168-M172 WeakPolarHBondContact O-CB 3.44Å; A168-M172 VanDerWaalsContact O-CG 3.3Å; A168-M172 WeakPolarHBondContact O-CG 3.5Å; A168-M172 PolarHBondContact O-N 2.84Å; Y169-M172 PolarHBondContact O-N 3.42Å; M172-V175 PolarHBondContact O-N 3.42Å; M172-F176 WeakPolarHBondContact O-CB 3.33Å; M172-F176 PolarHBondContact O-N 2.91Å
173	L	96.9	Very high	96	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-59.3	-47.1	174.8	175.1	65.1	0	0	0	111.1	Y169 I170 G171 F176 C177 I266 L275	Y169-L173 WeakPolarHBondContact O-CB 3.1Å; Y169-L173 PolarHBondContact O-N 2.99Å; I170-L173 WeakPolarHBondContact O-CB 3.28Å; I170-L173 PolarHBondContact O-N 3.44Å; G171-L173 VanDerWaalsContact C-N 3.29Å; G171-L173 PolarHBondContact O-N 2.83Å; L173-F176 WeakPolarHBondContact O-CB 3.42Å; L173-F176 PolarHBondContact O-N 3.43Å; L173-C177 PolarHBondContact O-N 3.4Å; L173-C177 PolarHBondContact O-SG 2.83Å; L173-C177 VanDerWaalsContact O-SG 3.35Å; L173-I266 HydrophobicContact CD2-CD1 4.43Å; L173-I266 HydrophobicContact CD2-CG1 4.14Å; L173-L275 HydrophobicContact CD1-CD1 4.1Å; L173-L275 HydrophobicContact CD1-CD2 3.37Å; L173-L275 HydrophobicContact CD1-CG 3.57Å
174	A	97	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65	-42.4	-179.8	0	0	0	0	0	112.1	T130 I170 G171 F176 C177 T178 A262 I266	T130-A174 HydrophobicContact CG2-CB 3.42Å; T130-A174 VanDerWaalsContact CG2-CB 3.42Å; I170-A174 PolarHBondContact O-N 2.89Å; G171-A174 PolarHBondContact O-N 3.32Å; A174-F176 VanDerWaalsContact C-N 3.33Å; A174-F176 PolarHBondContact O-N 3.27Å; A174-C177 PolarHBondContact O-N 3.27Å; A174-T178 WeakPolarHBondContact O-CG2 3.37Å; A174-T178 PolarHBondContact O-N 2.85Å; A174-T178 PolarHBondContact O-OG1 2.97Å; A174-A262 HydrophobicContact CB-CB 3.88Å; A174-I266 HydrophobicContact CB-CD1 4.18Å
175	V	96	Very high	96.1	Very high	19 Å²	19	28.7 Å²	28.7	12%	0.115	15%	0.154	C	C	.	.	H	α-helix	trans	-64.8	-37.7	174.3	177	0	0	0	0	111.9	L123 P126 S127 G171 M172 T178 N179	L123-V175 HydrophobicContact CD2-CG1 4.39Å; P126-V175 HydrophobicContact CB-CG2 4.43Å; S127-V175 VanDerWaalsContact OG-CG2 3.31Å; S127-V175 WeakPolarHBondContact OG-CG2 3.46Å; G171-V175 WeakPolarHBondContact O-CG2 3.37Å; G171-V175 PolarHBondContact O-N 3.32Å; M172-V175 PolarHBondContact O-N 3.42Å; V175-T178 PolarHBondContact O-OG1 3.09Å; V175-N179 PolarHBondContact O-N 3.45Å; V175-N179 PolarHBondContact O-ND2 3.29Å
176	F	97	Very high	96	Very high	34 Å²	34	24 Å²	24	15%	0.149	13%	0.133	C	C	.	.	H	α-helix	trans	-62.3	-54.2	175	171	-98.5	0	0	0	110	M172 L173 A174 T178 N179 A180 L275 F278 Q281 V282 F285	M172-F176 WeakPolarHBondContact O-CB 3.33Å; M172-F176 PolarHBondContact O-N 2.91Å; L173-F176 WeakPolarHBondContact O-CB 3.42Å; L173-F176 PolarHBondContact O-N 3.43Å; A174-F176 VanDerWaalsContact C-N 3.33Å; A174-F176 PolarHBondContact O-N 3.27Å; F176-T178 VanDerWaalsContact C-N 3.31Å; F176-T178 PolarHBondContact O-N 3.47Å; F176-N179 PolarHBondContact O-N 3.4Å; F176-N179 VanDerWaalsContact O-N 3.11Å; F176-A180 HydrophobicContact CD1-CB 4.2Å; F176-A180 HydrophobicContact CD2-CB 4.24Å; F176-A180 HydrophobicContact CE1-CB 3.88Å; F176-A180 HydrophobicContact CE2-CB 3.92Å; F176-A180 HydrophobicContact CG-CB 4.37Å; F176-A180 HydrophobicContact CZ-CB 3.72Å; F176-A180 WeakPolarHBondContact O-CA 3.32Å; F176-A180 WeakPolarHBondContact O-CB 3.47Å; F176-A180 PolarHBondContact O-N 2.84Å; F176-L275 HydrophobicContact CD1-CD2 4.33Å; F176-L275 HydrophobicContact CE1-CD2 4.29Å; F176-F278 HydrophobicContact CD1-CD1 4.46Å; F176-F278 HydrophobicContact CE1-CB 4.22Å; F176-F278 AromaticContact CE1-CD1 3.74Å; F176-F278 HydrophobicContact CE1-CD1 3.74Å; F176-F278 HydrophobicContact CE1-CG 4.33Å; F176-Q281 HydrophobicContact CZ-CB 4.35Å; F176-V282 HydrophobicContact CE1-CG2 3.87Å; F176-V282 HydrophobicContact CE2-CG2 4.47Å; F176-V282 HydrophobicContact CZ-CB 4.3Å; F176-V282 HydrophobicContact CZ-CG2 3.53Å; F176-F285 HydrophobicContact CD2-CD1 4.47Å; F176-F285 HydrophobicContact CD2-CG 4.45Å; F176-F285 HydrophobicContact CE2-CB 3.89Å; F176-F285 HydrophobicContact CE2-CD1 4.07Å; F176-F285 AromaticContact CE2-CG 3.92Å; F176-F285 HydrophobicContact CE2-CG 3.92Å
177	C	97.9	Very high	96	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.1	-41.6	-176.8	-70.4	0	0	0	0	112.6	L173 A174 N179 G258 A262 F278	L173-C177 PolarHBondContact O-N 3.4Å; L173-C177 PolarHBondContact O-SG 2.83Å; L173-C177 VanDerWaalsContact O-SG 3.35Å; A174-C177 PolarHBondContact O-N 3.27Å; C177-N179 VanDerWaalsContact C-N 3.31Å; C177-N179 PolarHBondContact O-N 3.18Å; C177-G258 VanDerWaalsContact C-CA 3.47Å; C177-G258 WeakPolarHBondContact CB-O 3.19Å; C177-G258 WeakPolarHBondContact O-CA 3.31Å; C177-A262 HydrophobicContact CB-CB 4.18Å; C177-F278 HydrophobicContact CB-CE1 4.07Å; C177-F278 HydrophobicContact CB-CZ 3.98Å
178	T	95.1	Very high	96.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.7	-31.3	179.4	53.3	0	0	0	0	113.7	M105 A174 V175 F176 M259	M105-T178 HydrophobicContact CG-CG2 3.64Å; M105-T178 HydrophobicContact SD-CG2 4.3Å; A174-T178 WeakPolarHBondContact O-CG2 3.37Å; A174-T178 PolarHBondContact O-N 2.85Å; A174-T178 PolarHBondContact O-OG1 2.97Å; V175-T178 PolarHBondContact O-OG1 3.09Å; F176-T178 VanDerWaalsContact C-N 3.31Å; F176-T178 PolarHBondContact O-N 3.47Å; T178-M259 HydrophobicContact CG2-CB 3.94Å; T178-M259 HydrophobicContact CG2-CE 4.14Å
179	N	95.3	Very high	96.3	Very high	15 Å²	15	19.3 Å²	19.3	8%	0.08	11%	0.105	C	C	.	.	H	α-helix	trans	-97.4	-28.6	-178.5	-73.8	-80	0	0	0	113.1	K122 V175 F176 C177 I181 N182 I183	K122-N179 PolarHBondContact O-ND2 3.44Å; K122-N179 PolarHBondContact O-OD1 3.21Å; V175-N179 PolarHBondContact O-N 3.45Å; V175-N179 PolarHBondContact O-ND2 3.29Å; F176-N179 PolarHBondContact O-N 3.4Å; F176-N179 VanDerWaalsContact O-N 3.11Å; C177-N179 VanDerWaalsContact C-N 3.31Å; C177-N179 PolarHBondContact O-N 3.18Å; N179-I181 PolarHBondContact O-N 3.02Å; N179-N182 WeakPolarHBondContact O-CB 3.49Å; N179-N182 PolarHBondContact O-N 2.98Å; N179-N182 VanDerWaalsContact O-N 3.1Å; N179-I183 HydrophobicContact CB-CD1 4.27Å; N179-I183 WeakPolarHBondContact O-CG1 3.28Å; N179-I183 PolarHBondContact O-N 3.38Å
180	A	97.1	Very high	96.4	Very high	2 Å²	2	16.4 Å²	16.4	2%	0.017	9%	0.094	C	C	.	.	H	α-helix	trans	-61	-42.7	-169.1	0	0	0	0	0	113.3	F176 N182 I183 Y184 F278 Q281	F176-A180 HydrophobicContact CD1-CB 4.2Å; F176-A180 HydrophobicContact CD2-CB 4.24Å; F176-A180 HydrophobicContact CE1-CB 3.88Å; F176-A180 HydrophobicContact CE2-CB 3.92Å; F176-A180 HydrophobicContact CG-CB 4.37Å; F176-A180 HydrophobicContact CZ-CB 3.72Å; F176-A180 WeakPolarHBondContact O-CA 3.32Å; F176-A180 WeakPolarHBondContact O-CB 3.47Å; F176-A180 PolarHBondContact O-N 2.84Å; A180-N182 VanDerWaalsContact C-N 3.33Å; A180-I183 PolarHBondContact O-N 3.4Å; A180-Y184 PolarHBondContact O-N 3.03Å; A180-Y184 VanDerWaalsContact O-N 3.16Å; A180-F278 HydrophobicContact CB-CD1 4.24Å; A180-F278 HydrophobicContact CB-CE1 4.18Å; A180-Q281 HydrophobicContact CB-CB 3.99Å; A180-Q281 HydrophobicContact CB-CG 4.44Å
181	I	97.8	Very high	96.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.4	-40.9	176.8	-61.9	165.3	0	0	0	110.1	N179 Y184 A185 Q194 C254 F261 F278	N179-I181 PolarHBondContact O-N 3.02Å; I181-Y184 CarbonylContact O-C 3.37Å; I181-Y184 VanDerWaalsContact O-C 3.23Å; I181-Y184 PolarHBondContact O-N 3.39Å; I181-A185 PolarHBondContact O-N 3.34Å; I181-Q194 HydrophobicContact CG2-CG 4.44Å; I181-C254 HydrophobicContact CB-CB 4.36Å; I181-C254 HydrophobicContact CG2-CB 4.19Å; I181-F261 HydrophobicContact CD1-CD2 4.14Å; I181-F261 HydrophobicContact CD1-CE2 4.01Å; I181-F278 HydrophobicContact CG1-CE1 4.39Å
182	N	95.5	Very high	96.7	Very high	39 Å²	39	17 Å²	17	21%	0.209	9%	0.094	C	C	.	.	H	α-helix	trans	-68.5	-40.6	179	-165.7	14.8	0	0	0	112.5	N179 A180 Y184 A185 D251 C254	N179-N182 WeakPolarHBondContact O-CB 3.49Å; N179-N182 PolarHBondContact O-N 2.98Å; N179-N182 VanDerWaalsContact O-N 3.1Å; A180-N182 VanDerWaalsContact C-N 3.33Å; N182-Y184 PolarHBondContact O-N 3.13Å; N182-A185 WeakPolarHBondContact O-CB 3.45Å; N182-A185 PolarHBondContact O-N 2.96Å; N182-D251 VanDerWaalsContact CG-OD1 3.26Å; N182-D251 PolarHBondContact ND2-OD1 3.46Å; N182-D251 PolarHBondContact OD1-OD1 2.91Å; N182-D251 VanDerWaalsContact OD1-OD1 3.11Å; N182-C254 HydrophobicContact CB-CB 3.81Å
183	I	95.1	Very high	96.8	Very high	40 Å²	40	11.1 Å²	11.1	21%	0.205	7%	0.066	C	C	.	.	H	α-helix	trans	-64.6	-25.3	176	-64.6	170.5	0	0	0	110.9	N179 A180 N284 F285 L292	N179-I183 HydrophobicContact CB-CD1 4.27Å; N179-I183 WeakPolarHBondContact O-CG1 3.28Å; N179-I183 PolarHBondContact O-N 3.38Å; A180-I183 PolarHBondContact O-N 3.4Å; I183-N284 PolarHBondContact O-ND2 3.42Å; I183-N284 VanDerWaalsContact O-ND2 3.09Å; I183-F285 HydrophobicContact CD1-CD2 4.28Å; I183-L292 HydrophobicContact CD1-CD1 4.45Å
184	Y	96.9	Very high	96.9	Very high	1 Å²	1	10.9 Å²	10.9	0%	0.004	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	33.7	175.9	-165.3	-152.1	0	0	0	113.3	A180 I181 N182 L190 Q194 P280 Q281 N284 L362 I363 L382	A180-Y184 PolarHBondContact O-N 3.03Å; A180-Y184 VanDerWaalsContact O-N 3.16Å; I181-Y184 CarbonylContact O-C 3.37Å; I181-Y184 VanDerWaalsContact O-C 3.23Å; I181-Y184 PolarHBondContact O-N 3.39Å; N182-Y184 PolarHBondContact O-N 3.13Å; Y184-L190 WeakPolarHBondContact O-CD2 3.34Å; Y184-Q194 PolarHBondContact O-NE2 2.9Å; Y184-Q194 VanDerWaalsContact O-NE2 3.07Å; Y184-P280 HydrophobicContact CE1-CB 3.85Å; Y184-Q281 HydrophobicContact CD1-CG 4.2Å; Y184-N284 WeakPolarHBondContact CA-ND2 3.15Å; Y184-N284 WeakPolarHBondContact CB-ND2 3.15Å; Y184-N284 HydrophobicContact CD2-CB 4.07Å; Y184-N284 HydrophobicContact CG-CB 4.01Å; Y184-L362 HydrophobicContact CD2-CB 4.15Å; Y184-L362 HydrophobicContact CE1-CD1 4.3Å; Y184-L362 HydrophobicContact CE2-CB 3.42Å; Y184-L362 VanDerWaalsContact CE2-CB 3.42Å; Y184-L362 HydrophobicContact CE2-CD1 4.22Å; Y184-L362 HydrophobicContact CE2-CG 4.42Å; Y184-I363 HydrophobicContact CD2-CG1 4.05Å; Y184-I363 HydrophobicContact CE2-CG1 3.85Å; Y184-L382 HydrophobicContact CE2-CD1 4.5Å; Y184-L382 WeakPolarHBondContact OH-CD2 3.28Å
185	A	95.3	Very high	97	Very high	25 Å²	25	10.9 Å²	10.9	21%	0.207	7%	0.065	C	C	.	.			trans	-104.6	171.3	177.7	0	0	0	0	0	112.3	I181 N182 E191 I363	I181-A185 PolarHBondContact O-N 3.34Å; N182-A185 WeakPolarHBondContact O-CB 3.45Å; N182-A185 PolarHBondContact O-N 2.96Å; A185-E191 HydrophobicContact CB-CG 3.49Å; A185-E191 VanDerWaalsContact CB-CG 3.49Å; A185-E191 WeakPolarHBondContact CB-OE1 3.31Å; A185-I363 VanDerWaalsContact O-CD1 3.28Å; A185-I363 WeakPolarHBondContact O-CD1 2.99Å
186	G	93	Very high	97.1	Very high	17 Å²	17	10.6 Å²	10.6	18%	0.175	6%	0.062	C	C	.	.			trans	132.4	6.1	168.6	0	0	0	0	0	117.2	E191 L303	G186-E191 PolarHBondContact N-OE1 3.4Å; G186-L303 WeakPolarHBondContact O-CD2 3.35Å
187	I	96.8	Very high	97.2	Very high	3 Å²	3	10 Å²	10	2%	0.015	6%	0.062	C	C	.	.	S	Bend	trans	-138.8	150.7	169.6	65.3	-177.9	0	0	0	110.3	G189 L190 P304 L313 E375 L378 A379 L382	I187-G189 PolarHBondContact O-N 3.4Å; I187-L190 HydrophobicContact CD1-CB 4.33Å; I187-L190 HydrophobicContact CD1-CD2 4.18Å; I187-L190 HydrophobicContact CG1-CB 3.56Å; I187-L190 HydrophobicContact CG1-CD2 3.82Å; I187-L190 HydrophobicContact CG1-CG 4.29Å; I187-L190 WeakPolarHBondContact O-CB 3.48Å; I187-L190 PolarHBondContact O-N 3.41Å; I187-P304 HydrophobicContact CG2-CG 4.04Å; I187-L313 HydrophobicContact CG2-CD1 3.99Å; I187-E375 WeakPolarHBondContact CA-OE1 3.49Å; I187-E375 HydrophobicContact CB-CG 3.99Å; I187-E375 HydrophobicContact CG2-CG 4.33Å; I187-L378 HydrophobicContact CD1-CB 4.02Å; I187-L378 HydrophobicContact CD1-CD2 3.85Å; I187-L378 HydrophobicContact CD1-CG 3.64Å; I187-L378 HydrophobicContact CG2-CD2 4.26Å; I187-A379 HydrophobicContact CD1-CB 3.94Å; I187-A379 HydrophobicContact CG1-CB 4.36Å; I187-L382 HydrophobicContact CD1-CD1 3.9Å
188	N	97.5	Very high	97.3	Very high	7 Å²	7	10 Å²	10	4%	0.037	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	120	-173.5	-68	-45.5	0	0	0	112.8	D43 K46 A245 F248 E375	D43-N188 PolarHBondContact OD1-ND2 3.11Å; K46-N188 PolarHBondContact NZ-ND2 3.11Å; N188-A245 HydrophobicContact CB-CB 4.03Å; N188-A245 WeakPolarHBondContact OD1-CB 3.45Å; N188-F248 VanDerWaalsContact OD1-CE1 3.29Å; N188-F248 WeakPolarHBondContact OD1-CE1 3.35Å; N188-E375 WeakPolarHBondContact CB-OE1 3.37Å; N188-E375 PolarHBondContact N-OE1 3.45Å; N188-E375 VanDerWaalsContact ND2-CD 3.25Å; N188-E375 PolarHBondContact ND2-OE1 2.95Å; N188-E375 PolarHBondContact ND2-OE2 2.79Å
189	G	98.2	Very high	97.4	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	-8.5	178.6	0	0	0	0	0	115	I187 G193 N241	I187-G189 PolarHBondContact O-N 3.4Å; G189-G193 WeakPolarHBondContact O-CA 3.11Å; G189-G193 PolarHBondContact O-N 3.31Å; G189-N241 VanDerWaalsContact CA-OD1 3.23Å; G189-N241 WeakPolarHBondContact CA-OD1 3.25Å; G189-N241 PolarHBondContact N-O 2.71Å; G189-N241 PolarHBondContact N-OD1 3.39Å
190	L	98.6	Very high	97.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-71.9	-44.4	-175.2	176.5	61	0	0	0	112.5	Y184 I187 V192 G193 Q194 I363 L382 I383	Y184-L190 WeakPolarHBondContact O-CD2 3.34Å; I187-L190 HydrophobicContact CD1-CB 4.33Å; I187-L190 HydrophobicContact CD1-CD2 4.18Å; I187-L190 HydrophobicContact CG1-CB 3.56Å; I187-L190 HydrophobicContact CG1-CD2 3.82Å; I187-L190 HydrophobicContact CG1-CG 4.29Å; I187-L190 WeakPolarHBondContact O-CB 3.48Å; I187-L190 PolarHBondContact O-N 3.41Å; L190-V192 PolarHBondContact O-N 3.48Å; L190-G193 PolarHBondContact O-N 2.89Å; L190-Q194 WeakPolarHBondContact O-CB 3.47Å; L190-Q194 WeakPolarHBondContact O-CG 3.46Å; L190-Q194 PolarHBondContact O-N 2.85Å; L190-Q194 PolarHBondContact O-NE2 3.41Å; L190-I363 HydrophobicContact CD2-CD1 3.76Å; L190-I363 HydrophobicContact CD2-CG1 4.16Å; L190-L382 HydrophobicContact CD1-CB 3.67Å; L190-L382 HydrophobicContact CD1-CD1 4.22Å; L190-L382 HydrophobicContact CD2-CD1 3.75Å; L190-I383 HydrophobicContact CD1-CG1 4.36Å
191	E	98.5	Very high	97.7	Very high	22 Å²	22	14 Å²	14	10%	0.103	8%	0.083	C	C	.	.	H	α-helix	trans	-60.5	-48.2	-177.8	-59.5	83.3	176.7	0	0	110.6	A185 G186 Q194 S195 V249 F253	A185-E191 HydrophobicContact CB-CG 3.49Å; A185-E191 VanDerWaalsContact CB-CG 3.49Å; A185-E191 WeakPolarHBondContact CB-OE1 3.31Å; G186-E191 PolarHBondContact N-OE1 3.4Å; E191-Q194 WeakPolarHBondContact O-CG 3.03Å; E191-S195 WeakPolarHBondContact O-CB 3.16Å; E191-S195 PolarHBondContact O-N 2.81Å; E191-S195 PolarHBondContact O-OG 3.34Å; E191-V249 HydrophobicContact CB-CG2 3.98Å; E191-V249 HydrophobicContact CG-CG2 4.18Å; E191-F253 HydrophobicContact CB-CD1 4.33Å; E191-F253 HydrophobicContact CB-CE1 4.46Å
192	V	98.8	Very high	97.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-74.3	-41.4	178.8	-167.6	0	0	0	0	111.3	L190 S195 L196 S234 L237 L238 V249 F253	L190-V192 PolarHBondContact O-N 3.48Å; V192-S195 PolarHBondContact O-N 2.89Å; V192-L196 HydrophobicContact CG1-CD1 3.9Å; V192-L196 HydrophobicContact CG1-CG 4.29Å; V192-L196 WeakPolarHBondContact O-CB 3.39Å; V192-L196 WeakPolarHBondContact O-CG 3.09Å; V192-L196 PolarHBondContact O-N 3.47Å; V192-S234 WeakPolarHBondContact CG1-O 3.33Å; V192-L237 HydrophobicContact CG1-CB 4.49Å; V192-L237 HydrophobicContact CG2-CD2 3.91Å; V192-L237 HydrophobicContact CG2-CG 4.03Å; V192-L238 HydrophobicContact CB-CB 4.26Å; V192-L238 HydrophobicContact CB-CD1 3.7Å; V192-L238 HydrophobicContact CG1-CB 3.7Å; V192-L238 HydrophobicContact CG1-CD1 3.99Å; V192-L238 HydrophobicContact CG1-CG 4.45Å; V192-V249 HydrophobicContact CG2-CG1 3.48Å; V192-V249 VanDerWaalsContact CG2-CG1 3.48Å; V192-F253 HydrophobicContact CB-CE1 4.15Å; V192-F253 HydrophobicContact CB-CZ 4.05Å; V192-F253 HydrophobicContact CG1-CE1 4.45Å; V192-F253 HydrophobicContact CG1-CE2 4.4Å; V192-F253 HydrophobicContact CG1-CZ 3.85Å; V192-F253 HydrophobicContact CG2-CD1 4.24Å; V192-F253 HydrophobicContact CG2-CE1 3.84Å; V192-F253 HydrophobicContact CG2-CE2 4.41Å; V192-F253 HydrophobicContact CG2-CZ 3.92Å
193	G	98.8	Very high	97.9	Very high	4 Å²	4	13.5 Å²	13.5	4%	0.041	8%	0.08	C	C	.	.	H	α-helix	trans	-62.5	-48	-177.6	0	0	0	0	0	112.6	G189 L190 S195 L196 V197	G189-G193 WeakPolarHBondContact O-CA 3.11Å; G189-G193 PolarHBondContact O-N 3.31Å; L190-G193 PolarHBondContact O-N 2.89Å; G193-S195 VanDerWaalsContact C-N 3.3Å; G193-S195 PolarHBondContact O-N 3.16Å; G193-L196 PolarHBondContact O-N 3.44Å; G193-V197 WeakPolarHBondContact O-CG2 3.29Å; G193-V197 PolarHBondContact O-N 3.43Å; G193-V197 VanDerWaalsContact O-N 3.16Å
194	Q	98.6	Very high	98.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.5	-41	176.9	75.2	-173.1	-83.8	0	0	111.3	I181 Y184 L190 E191 V197 I198 Q386	I181-Q194 HydrophobicContact CG2-CG 4.44Å; Y184-Q194 PolarHBondContact O-NE2 2.9Å; Y184-Q194 VanDerWaalsContact O-NE2 3.07Å; L190-Q194 WeakPolarHBondContact O-CB 3.47Å; L190-Q194 WeakPolarHBondContact O-CG 3.46Å; L190-Q194 PolarHBondContact O-N 2.85Å; L190-Q194 PolarHBondContact O-NE2 3.41Å; E191-Q194 WeakPolarHBondContact O-CG 3.03Å; Q194-V197 PolarHBondContact O-N 3.31Å; Q194-I198 WeakPolarHBondContact O-CG1 3.19Å; Q194-I198 PolarHBondContact O-N 3.12Å; Q194-Q386 HydrophobicContact CB-CG 4.41Å
195	S	98.9	Very high	98.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-71.2	-35.7	-177	-52.2	0	0	0	0	112	E191 V192 G193 I198 A199 Y230 F261	E191-S195 WeakPolarHBondContact O-CB 3.16Å; E191-S195 PolarHBondContact O-N 2.81Å; E191-S195 PolarHBondContact O-OG 3.34Å; V192-S195 PolarHBondContact O-N 2.89Å; G193-S195 VanDerWaalsContact C-N 3.3Å; G193-S195 PolarHBondContact O-N 3.16Å; S195-I198 PolarHBondContact O-N 3.05Å; S195-A199 WeakPolarHBondContact O-CB 3.46Å; S195-A199 PolarHBondContact O-N 3.09Å; S195-Y230 WeakPolarHBondContact CB-OH 3.37Å; S195-F261 VanDerWaalsContact O-CZ 3.27Å; S195-F261 WeakPolarHBondContact O-CZ 3.15Å
196	L	98.9	Very high	98.2	Very high	13 Å²	13	12.3 Å²	12.3	7%	0.068	8%	0.076	C	C	.	.	H	α-helix	trans	-63.8	-41.2	172.2	-83.6	169.7	0	0	0	112.2	V192 G193 I198 A199 L200 V231 L238	V192-L196 HydrophobicContact CG1-CD1 3.9Å; V192-L196 HydrophobicContact CG1-CG 4.29Å; V192-L196 WeakPolarHBondContact O-CB 3.39Å; V192-L196 WeakPolarHBondContact O-CG 3.09Å; V192-L196 PolarHBondContact O-N 3.47Å; G193-L196 PolarHBondContact O-N 3.44Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 PolarHBondContact O-N 3.2Å; L196-A199 PolarHBondContact O-N 3.41Å; L196-L200 WeakPolarHBondContact O-CB 3.46Å; L196-L200 VanDerWaalsContact O-CG 3.27Å; L196-L200 WeakPolarHBondContact O-CG 3.27Å; L196-L200 PolarHBondContact O-N 3.31Å; L196-V231 HydrophobicContact CD2-CB 4.4Å; L196-V231 HydrophobicContact CD2-CG1 4.24Å; L196-V231 HydrophobicContact CD2-CG2 4.38Å; L196-L238 HydrophobicContact CD1-CB 3.93Å; L196-L238 HydrophobicContact CD1-CD2 3.75Å; L196-L238 HydrophobicContact CD1-CG 4.3Å
197	V	98.9	Very high	98.4	Very high	22 Å²	22	15.4 Å²	15.4	13%	0.133	9%	0.088	C	C	.	.	H	α-helix	trans	-63.6	-42.1	175.7	177.1	0	0	0	0	110.6	G193 Q194 L200 S201 I383 Q386 V387	G193-V197 WeakPolarHBondContact O-CG2 3.29Å; G193-V197 PolarHBondContact O-N 3.43Å; G193-V197 VanDerWaalsContact O-N 3.16Å; Q194-V197 PolarHBondContact O-N 3.31Å; V197-L200 PolarHBondContact O-N 3.25Å; V197-S201 WeakPolarHBondContact O-CB 3.33Å; V197-S201 PolarHBondContact O-N 2.94Å; V197-S201 PolarHBondContact O-OG 2.91Å; V197-I383 HydrophobicContact CG2-CG2 3.97Å; V197-Q386 HydrophobicContact CB-CB 4.44Å; V197-Q386 HydrophobicContact CB-CG 3.67Å; V197-Q386 HydrophobicContact CG1-CB 4.31Å; V197-Q386 HydrophobicContact CG1-CG 3.62Å; V197-Q386 HydrophobicContact CG2-CG 4.44Å; V197-V387 HydrophobicContact CB-CG2 4.48Å; V197-V387 HydrophobicContact CG1-CB 4.41Å; V197-V387 HydrophobicContact CG1-CG2 3.77Å; V197-V387 HydrophobicContact CG2-CG2 3.77Å
198	I	98.9	Very high	98.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.6	-49.4	173.9	-67.8	167.3	0	0	0	110.5	Q194 S195 L196 L200 S201 I202 F261 F277 F278 Q386	Q194-I198 WeakPolarHBondContact O-CG1 3.19Å; Q194-I198 PolarHBondContact O-N 3.12Å; S195-I198 PolarHBondContact O-N 3.05Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 PolarHBondContact O-N 3.2Å; I198-L200 PolarHBondContact O-N 3.36Å; I198-S201 WeakPolarHBondContact O-CB 3.47Å; I198-S201 PolarHBondContact O-N 3.15Å; I198-S201 VanDerWaalsContact O-N 3.13Å; I198-I202 HydrophobicContact CG2-CD1 3.87Å; I198-I202 HydrophobicContact CG2-CG1 4.46Å; I198-I202 WeakPolarHBondContact O-CG1 3.43Å; I198-I202 PolarHBondContact O-N 3.47Å; I198-F261 HydrophobicContact CB-CE2 4.17Å; I198-F261 HydrophobicContact CB-CZ 4.22Å; I198-F261 HydrophobicContact CG2-CD1 4.21Å; I198-F261 HydrophobicContact CG2-CD2 3.94Å; I198-F261 HydrophobicContact CG2-CE1 4.17Å; I198-F261 HydrophobicContact CG2-CE2 3.86Å; I198-F261 HydrophobicContact CG2-CG 4.13Å; I198-F261 HydrophobicContact CG2-CZ 4Å; I198-F277 HydrophobicContact CG2-CB 4.43Å; I198-F278 HydrophobicContact CD1-CD2 4.17Å; I198-F278 HydrophobicContact CD1-CE2 4.09Å; I198-F278 HydrophobicContact CD1-CZ 4.39Å; I198-F278 HydrophobicContact CG2-CD2 4.28Å; I198-F278 HydrophobicContact CG2-CE2 3.88Å; I198-Q386 HydrophobicContact CG1-CG 4.45Å
199	A	98.9	Very high	98.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.2	-43.7	-179.7	0	0	0	0	0	113	S195 L196 S201 I202 I203 Y230 V231 F261	S195-A199 WeakPolarHBondContact O-CB 3.46Å; S195-A199 PolarHBondContact O-N 3.09Å; L196-A199 PolarHBondContact O-N 3.41Å; A199-S201 VanDerWaalsContact C-N 3.29Å; A199-S201 PolarHBondContact O-N 3.39Å; A199-I202 PolarHBondContact O-N 2.99Å; A199-I203 WeakPolarHBondContact O-CG1 3.33Å; A199-I203 PolarHBondContact O-N 3.35Å; A199-Y230 HydrophobicContact CB-CD1 3.54Å; A199-Y230 HydrophobicContact CB-CE1 3.61Å; A199-V231 HydrophobicContact CB-CG2 3.73Å; A199-F261 HydrophobicContact CB-CE1 3.83Å; A199-F261 HydrophobicContact CB-CZ 4.08Å
200	L	98.9	Very high	97.9	Very high	93 Å²	93	19.2 Å²	19.2	49%	0.487	11%	0.107	S	C	.	.	H	α-helix	trans	-63.7	-36.6	175	-71.4	169.8	0	0	0	111.6	L196 V197 I198 I203 A204 V231	L196-L200 WeakPolarHBondContact O-CB 3.46Å; L196-L200 VanDerWaalsContact O-CG 3.27Å; L196-L200 WeakPolarHBondContact O-CG 3.27Å; L196-L200 PolarHBondContact O-N 3.31Å; V197-L200 PolarHBondContact O-N 3.25Å; I198-L200 PolarHBondContact O-N 3.36Å; L200-I203 PolarHBondContact O-N 2.68Å; L200-A204 WeakPolarHBondContact O-CB 3.41Å; L200-A204 PolarHBondContact O-N 2.85Å; L200-V231 HydrophobicContact CD2-CG1 4.11Å; L200-V231 HydrophobicContact CD2-CG2 4.23Å; L200-V231 HydrophobicContact CG-CG2 4.44Å
201	S	98.9	Very high	97.6	Very high	9 Å²	9	26 Å²	26	6%	0.063	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-41.9	174	-52.3	0	0	0	0	111.3	V197 I198 A199 A204 F205 S390 F394	V197-S201 WeakPolarHBondContact O-CB 3.33Å; V197-S201 PolarHBondContact O-N 2.94Å; V197-S201 PolarHBondContact O-OG 2.91Å; I198-S201 WeakPolarHBondContact O-CB 3.47Å; I198-S201 PolarHBondContact O-N 3.15Å; I198-S201 VanDerWaalsContact O-N 3.13Å; A199-S201 VanDerWaalsContact C-N 3.29Å; A199-S201 PolarHBondContact O-N 3.39Å; S201-A204 PolarHBondContact O-N 2.98Å; S201-F205 VanDerWaalsContact O-CB 3.31Å; S201-F205 WeakPolarHBondContact O-CB 3.38Å; S201-F205 PolarHBondContact O-N 2.65Å; S201-S390 WeakPolarHBondContact OG-CB 3.47Å; S201-S390 PolarHBondContact OG-OG 3.27Å; S201-F394 VanDerWaalsContact O-CZ 3.28Å; S201-F394 WeakPolarHBondContact O-CZ 3.44Å
202	I	98.8	Very high	97.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-45	174.7	-65.4	165.6	0	0	0	110.7	I198 A199 F205 N206 S223 T227 F261 V264 F270 L274 F277	I198-I202 HydrophobicContact CG2-CD1 3.87Å; I198-I202 HydrophobicContact CG2-CG1 4.46Å; I198-I202 WeakPolarHBondContact O-CG1 3.43Å; I198-I202 PolarHBondContact O-N 3.47Å; A199-I202 PolarHBondContact O-N 2.99Å; I202-F205 PolarHBondContact O-N 2.91Å; I202-N206 VanDerWaalsContact CG2-ND2 3.29Å; I202-N206 WeakPolarHBondContact CG2-ND2 3.46Å; I202-N206 PolarHBondContact O-N 3.41Å; I202-N206 PolarHBondContact O-ND2 2.8Å; I202-S223 WeakPolarHBondContact CG2-OG 3.44Å; I202-T227 HydrophobicContact CB-CG2 4.36Å; I202-T227 HydrophobicContact CG2-CG2 3.77Å; I202-F261 HydrophobicContact CD1-CD1 3.55Å; I202-F261 HydrophobicContact CD1-CE1 4.1Å; I202-F261 HydrophobicContact CD1-CG 4.23Å; I202-V264 HydrophobicContact CD1-CG2 4.26Å; I202-V264 HydrophobicContact CG2-CG2 4.29Å; I202-F270 HydrophobicContact CG2-CE2 4Å; I202-F270 HydrophobicContact CG2-CZ 3.85Å; I202-L274 HydrophobicContact CD1-CD1 3.71Å; I202-L274 HydrophobicContact CG1-CD1 4.28Å; I202-F277 HydrophobicContact CG1-CD2 3.95Å; I202-F277 HydrophobicContact CG1-CE2 4.25Å
203	I	98.8	Very high	96.5	Very high	28 Å²	28	31.5 Å²	31.5	14%	0.144	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-50.7	176.5	-71.8	172.3	0	0	0	110.8	A199 L200 F205 N206 I207 L224 T227 V228 V231	A199-I203 WeakPolarHBondContact O-CG1 3.33Å; A199-I203 PolarHBondContact O-N 3.35Å; L200-I203 PolarHBondContact O-N 2.68Å; I203-F205 VanDerWaalsContact C-N 3.31Å; I203-F205 PolarHBondContact O-N 2.93Å; I203-N206 PolarHBondContact O-N 2.79Å; I203-I207 HydrophobicContact CG2-CD1 3.79Å; I203-I207 HydrophobicContact CG2-CG1 4.48Å; I203-I207 WeakPolarHBondContact O-CG1 3.27Å; I203-I207 PolarHBondContact O-N 3.39Å; I203-L224 HydrophobicContact CB-CD2 4.17Å; I203-L224 HydrophobicContact CG1-CD2 4.05Å; I203-L224 HydrophobicContact CG2-CD2 3.95Å; I203-T227 VanDerWaalsContact CG1-OG1 3.3Å; I203-T227 WeakPolarHBondContact CG1-OG1 3.23Å; I203-V228 HydrophobicContact CD1-CG2 4.18Å; I203-V231 HydrophobicContact CD1-CB 4.43Å; I203-V231 HydrophobicContact CD1-CG2 3.67Å
204	A	98.5	Very high	95.4	Very high	39 Å²	39	36.1 Å²	36.1	32%	0.322	19%	0.185	S	C	.	.	H	α-helix	trans	-60.2	-41.7	179	0	0	0	0	0	111.8	L200 S201 I207 I208 F394	L200-A204 WeakPolarHBondContact O-CB 3.41Å; L200-A204 PolarHBondContact O-N 2.85Å; S201-A204 PolarHBondContact O-N 2.98Å; A204-I207 PolarHBondContact O-N 3.12Å; A204-I208 WeakPolarHBondContact O-CD1 3.42Å; A204-I208 VanDerWaalsContact O-CG1 3.24Å; A204-I208 WeakPolarHBondContact O-CG1 3.4Å; A204-I208 PolarHBondContact O-N 2.75Å; A204-F394 HydrophobicContact CB-CZ 3.89Å
205	F	97.7	Very high	94.7	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-48.9	174.5	173.6	-103.1	0	0	0	112.4	S201 I202 I203 I207 I208 Q209 H220 F270 T273 F277 F394 R397 F398	S201-F205 VanDerWaalsContact O-CB 3.31Å; S201-F205 WeakPolarHBondContact O-CB 3.38Å; S201-F205 PolarHBondContact O-N 2.65Å; I202-F205 PolarHBondContact O-N 2.91Å; I203-F205 VanDerWaalsContact C-N 3.31Å; I203-F205 PolarHBondContact O-N 2.93Å; F205-I207 PolarHBondContact O-N 3.39Å; F205-I208 PolarHBondContact O-N 3.32Å; F205-Q209 HydrophobicContact CD1-CG 4.5Å; F205-Q209 HydrophobicContact CD2-CG 4.16Å; F205-Q209 HydrophobicContact CE1-CG 4.04Å; F205-Q209 HydrophobicContact CE2-CG 3.66Å; F205-Q209 HydrophobicContact CZ-CG 3.6Å; F205-Q209 WeakPolarHBondContact O-CG 3.09Å; F205-Q209 PolarHBondContact O-N 3.09Å; F205-H220 AromaticContact CE1-CE1 3.85Å; F205-F270 HydrophobicContact CD1-CB 4.5Å; F205-F270 HydrophobicContact CD1-CD1 4.41Å; F205-F270 HydrophobicContact CD1-CD2 4.24Å; F205-F270 HydrophobicContact CD1-CG 4.15Å; F205-F270 HydrophobicContact CE1-CB 3.5Å; F205-F270 VanDerWaalsContact CE1-CB 3.5Å; F205-F270 AromaticContact CE1-CD1 3.84Å; F205-F270 HydrophobicContact CE1-CD1 3.84Å; F205-F270 HydrophobicContact CE1-CD2 4.02Å; F205-F270 AromaticContact CE1-CG 3.52Å; F205-F270 HydrophobicContact CE1-CG 3.52Å; F205-F270 HydrophobicContact CZ-CB 3.91Å; F205-F270 HydrophobicContact CZ-CG 4.41Å; F205-T273 HydrophobicContact CD2-CG2 3.88Å; F205-T273 HydrophobicContact CE2-CG2 3.82Å; F205-T273 HydrophobicContact CG-CG2 4.26Å; F205-T273 HydrophobicContact CZ-CG2 4.15Å; F205-F277 HydrophobicContact CB-CE2 4.07Å; F205-F277 HydrophobicContact CB-CZ 3.97Å; F205-F277 HydrophobicContact CG-CE2 4.42Å; F205-F277 HydrophobicContact CG-CZ 4.45Å; F205-F394 HydrophobicContact CB-CE1 3.8Å; F205-F394 HydrophobicContact CB-CZ 4.18Å; F205-F394 HydrophobicContact CD2-CE1 4.41Å; F205-R397 HydrophobicContact CE2-CG 4.1Å; F205-F398 HydrophobicContact CD2-CE1 4.48Å; F205-F398 HydrophobicContact CD2-CE2 4.45Å; F205-F398 AromaticContact CD2-CZ 3.78Å; F205-F398 HydrophobicContact CD2-CZ 3.78Å; F205-F398 HydrophobicContact CE2-CE1 4.25Å; F205-F398 HydrophobicContact CE2-CZ 4.01Å
206	N	97.5	Very high	94.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-41.2	179.4	-73.6	-56.1	0	0	0	112	I202 I203 Q209 I210 H220 S223 L224	I202-N206 VanDerWaalsContact CG2-ND2 3.29Å; I202-N206 WeakPolarHBondContact CG2-ND2 3.46Å; I202-N206 PolarHBondContact O-N 3.41Å; I202-N206 PolarHBondContact O-ND2 2.8Å; I203-N206 PolarHBondContact O-N 2.79Å; N206-Q209 PolarHBondContact O-N 3.27Å; N206-I210 WeakPolarHBondContact O-CB 3.43Å; N206-I210 WeakPolarHBondContact O-CG1 3.24Å; N206-I210 PolarHBondContact O-N 2.77Å; N206-H220 HydrophobicContact CB-CB 4.07Å; N206-H220 WeakPolarHBondContact OD1-CA 3.31Å; N206-H220 PolarHBondContact OD1-ND1 3.49Å; N206-S223 VanDerWaalsContact ND2-CB 3.29Å; N206-S223 WeakPolarHBondContact ND2-CB 3.47Å; N206-S223 PolarHBondContact ND2-OG 3.3Å; N206-L224 HydrophobicContact CB-CD1 4.32Å; N206-L224 HydrophobicContact CB-CD2 3.88Å; N206-L224 HydrophobicContact CB-CG 3.83Å
207	I	96.3	Very high	93.9	Very high	83 Å²	83	42.5 Å²	42.5	43%	0.426	23%	0.226	S	C	.	.	H	α-helix	trans	-61.1	-47.6	175.8	-68.7	169.5	0	0	0	110.4	I203 A204 F205 Q209 I210 L211 L224	I203-I207 HydrophobicContact CG2-CD1 3.79Å; I203-I207 HydrophobicContact CG2-CG1 4.48Å; I203-I207 WeakPolarHBondContact O-CG1 3.27Å; I203-I207 PolarHBondContact O-N 3.39Å; A204-I207 PolarHBondContact O-N 3.12Å; F205-I207 PolarHBondContact O-N 3.39Å; I207-Q209 VanDerWaalsContact C-N 3.29Å; I207-Q209 PolarHBondContact O-N 2.95Å; I207-I210 PolarHBondContact O-N 2.91Å; I207-L211 HydrophobicContact CG2-CD1 4.18Å; I207-L211 VanDerWaalsContact O-CG 3.31Å; I207-L211 WeakPolarHBondContact O-CG 3.38Å; I207-L211 PolarHBondContact O-N 3.25Å; I207-L211 VanDerWaalsContact O-N 3.13Å; I207-L224 HydrophobicContact CG1-CD1 4.47Å
208	I	95.2	Very high	93.6	Very high	61 Å²	61	42.9 Å²	42.9	31%	0.313	23%	0.229	S	C	.	.	H	α-helix	trans	-59.3	-42.9	178	-68.3	164.3	0	0	0	110.7	A204 F205 L211 R212 F394 F398	A204-I208 WeakPolarHBondContact O-CD1 3.42Å; A204-I208 VanDerWaalsContact O-CG1 3.24Å; A204-I208 WeakPolarHBondContact O-CG1 3.4Å; A204-I208 PolarHBondContact O-N 2.75Å; F205-I208 PolarHBondContact O-N 3.32Å; I208-L211 PolarHBondContact O-N 3.4Å; I208-R212 WeakPolarHBondContact O-CB 3.44Å; I208-R212 VanDerWaalsContact O-CG 3.3Å; I208-R212 WeakPolarHBondContact O-CG 3.46Å; I208-R212 PolarHBondContact O-N 3.4Å; I208-F394 HydrophobicContact CD1-CE1 4.26Å; I208-F398 HydrophobicContact CB-CE2 4.41Å; I208-F398 HydrophobicContact CB-CZ 4.13Å; I208-F398 HydrophobicContact CD1-CE2 3.88Å; I208-F398 HydrophobicContact CD1-CZ 4.43Å; I208-F398 HydrophobicContact CG2-CE1 4.14Å; I208-F398 HydrophobicContact CG2-CE2 3.84Å; I208-F398 HydrophobicContact CG2-CZ 3.48Å; I208-F398 VanDerWaalsContact CG2-CZ 3.48Å
209	Q	94.2	Very high	93.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-72.7	-36.6	-179.4	-67.8	-66.4	30.3	0	0	113.5	F205 N206 I207 L211 R212 L213 H220	F205-Q209 HydrophobicContact CD1-CG 4.5Å; F205-Q209 HydrophobicContact CD2-CG 4.16Å; F205-Q209 HydrophobicContact CE1-CG 4.04Å; F205-Q209 HydrophobicContact CE2-CG 3.66Å; F205-Q209 HydrophobicContact CZ-CG 3.6Å; F205-Q209 WeakPolarHBondContact O-CG 3.09Å; F205-Q209 PolarHBondContact O-N 3.09Å; N206-Q209 PolarHBondContact O-N 3.27Å; I207-Q209 VanDerWaalsContact C-N 3.29Å; I207-Q209 PolarHBondContact O-N 2.95Å; Q209-L211 PolarHBondContact O-N 3.42Å; Q209-R212 PolarHBondContact O-N 3.48Å; Q209-L213 PolarHBondContact O-N 3.22Å; Q209-L213 VanDerWaalsContact OE1-CD1 3.25Å; Q209-H220 VanDerWaalsContact CB-CD2 3.49Å; Q209-H220 WeakPolarHBondContact CB-CD2 3.23Å; Q209-H220 VanDerWaalsContact CB-NE2 3.25Å; Q209-H220 WeakPolarHBondContact CB-NE2 3.28Å
210	I	93.4	Very high	93.3	Very high	28 Å²	28	45.7 Å²	45.7	14%	0.144	24%	0.242	C	C	.	.	H	α-helix	trans	-57.3	-39.5	171.8	-73.5	169	0	0	0	110.8	V4 N206 I207 R212 L217 H220 L221 L224	V4-I210 HydrophobicContact CG2-CG2 3.91Å; N206-I210 WeakPolarHBondContact O-CB 3.43Å; N206-I210 WeakPolarHBondContact O-CG1 3.24Å; N206-I210 PolarHBondContact O-N 2.77Å; I207-I210 PolarHBondContact O-N 2.91Å; I210-R212 VanDerWaalsContact C-N 3.31Å; I210-R212 PolarHBondContact O-N 2.91Å; I210-L217 HydrophobicContact CB-CD1 4.42Å; I210-L217 HydrophobicContact CG1-CD1 4.07Å; I210-L217 HydrophobicContact CG2-CD1 3.73Å; I210-H220 HydrophobicContact CD1-CB 3.86Å; I210-H220 HydrophobicContact CG1-CB 3.5Å; I210-L221 HydrophobicContact CD1-CD2 4.11Å; I210-L221 HydrophobicContact CD1-CG 4.28Å; I210-L224 HydrophobicContact CD1-CD1 3.56Å
211	L	92.2	Very high	93.2	Very high	142 Å²	142	41.8 Å²	41.8	74%	0.743	22%	0.221	S	C	*	.	H	α-helix	trans	-73.8	-20.4	178	-65.2	173.5	0	0	0	113.5	I207 I208 Q209	I207-L211 HydrophobicContact CG2-CD1 4.18Å; I207-L211 VanDerWaalsContact O-CG 3.31Å; I207-L211 WeakPolarHBondContact O-CG 3.38Å; I207-L211 PolarHBondContact O-N 3.25Å; I207-L211 VanDerWaalsContact O-N 3.13Å; I208-L211 PolarHBondContact O-N 3.4Å; Q209-L211 PolarHBondContact O-N 3.42Å
212	R	89.8	Confident	93.1	Very high	113 Å²	113	42 Å²	42	43%	0.426	22%	0.221	S	C	.	.	H	α-helix	trans	-103.2	-34.9	-175.3	-74.6	-179.2	60	-166.9	-15.5	114.3	I208 Q209 I210 E409	I208-R212 WeakPolarHBondContact O-CB 3.44Å; I208-R212 VanDerWaalsContact O-CG 3.3Å; I208-R212 WeakPolarHBondContact O-CG 3.46Å; I208-R212 PolarHBondContact O-N 3.4Å; Q209-R212 PolarHBondContact O-N 3.48Å; I210-R212 VanDerWaalsContact C-N 3.31Å; I210-R212 PolarHBondContact O-N 2.91Å; R212-E409 PolarHBondContact NH2-OXT 3.36Å
213	L	83.7	Confident	93.1	Very high	26 Å²	26	42 Å²	42	14%	0.136	22%	0.221	C	C	.	.			trans	-130.7	84.8	-164.5	-59	178.4	0	0	0	110.9	Q209 S215 Q216 E409	Q209-L213 PolarHBondContact O-N 3.22Å; Q209-L213 VanDerWaalsContact OE1-CD1 3.25Å; L213-S215 PolarHBondContact O-N 3.38Å; L213-Q216 HydrophobicContact CB-CB 4.37Å; L213-Q216 PolarHBondContact O-N 3.18Å; L213-Q216 VanDerWaalsContact O-N 3.12Å; L213-E409 HydrophobicContact CD1-CB 3.93Å; L213-E409 HydrophobicContact CD2-CB 4.32Å
214	E	77.4	Confident	93.1	Very high	100 Å²	100	41.2 Å²	41.2	47%	0.467	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-55.9	-36.2	178.9	-171.4	-179.9	162.1	0	0	112	M1 E2 Q216 L217	M1-E214 WeakPolarHBondContact CA-OE1 3.27Å; M1-E214 PolarHBondContact N-OE1 2.97Å; E2-E214 PolarHBondContact N-OE1 3.38Å; E214-Q216 PolarHBondContact O-N 2.95Å; E214-Q216 VanDerWaalsContact O-N 3.14Å; E214-L217 WeakPolarHBondContact O-CB 3.39Å; E214-L217 PolarHBondContact O-N 3.27Å
215	S	83.9	Confident	93.1	Very high	100 Å²	100	40.2 Å²	40.2	70%	0.699	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-64.5	-18.1	-178.7	62.2	0	0	0	0	114.7	L213	L213-S215 PolarHBondContact O-N 3.38Å
216	Q	86.8	Confident	93.1	Very high	40 Å²	40	40.2 Å²	40.2	19%	0.187	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-112	11	-177.4	-64.1	-178.9	5.9	0	0	112.6	L213 E214 S218 F219 H220 E409	L213-Q216 HydrophobicContact CB-CB 4.37Å; L213-Q216 PolarHBondContact O-N 3.18Å; L213-Q216 VanDerWaalsContact O-N 3.12Å; E214-Q216 PolarHBondContact O-N 2.95Å; E214-Q216 VanDerWaalsContact O-N 3.14Å; Q216-S218 VanDerWaalsContact C-N 3.27Å; Q216-S218 PolarHBondContact O-N 3.42Å; Q216-F219 HydrophobicContact CB-CD2 4.3Å; Q216-F219 HydrophobicContact CG-CD2 4.44Å; Q216-F219 PolarHBondContact O-N 2.92Å; Q216-H220 PolarHBondContact O-CD2 3.06Å; Q216-H220 VanDerWaalsContact O-CD2 3.25Å; Q216-H220 PolarHBondContact O-N 3.12Å; Q216-E409 PolarHBondContact NE2-OE2 3.02Å
217	L	92.9	Very high	93.2	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-48.6	-47.4	-177.7	175.5	65.1	0	0	0	112.4	E2 V4 I210 E214 F219 H220 L221	E2-L217 HydrophobicContact CB-CD2 4.02Å; E2-L217 WeakPolarHBondContact O-CD2 3.47Å; V4-L217 HydrophobicContact CG2-CD1 4.05Å; I210-L217 HydrophobicContact CB-CD1 4.42Å; I210-L217 HydrophobicContact CG1-CD1 4.07Å; I210-L217 HydrophobicContact CG2-CD1 3.73Å; E214-L217 WeakPolarHBondContact O-CB 3.39Å; E214-L217 PolarHBondContact O-N 3.27Å; L217-F219 PolarHBondContact O-N 3.43Å; L217-H220 PolarHBondContact O-N 3.41Å; L217-L221 HydrophobicContact CD1-CD1 3.74Å; L217-L221 HydrophobicContact CD1-CG 3.95Å; L217-L221 HydrophobicContact CD2-CD1 4.31Å; L217-L221 HydrophobicContact CG-CD1 3.67Å; L217-L221 HydrophobicContact CG-CG 4.28Å; L217-L221 WeakPolarHBondContact O-CB 3.25Å; L217-L221 VanDerWaalsContact O-CG 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.05Å
218	S	92.9	Very high	93.3	Very high	30 Å²	30	37 Å²	37	21%	0.21	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-39.5	-176	61.2	0	0	0	0	113.8	Q216 F222	Q216-S218 VanDerWaalsContact C-N 3.27Å; Q216-S218 PolarHBondContact O-N 3.42Å; S218-F222 WeakPolarHBondContact O-CB 3.4Å; S218-F222 PolarHBondContact O-N 3.45Å
219	F	94.9	Very high	93.5	Very high	56 Å²	56	34.1 Å²	34.1	25%	0.246	17%	0.174	C	C	.	.	H	α-helix	trans	-67.1	-41.3	178.2	-61.5	-48.7	0	0	0	112.3	Q216 L217 F222 S223 H269	Q216-F219 HydrophobicContact CB-CD2 4.3Å; Q216-F219 HydrophobicContact CG-CD2 4.44Å; Q216-F219 PolarHBondContact O-N 2.92Å; L217-F219 PolarHBondContact O-N 3.43Å; F219-F222 WeakPolarHBondContact O-CB 3.31Å; F219-F222 PolarHBondContact O-N 3.32Å; F219-S223 PolarHBondContact O-N 3.11Å; F219-S223 VanDerWaalsContact O-N 3.07Å; F219-H269 AromaticContact CD1-CD2 3.6Å; F219-H269 AromaticContact CE1-CD2 3.51Å; F219-H269 AromaticContact CE1-NE2 3.66Å; F219-H269 AromaticContact CG-CD2 3.95Å; F219-H269 AromaticContact CZ-CD2 3.77Å; F219-H269 AromaticContact CZ-NE2 3.87Å
220	H	96.3	Very high	93.7	Very high	3 Å²	3	34.1 Å²	34.1	1%	0.014	17%	0.174	C	C	.	.	H	α-helix	trans	-74.2	-35.3	179.4	-65.7	-52.4	0	0	0	112.2	F205 N206 Q209 I210 Q216 L217 S223 L224	F205-H220 AromaticContact CE1-CE1 3.85Å; N206-H220 HydrophobicContact CB-CB 4.07Å; N206-H220 WeakPolarHBondContact OD1-CA 3.31Å; N206-H220 PolarHBondContact OD1-ND1 3.49Å; Q209-H220 VanDerWaalsContact CB-CD2 3.49Å; Q209-H220 WeakPolarHBondContact CB-CD2 3.23Å; Q209-H220 VanDerWaalsContact CB-NE2 3.25Å; Q209-H220 WeakPolarHBondContact CB-NE2 3.28Å; I210-H220 HydrophobicContact CD1-CB 3.86Å; I210-H220 HydrophobicContact CG1-CB 3.5Å; Q216-H220 PolarHBondContact O-CD2 3.06Å; Q216-H220 VanDerWaalsContact O-CD2 3.25Å; Q216-H220 PolarHBondContact O-N 3.12Å; L217-H220 PolarHBondContact O-N 3.41Å; H220-S223 PolarHBondContact O-N 3.26Å; H220-L224 WeakPolarHBondContact O-CG 3.39Å; H220-L224 PolarHBondContact O-N 2.93Å
221	L	96.6	Very high	94	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.052	17%	0.173	C	C	.	.	H	α-helix	trans	-63.8	-44.9	170.1	-74.5	172.2	0	0	0	112.1	V4 P5 L9 I210 L217 S223 L224 Y225	V4-L221 HydrophobicContact CG1-CD2 4.25Å; P5-L221 VanDerWaalsContact CD-CD1 3.4Å; P5-L221 HydrophobicContact CG-CD1 3.64Å; L9-L221 HydrophobicContact CD1-CD2 3.91Å; L9-L221 HydrophobicContact CD2-CD2 4.2Å; L9-L221 HydrophobicContact CG-CD2 4.26Å; I210-L221 HydrophobicContact CD1-CD2 4.11Å; I210-L221 HydrophobicContact CD1-CG 4.28Å; L217-L221 HydrophobicContact CD1-CD1 3.74Å; L217-L221 HydrophobicContact CD1-CG 3.95Å; L217-L221 HydrophobicContact CD2-CD1 4.31Å; L217-L221 HydrophobicContact CG-CD1 3.67Å; L217-L221 HydrophobicContact CG-CG 4.28Å; L217-L221 WeakPolarHBondContact O-CB 3.25Å; L217-L221 VanDerWaalsContact O-CG 3.28Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.05Å; L221-S223 VanDerWaalsContact C-N 3.29Å; L221-S223 PolarHBondContact O-N 3.4Å; L221-L224 PolarHBondContact O-N 3.31Å; L221-L224 VanDerWaalsContact O-N 3.1Å; L221-Y225 HydrophobicContact CB-CE2 4.29Å; L221-Y225 WeakPolarHBondContact O-CD2 3.26Å; L221-Y225 PolarHBondContact O-N 2.89Å
222	F	97.4	Very high	94.3	Very high	15 Å²	15	29.9 Å²	29.9	7%	0.066	15%	0.15	C	C	.	.	H	α-helix	trans	-51.6	-51.2	173	167.2	-90.1	0	0	0	110.4	E94 S218 F219 L224 Y225 F226 V263 L267	E94-F222 HydrophobicContact CB-CE2 4.29Å; S218-F222 WeakPolarHBondContact O-CB 3.4Å; S218-F222 PolarHBondContact O-N 3.45Å; F219-F222 WeakPolarHBondContact O-CB 3.31Å; F219-F222 PolarHBondContact O-N 3.32Å; F222-L224 VanDerWaalsContact C-N 3.34Å; F222-L224 PolarHBondContact O-N 2.9Å; F222-Y225 WeakPolarHBondContact O-CB 3.37Å; F222-Y225 PolarHBondContact O-N 2.77Å; F222-F226 HydrophobicContact CD2-CE2 4.02Å; F222-F226 HydrophobicContact CE1-CD2 4.42Å; F222-F226 HydrophobicContact CE1-CE2 4.39Å; F222-F226 HydrophobicContact CE2-CD2 4.15Å; F222-F226 AromaticContact CE2-CE2 3.43Å; F222-F226 HydrophobicContact CE2-CE2 3.43Å; F222-F226 VanDerWaalsContact CE2-CE2 3.43Å; F222-F226 HydrophobicContact CE2-CZ 4.14Å; F222-F226 HydrophobicContact CZ-CD2 4.08Å; F222-F226 AromaticContact CZ-CE2 3.62Å; F222-F226 HydrophobicContact CZ-CE2 3.62Å; F222-F226 HydrophobicContact CZ-CZ 4.18Å; F222-F226 WeakPolarHBondContact O-CD2 3.25Å; F222-V263 HydrophobicContact CE1-CG1 4.33Å; F222-V263 HydrophobicContact CZ-CG1 4.01Å; F222-L267 HydrophobicContact CD1-CB 4.24Å; F222-L267 HydrophobicContact CE1-CB 3.58Å; F222-L267 HydrophobicContact CE1-CD1 4.29Å; F222-L267 HydrophobicContact CE2-CD1 4.4Å; F222-L267 HydrophobicContact CZ-CB 3.87Å; F222-L267 HydrophobicContact CZ-CD1 3.72Å; F222-L267 HydrophobicContact CZ-CG 4.42Å
223	S	98.4	Very high	94.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.8	-43.4	177.8	179	0	0	0	0	112.5	I202 N206 F219 H220 L221 Y225 F226 T227 V264 F270	I202-S223 WeakPolarHBondContact CG2-OG 3.44Å; N206-S223 VanDerWaalsContact ND2-CB 3.29Å; N206-S223 WeakPolarHBondContact ND2-CB 3.47Å; N206-S223 PolarHBondContact ND2-OG 3.3Å; F219-S223 PolarHBondContact O-N 3.11Å; F219-S223 VanDerWaalsContact O-N 3.07Å; H220-S223 PolarHBondContact O-N 3.26Å; L221-S223 VanDerWaalsContact C-N 3.29Å; L221-S223 PolarHBondContact O-N 3.4Å; S223-Y225 VanDerWaalsContact C-N 3.32Å; S223-Y225 PolarHBondContact O-N 3.4Å; S223-F226 PolarHBondContact O-N 2.92Å; S223-T227 WeakPolarHBondContact O-CG2 3.5Å; S223-T227 PolarHBondContact O-N 3.09Å; S223-T227 PolarHBondContact O-OG1 3.09Å; S223-V264 WeakPolarHBondContact OG-CB 3.44Å; S223-F270 WeakPolarHBondContact OG-CZ 3.36Å
224	L	98.4	Very high	95.4	Very high	11 Å²	11	23.2 Å²	23.2	6%	0.058	12%	0.124	C	C	.	.	H	α-helix	trans	-61.6	-39.5	180	-73.9	176.8	0	0	0	112.3	L9 I203 N206 I207 I210 H220 L221 F222 F226 T227 V228	L9-L224 HydrophobicContact CD2-CB 4.43Å; I203-L224 HydrophobicContact CB-CD2 4.17Å; I203-L224 HydrophobicContact CG1-CD2 4.05Å; I203-L224 HydrophobicContact CG2-CD2 3.95Å; N206-L224 HydrophobicContact CB-CD1 4.32Å; N206-L224 HydrophobicContact CB-CD2 3.88Å; N206-L224 HydrophobicContact CB-CG 3.83Å; I207-L224 HydrophobicContact CG1-CD1 4.47Å; I210-L224 HydrophobicContact CD1-CD1 3.56Å; H220-L224 WeakPolarHBondContact O-CG 3.39Å; H220-L224 PolarHBondContact O-N 2.93Å; L221-L224 PolarHBondContact O-N 3.31Å; L221-L224 VanDerWaalsContact O-N 3.1Å; F222-L224 VanDerWaalsContact C-N 3.34Å; F222-L224 PolarHBondContact O-N 2.9Å; L224-F226 PolarHBondContact O-N 3.48Å; L224-T227 WeakPolarHBondContact CA-OG1 3.13Å; L224-T227 PolarHBondContact O-N 3.49Å; L224-V228 WeakPolarHBondContact O-CB 3.43Å; L224-V228 WeakPolarHBondContact O-CG2 3.24Å; L224-V228 PolarHBondContact O-N 3.21Å
225	Y	98.5	Very high	96.4	Very high	18 Å²	18	21.9 Å²	21.9	7%	0.071	12%	0.122	C	C	.	.	H	α-helix	trans	-57.6	-31.3	177.8	-63.2	-27.6	0	0	0	113.3	P8 L9 N12 F71 P75 L221 F222 S223 P229	P8-Y225 HydrophobicContact CB-CE1 4.06Å; L9-Y225 HydrophobicContact CD2-CD1 4.07Å; L9-Y225 HydrophobicContact CD2-CE1 3.73Å; L9-Y225 HydrophobicContact CG-CE1 4.24Å; N12-Y225 PolarHBondContact ND2-O 3.5Å; N12-Y225 VanDerWaalsContact ND2-O 3.09Å; F71-Y225 AromaticContact CE1-CD1 3.64Å; F71-Y225 HydrophobicContact CE1-CD1 3.64Å; F71-Y225 AromaticContact CE1-CD2 3.93Å; F71-Y225 HydrophobicContact CE1-CD2 3.93Å; F71-Y225 HydrophobicContact CE1-CE1 4.27Å; F71-Y225 AromaticContact CE1-CG 3.46Å; F71-Y225 HydrophobicContact CE1-CG 3.46Å; F71-Y225 VanDerWaalsContact CE1-CG 3.46Å; F71-Y225 AromaticContact CZ-CD1 3.53Å; F71-Y225 HydrophobicContact CZ-CD1 3.53Å; F71-Y225 HydrophobicContact CZ-CD2 4.42Å; F71-Y225 AromaticContact CZ-CE1 3.83Å; F71-Y225 HydrophobicContact CZ-CE1 3.83Å; F71-Y225 AromaticContact CZ-CG 3.87Å; F71-Y225 HydrophobicContact CZ-CG 3.87Å; P75-Y225 HydrophobicContact CB-CD2 4.42Å; P75-Y225 HydrophobicContact CB-CE2 3.8Å; P75-Y225 HydrophobicContact CG-CD2 3.9Å; P75-Y225 HydrophobicContact CG-CE2 3.69Å; L221-Y225 HydrophobicContact CB-CE2 4.29Å; L221-Y225 WeakPolarHBondContact O-CD2 3.26Å; L221-Y225 PolarHBondContact O-N 2.89Å; F222-Y225 WeakPolarHBondContact O-CB 3.37Å; F222-Y225 PolarHBondContact O-N 2.77Å; S223-Y225 VanDerWaalsContact C-N 3.32Å; S223-Y225 PolarHBondContact O-N 3.4Å; Y225-P229 WeakPolarHBondContact O-CD 3.41Å; Y225-P229 WeakPolarHBondContact O-CG 3.3Å
226	F	98.8	Very high	97.1	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-88.7	-40.2	176.3	-77.8	-101.1	0	0	0	112.9	Y64 L68 F95 V99 I102 F222 S223 L224 V264	Y64-F226 VanDerWaalsContact CE2-O 3.29Å; Y64-F226 WeakPolarHBondContact CE2-O 3.36Å; Y64-F226 WeakPolarHBondContact OH-CD1 3.42Å; Y64-F226 PolarHBondContact OH-O 3.43Å; L68-F226 HydrophobicContact CD1-CD1 3.77Å; L68-F226 HydrophobicContact CD1-CE1 3.67Å; F95-F226 AromaticContact CD2-CE2 3.59Å; F95-F226 HydrophobicContact CD2-CE2 3.59Å; F95-F226 HydrophobicContact CD2-CZ 4.06Å; F95-F226 HydrophobicContact CE2-CD2 4.29Å; F95-F226 AromaticContact CE2-CE2 3.57Å; F95-F226 HydrophobicContact CE2-CE2 3.57Å; F95-F226 HydrophobicContact CE2-CZ 4.04Å; F95-F226 HydrophobicContact CG-CE2 4.27Å; F95-F226 HydrophobicContact CG-CZ 4.33Å; F95-F226 HydrophobicContact CZ-CE2 4.22Å; F95-F226 HydrophobicContact CZ-CZ 4.28Å; V99-F226 HydrophobicContact CG2-CE1 4.11Å; V99-F226 HydrophobicContact CG2-CZ 4.07Å; I102-F226 HydrophobicContact CD1-CD1 3.58Å; I102-F226 HydrophobicContact CD1-CE1 3.73Å; F222-F226 HydrophobicContact CD2-CE2 4.02Å; F222-F226 HydrophobicContact CE1-CD2 4.42Å; F222-F226 HydrophobicContact CE1-CE2 4.39Å; F222-F226 HydrophobicContact CE2-CD2 4.15Å; F222-F226 AromaticContact CE2-CE2 3.43Å; F222-F226 HydrophobicContact CE2-CE2 3.43Å; F222-F226 VanDerWaalsContact CE2-CE2 3.43Å; F222-F226 HydrophobicContact CE2-CZ 4.14Å; F222-F226 HydrophobicContact CZ-CD2 4.08Å; F222-F226 AromaticContact CZ-CE2 3.62Å; F222-F226 HydrophobicContact CZ-CE2 3.62Å; F222-F226 HydrophobicContact CZ-CZ 4.18Å; F222-F226 WeakPolarHBondContact O-CD2 3.25Å; S223-F226 PolarHBondContact O-N 2.92Å; L224-F226 PolarHBondContact O-N 3.48Å; F226-V264 HydrophobicContact CB-CG1 3.54Å; F226-V264 HydrophobicContact CG-CG1 4.12Å
227	T	98.9	Very high	97.7	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-79.9	-31.9	-171.5	52.2	0	0	0	0	113.7	I202 I203 S223 L224 Y230 V231 L260 V264	I202-T227 HydrophobicContact CB-CG2 4.36Å; I202-T227 HydrophobicContact CG2-CG2 3.77Å; I203-T227 VanDerWaalsContact CG1-OG1 3.3Å; I203-T227 WeakPolarHBondContact CG1-OG1 3.23Å; S223-T227 WeakPolarHBondContact O-CG2 3.5Å; S223-T227 PolarHBondContact O-N 3.09Å; S223-T227 PolarHBondContact O-OG1 3.09Å; L224-T227 WeakPolarHBondContact CA-OG1 3.13Å; L224-T227 PolarHBondContact O-N 3.49Å; T227-Y230 WeakPolarHBondContact O-CB 3.25Å; T227-Y230 PolarHBondContact O-N 2.83Å; T227-V231 PolarHBondContact O-N 3.23Å; T227-L260 HydrophobicContact CG2-CD2 4.1Å; T227-V264 HydrophobicContact CG2-CG1 4.27Å; T227-V264 HydrophobicContact CG2-CG2 4.15Å
228	V	98.7	Very high	98	Very high	17 Å²	17	17.3 Å²	17.3	10%	0.103	9%	0.092	C	C	.	.	H	α-helix	trans	-61	-55.5	177.7	169.4	0	0	0	0	111.6	N12 M13 I203 L224 Y230 V231 F232	N12-V228 WeakPolarHBondContact OD1-CB 3.28Å; N12-V228 WeakPolarHBondContact OD1-CG1 3.48Å; M13-V228 HydrophobicContact SD-CG1 3.48Å; M13-V228 WeakPolarHBondContact SD-CG1 3.42Å; I203-V228 HydrophobicContact CD1-CG2 4.18Å; L224-V228 WeakPolarHBondContact O-CB 3.43Å; L224-V228 WeakPolarHBondContact O-CG2 3.24Å; L224-V228 PolarHBondContact O-N 3.21Å; V228-Y230 PolarHBondContact O-N 2.95Å; V228-V231 PolarHBondContact O-N 3.16Å; V228-V231 VanDerWaalsContact O-N 3.12Å; V228-F232 HydrophobicContact CG1-CD2 4.35Å; V228-F232 HydrophobicContact CG1-CE2 4.22Å; V228-F232 WeakPolarHBondContact O-CD2 3.02Å; V228-F232 PolarHBondContact O-N 2.88Å
229	P	98.8	Very high	98.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-30.1	178.5	19.4	-29.1	0	0	0	112.6	N12 S16 Y64 I67 L68 Y225 F232 T233	N12-P229 WeakPolarHBondContact OD1-CD 3.37Å; S16-P229 VanDerWaalsContact OG-CA 3.24Å; S16-P229 WeakPolarHBondContact OG-CA 3.49Å; S16-P229 WeakPolarHBondContact OG-CB 3.46Å; Y64-P229 HydrophobicContact CD2-CB 4Å; Y64-P229 HydrophobicContact CD2-CG 4.34Å; Y64-P229 HydrophobicContact CE2-CB 3.96Å; Y64-P229 HydrophobicContact CE2-CG 3.79Å; I67-P229 HydrophobicContact CB-CB 4.41Å; I67-P229 HydrophobicContact CD1-CB 4.26Å; I67-P229 HydrophobicContact CG2-CB 3.69Å; I67-P229 HydrophobicContact CG2-CG 4.36Å; L68-P229 HydrophobicContact CD2-CG 4.02Å; Y225-P229 WeakPolarHBondContact O-CD 3.41Å; Y225-P229 WeakPolarHBondContact O-CG 3.3Å; P229-F232 PolarHBondContact O-N 3.22Å; P229-T233 PolarHBondContact O-N 3.47Å; P229-T233 VanDerWaalsContact O-N 3.09Å; P229-T233 PolarHBondContact O-OG1 2.89Å
230	Y	98.9	Very high	98.4	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64	-43.5	176	173.8	-92.2	0	0	0	112.3	S195 A199 T227 V228 F232 T233 S234 F253 F256 S257 L260 F261	S195-Y230 WeakPolarHBondContact CB-OH 3.37Å; A199-Y230 HydrophobicContact CB-CD1 3.54Å; A199-Y230 HydrophobicContact CB-CE1 3.61Å; T227-Y230 WeakPolarHBondContact O-CB 3.25Å; T227-Y230 PolarHBondContact O-N 2.83Å; V228-Y230 PolarHBondContact O-N 2.95Å; Y230-F232 VanDerWaalsContact C-N 3.32Å; Y230-F232 PolarHBondContact O-N 3.1Å; Y230-T233 PolarHBondContact O-OG1 2.81Å; Y230-S234 VanDerWaalsContact CE2-OG 3.32Å; Y230-S234 WeakPolarHBondContact CE2-OG 3.28Å; Y230-S234 VanDerWaalsContact CZ-OG 3.32Å; Y230-S234 WeakPolarHBondContact O-CB 3.42Å; Y230-S234 PolarHBondContact O-N 3.09Å; Y230-S234 PolarHBondContact O-OG 3.23Å; Y230-F253 HydrophobicContact CE2-CE2 4.45Å; Y230-F253 WeakPolarHBondContact OH-CZ 3.37Å; Y230-F256 AromaticContact CD2-CE1 3.8Å; Y230-F256 HydrophobicContact CD2-CE1 3.8Å; Y230-F256 HydrophobicContact CD2-CE2 4.32Å; Y230-F256 AromaticContact CD2-CZ 3.58Å; Y230-F256 HydrophobicContact CD2-CZ 3.58Å; Y230-F256 HydrophobicContact CE2-CD1 4.35Å; Y230-F256 AromaticContact CE2-CE1 3.82Å; Y230-F256 HydrophobicContact CE2-CE1 3.82Å; Y230-F256 HydrophobicContact CE2-CZ 4.01Å; Y230-S257 WeakPolarHBondContact CE2-OG 3.38Å; Y230-S257 VanDerWaalsContact OH-CB 3.23Å; Y230-S257 WeakPolarHBondContact OH-CB 3.05Å; Y230-S257 PolarHBondContact OH-OG 3.42Å; Y230-L260 HydrophobicContact CD2-CD1 3.5Å; Y230-L260 HydrophobicContact CE2-CD1 4.37Å; Y230-L260 HydrophobicContact CG-CD1 3.72Å; Y230-L260 HydrophobicContact CG-CD2 4.48Å; Y230-F261 HydrophobicContact CD1-CE1 4.31Å; Y230-F261 HydrophobicContact CD1-CZ 4.43Å; Y230-F261 AromaticContact CE1-CE1 3.97Å; Y230-F261 HydrophobicContact CE1-CE1 3.97Å; Y230-F261 AromaticContact CE1-CZ 3.65Å; Y230-F261 HydrophobicContact CE1-CZ 3.65Å; Y230-F261 AromaticContact CZ-CZ 3.79Å
231	V	98.9	Very high	98.5	Very high	19 Å²	19	20.9 Å²	20.9	12%	0.115	10%	0.099	C	C	.	.	H	α-helix	trans	-62	-43.3	177.6	167.2	0	0	0	0	110.6	L196 A199 L200 I203 T227 V228 T235	L196-V231 HydrophobicContact CD2-CB 4.4Å; L196-V231 HydrophobicContact CD2-CG1 4.24Å; L196-V231 HydrophobicContact CD2-CG2 4.38Å; A199-V231 HydrophobicContact CB-CG2 3.73Å; L200-V231 HydrophobicContact CD2-CG1 4.11Å; L200-V231 HydrophobicContact CD2-CG2 4.23Å; L200-V231 HydrophobicContact CG-CG2 4.44Å; I203-V231 HydrophobicContact CD1-CB 4.43Å; I203-V231 HydrophobicContact CD1-CG2 3.67Å; T227-V231 PolarHBondContact O-N 3.23Å; V228-V231 PolarHBondContact O-N 3.16Å; V228-V231 VanDerWaalsContact O-N 3.12Å; V231-T235 VanDerWaalsContact O-CB 3.25Å; V231-T235 WeakPolarHBondContact O-CB 3.47Å; V231-T235 PolarHBondContact O-N 3.37Å; V231-T235 PolarHBondContact O-OG1 3.47Å
232	F	98.8	Very high	98.6	Very high	61 Å²	61	23.7 Å²	23.7	27%	0.268	11%	0.109	S	C	.	.	H	α-helix	trans	-62.8	-50.8	179.8	-85.8	-106	0	0	0	112.3	M13 S16 A17 A20 V228 P229 Y230 V236	M13-F232 HydrophobicContact CE-CE2 4.07Å; M13-F232 HydrophobicContact CE-CZ 3.84Å; M13-F232 HydrophobicContact SD-CE2 4.16Å; M13-F232 HydrophobicContact SD-CZ 4.43Å; S16-F232 WeakPolarHBondContact O-CD1 3.39Å; A17-F232 HydrophobicContact CB-CE1 4.05Å; A20-F232 HydrophobicContact CB-CB 4.23Å; A20-F232 HydrophobicContact CB-CD1 4.08Å; V228-F232 HydrophobicContact CG1-CD2 4.35Å; V228-F232 HydrophobicContact CG1-CE2 4.22Å; V228-F232 WeakPolarHBondContact O-CD2 3.02Å; V228-F232 PolarHBondContact O-N 2.88Å; P229-F232 PolarHBondContact O-N 3.22Å; Y230-F232 VanDerWaalsContact C-N 3.32Å; Y230-F232 PolarHBondContact O-N 3.1Å; F232-V236 PolarHBondContact O-N 3.35Å
233	T	98.7	Very high	98.6	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-70	-37.9	-179.3	57.9	0	0	0	0	112.4	I63 I67 P229 Y230 V236 L237	I63-T233 HydrophobicContact CG2-CG2 4.2Å; I67-T233 HydrophobicContact CD1-CG2 3.81Å; P229-T233 PolarHBondContact O-N 3.47Å; P229-T233 VanDerWaalsContact O-N 3.09Å; P229-T233 PolarHBondContact O-OG1 2.89Å; Y230-T233 PolarHBondContact O-OG1 2.81Å; T233-V236 WeakPolarHBondContact O-CB 3.46Å; T233-V236 PolarHBondContact O-N 2.95Å; T233-L237 PolarHBondContact O-N 3.45Å
234	S	98.8	Very high	98.4	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-71.7	-32.5	179	-58.8	0	0	0	0	112.5	V192 Y230 V236 L237 L238	V192-S234 WeakPolarHBondContact CG1-O 3.33Å; Y230-S234 VanDerWaalsContact CE2-OG 3.32Å; Y230-S234 WeakPolarHBondContact CE2-OG 3.28Å; Y230-S234 VanDerWaalsContact CZ-OG 3.32Å; Y230-S234 WeakPolarHBondContact O-CB 3.42Å; Y230-S234 PolarHBondContact O-N 3.09Å; Y230-S234 PolarHBondContact O-OG 3.23Å; S234-V236 VanDerWaalsContact C-N 3.27Å; S234-V236 PolarHBondContact O-N 2.9Å; S234-L237 PolarHBondContact O-N 2.91Å; S234-L238 PolarHBondContact O-N 3.1Å
235	T	98.8	Very high	98.4	Very high	72 Å²	72	28.7 Å²	28.7	44%	0.442	14%	0.139	S	C	.	.	H	α-helix	trans	-62.3	-38.2	173.9	-61	0	0	0	0	111.2	V231 L238 R239	V231-T235 VanDerWaalsContact O-CB 3.25Å; V231-T235 WeakPolarHBondContact O-CB 3.47Å; V231-T235 PolarHBondContact O-N 3.37Å; V231-T235 PolarHBondContact O-OG1 3.47Å; T235-L238 PolarHBondContact O-N 2.96Å; T235-R239 PolarHBondContact O-N 3.46Å; T235-R239 VanDerWaalsContact O-N 3.16Å
236	V	98.7	Very high	98.3	Very high	17 Å²	17	33.4 Å²	33.4	10%	0.103	16%	0.156	C	C	.	.	H	α-helix	trans	-63.2	-48.7	173.1	175.7	0	0	0	0	110.4	A20 A23 N24 F232 T233 S234 L238 R239 W240	A20-V236 HydrophobicContact CB-CG2 3.86Å; A20-V236 WeakPolarHBondContact O-CG2 3.36Å; A23-V236 HydrophobicContact CB-CB 4.2Å; A23-V236 HydrophobicContact CB-CG1 3.93Å; A23-V236 HydrophobicContact CB-CG2 4.36Å; N24-V236 HydrophobicContact CB-CG1 3.87Å; F232-V236 PolarHBondContact O-N 3.35Å; T233-V236 WeakPolarHBondContact O-CB 3.46Å; T233-V236 PolarHBondContact O-N 2.95Å; S234-V236 VanDerWaalsContact C-N 3.27Å; S234-V236 PolarHBondContact O-N 2.9Å; V236-L238 VanDerWaalsContact C-N 3.29Å; V236-L238 PolarHBondContact O-N 3.26Å; V236-R239 WeakPolarHBondContact O-CB 3.47Å; V236-R239 PolarHBondContact O-N 2.87Å; V236-R239 VanDerWaalsContact O-N 3.12Å; V236-W240 VanDerWaalsContact O-CD1 3.23Å; V236-W240 PolarHBondContact O-N 2.74Å
237	L	98.8	Very high	98.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-42.5	177.7	-171.4	60.5	0	0	0	111.7	M56 T60 V192 T233 S234 R239 W240 N241 V247 V249 F253	M56-L237 HydrophobicContact CB-CD1 4.28Å; T60-L237 HydrophobicContact CG2-CB 3.93Å; T60-L237 HydrophobicContact CG2-CD1 4.28Å; V192-L237 HydrophobicContact CG1-CB 4.49Å; V192-L237 HydrophobicContact CG2-CD2 3.91Å; V192-L237 HydrophobicContact CG2-CG 4.03Å; T233-L237 PolarHBondContact O-N 3.45Å; S234-L237 PolarHBondContact O-N 2.91Å; L237-R239 VanDerWaalsContact C-N 3.28Å; L237-R239 PolarHBondContact O-N 3.43Å; L237-W240 PolarHBondContact O-N 2.89Å; L237-N241 WeakPolarHBondContact O-CB 3.34Å; L237-N241 PolarHBondContact O-N 3.26Å; L237-V247 HydrophobicContact CD1-CG2 4.21Å; L237-V249 HydrophobicContact CD1-CG1 4.22Å; L237-V249 HydrophobicContact CD2-CB 4.1Å; L237-V249 HydrophobicContact CD2-CG1 3.61Å; L237-V249 HydrophobicContact CG-CG1 3.85Å; L237-F253 HydrophobicContact CD2-CB 4.46Å; L237-F253 HydrophobicContact CD2-CD2 3.37Å; L237-F253 HydrophobicContact CD2-CE2 3.73Å; L237-F253 HydrophobicContact CD2-CG 3.93Å
238	L	98.7	Very high	98.3	Very high	35 Å²	35	34.9 Å²	34.9	18%	0.183	16%	0.163	C	C	.	.	H	α-helix	trans	-55.3	-45.8	176.6	-172.5	71.8	0	0	0	110.2	V192 L196 S234 T235 V236 W240 N241 W242	V192-L238 HydrophobicContact CB-CB 4.26Å; V192-L238 HydrophobicContact CB-CD1 3.7Å; V192-L238 HydrophobicContact CG1-CB 3.7Å; V192-L238 HydrophobicContact CG1-CD1 3.99Å; V192-L238 HydrophobicContact CG1-CG 4.45Å; L196-L238 HydrophobicContact CD1-CB 3.93Å; L196-L238 HydrophobicContact CD1-CD2 3.75Å; L196-L238 HydrophobicContact CD1-CG 4.3Å; S234-L238 PolarHBondContact O-N 3.1Å; T235-L238 PolarHBondContact O-N 2.96Å; V236-L238 VanDerWaalsContact C-N 3.29Å; V236-L238 PolarHBondContact O-N 3.26Å; L238-W240 PolarHBondContact O-N 2.85Å; L238-W240 VanDerWaalsContact O-N 3.17Å; L238-N241 CarbonylContact O-C 3.55Å; L238-N241 PolarHBondContact O-N 2.66Å; L238-W242 HydrophobicContact CD1-CE3 3.53Å; L238-W242 HydrophobicContact CD1-CZ3 3.83Å; L238-W242 HydrophobicContact CD2-CE3 4.21Å; L238-W242 HydrophobicContact CD2-CZ3 4.3Å; L238-W242 HydrophobicContact CG-CE3 3.84Å; L238-W242 HydrophobicContact CG-CZ3 4.32Å; L238-W242 WeakPolarHBondContact O-CA 3.15Å; L238-W242 WeakPolarHBondContact O-CB 3.37Å; L238-W242 PolarHBondContact O-N 2.77Å
239	R	98.4	Very high	98.3	Very high	140 Å²	140	34.4 Å²	34.4	53%	0.528	16%	0.16	S	C	.	.	H	α-helix	trans	-60.4	-28.3	179.4	-160.7	-171.7	85.1	96.4	-6.7	113.8	N24 T235 V236 L237 R246	N24-R239 PolarHBondContact OD1-NH2 3.01Å; T235-R239 PolarHBondContact O-N 3.46Å; T235-R239 VanDerWaalsContact O-N 3.16Å; V236-R239 WeakPolarHBondContact O-CB 3.47Å; V236-R239 PolarHBondContact O-N 2.87Å; V236-R239 VanDerWaalsContact O-N 3.12Å; L237-R239 VanDerWaalsContact C-N 3.28Å; L237-R239 PolarHBondContact O-N 3.43Å; R239-R246 PolarHBondContact O-NH2 3.16Å
240	W	98.5	Very high	98.2	Very high	22 Å²	22	35 Å²	35	8%	0.083	17%	0.167	C	C	.	.	H	α-helix	trans	-88.7	-32.4	177.6	-71.8	98.6	0	0	0	112.8	N24 V27 K28 V236 L237 L238 R246 V247	N24-W240 PolarHBondContact OD1-NE1 3.18Å; N24-W240 VanDerWaalsContact OD1-NE1 3.17Å; V27-W240 HydrophobicContact CG1-CB 4.05Å; V27-W240 HydrophobicContact CG1-CD2 3.77Å; V27-W240 HydrophobicContact CG1-CE3 4.4Å; V27-W240 HydrophobicContact CG1-CG 3.57Å; K28-W240 HydrophobicContact CB-CH2 3.7Å; K28-W240 HydrophobicContact CB-CZ2 3.83Å; K28-W240 HydrophobicContact CD-CH2 4.35Å; K28-W240 HydrophobicContact CG-CH2 3.89Å; K28-W240 HydrophobicContact CG-CZ2 4.45Å; V236-W240 VanDerWaalsContact O-CD1 3.23Å; V236-W240 PolarHBondContact O-N 2.74Å; L237-W240 PolarHBondContact O-N 2.89Å; L238-W240 PolarHBondContact O-N 2.85Å; L238-W240 VanDerWaalsContact O-N 3.17Å; W240-R246 HydrophobicContact CE3-CB 4.17Å; W240-R246 PolarHBondContact O-N 3.07Å; W240-V247 HydrophobicContact CB-CG2 3.54Å; W240-V247 PolarHBondContact O-N 3.49Å
241	N	98.4	Very high	98.1	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.011	17%	0.174	C	C	.	.	H	α-helix	trans	-91.7	-15.3	-178.9	179	-110.4	0	0	0	113.8	G189 L237 L238 A245 V247 V249	G189-N241 VanDerWaalsContact CA-OD1 3.23Å; G189-N241 WeakPolarHBondContact CA-OD1 3.25Å; G189-N241 PolarHBondContact N-O 2.71Å; G189-N241 PolarHBondContact N-OD1 3.39Å; L237-N241 WeakPolarHBondContact O-CB 3.34Å; L237-N241 PolarHBondContact O-N 3.26Å; L238-N241 CarbonylContact O-C 3.55Å; L238-N241 PolarHBondContact O-N 2.66Å; N241-A245 VanDerWaalsContact O-CB 3.3Å; N241-A245 WeakPolarHBondContact O-CB 3.29Å; N241-V247 HydrophobicContact CB-CG2 4.41Å; N241-V247 PolarHBondContact ND2-O 3.19Å; N241-V249 HydrophobicContact CB-CG1 3.98Å
242	W	98	Very high	98	Very high	68 Å²	68	35.5 Å²	35.5	26%	0.258	17%	0.169	S	C	.	.	S	Bend	trans	-59.6	150.3	178	-163.4	-102.4	0	0	0	111.4	L238 P244 A245 L380 I383	L238-W242 HydrophobicContact CD1-CE3 3.53Å; L238-W242 HydrophobicContact CD1-CZ3 3.83Å; L238-W242 HydrophobicContact CD2-CE3 4.21Å; L238-W242 HydrophobicContact CD2-CZ3 4.3Å; L238-W242 HydrophobicContact CG-CE3 3.84Å; L238-W242 HydrophobicContact CG-CZ3 4.32Å; L238-W242 WeakPolarHBondContact O-CA 3.15Å; L238-W242 WeakPolarHBondContact O-CB 3.37Å; L238-W242 PolarHBondContact O-N 2.77Å; W242-P244 CarbonylContact O-C 3.42Å; W242-A245 WeakPolarHBondContact O-CA 3.34Å; W242-A245 PolarHBondContact O-N 2.89Å; W242-A245 VanDerWaalsContact O-N 3.11Å; W242-L380 HydrophobicContact CH2-CD2 4.03Å; W242-L380 HydrophobicContact CZ2-CD2 3.81Å; W242-L380 HydrophobicContact CZ2-CG 4.25Å; W242-I383 HydrophobicContact CH2-CD1 3.61Å; W242-I383 HydrophobicContact CZ3-CD1 3.51Å
243	Y	96.8	Very high	98	Very high	44 Å²	44	32.6 Å²	32.6	17%	0.173	16%	0.156	C	C	.	.	S	Bend	trans	-58	130.7	179.8	-176.3	-82.8	0	0	0	113.1	K46 H374 E375 K376	K46-Y243 HydrophobicContact CD-CE2 4.14Å; K46-Y243 HydrophobicContact CG-CE2 4.35Å; Y243-H374 AromaticContact CD1-CE1 3.84Å; Y243-H374 AromaticContact CE1-CE1 3.18Å; Y243-H374 WeakPolarHBondContact CE1-CE1 3.11Å; Y243-H374 AromaticContact CE1-NE2 3.5Å; Y243-H374 AromaticContact CE2-CE1 3.89Å; Y243-H374 AromaticContact CZ-CE1 3.22Å; Y243-H374 AromaticContact CZ-NE2 3.19Å; Y243-H374 PolarHBondContact OH-CE1 3.24Å; Y243-H374 PolarHBondContact OH-NE2 3.45Å; Y243-E375 HydrophobicContact CD2-CB 3.83Å; Y243-E375 HydrophobicContact CD2-CG 3.93Å; Y243-E375 WeakPolarHBondContact CD2-OE2 3.32Å; Y243-E375 HydrophobicContact CE2-CB 3.76Å; Y243-E375 HydrophobicContact CE2-CG 4.28Å; Y243-E375 WeakPolarHBondContact CE2-OE2 3.14Å; Y243-K376 HydrophobicContact CD1-CB 3.86Å; Y243-K376 HydrophobicContact CD1-CD 4.37Å; Y243-K376 HydrophobicContact CD1-CG 4.45Å; Y243-K376 HydrophobicContact CE1-CB 4.5Å; Y243-K376 HydrophobicContact CG-CB 3.93Å
244	P	96	Very high	98	Very high	82 Å²	82	32.7 Å²	32.7	53%	0.532	16%	0.156	S	C	.	.	S	Bend	cis	-76.4	128.8	-12.4	31.3	-33.5	0	0	0	111	K46 W242 R246	K46-P244 HydrophobicContact CD-CB 4.33Å; W242-P244 CarbonylContact O-C 3.42Å; P244-R246 PolarHBondContact O-N 3.01Å
245	A	97.2	Very high	97.9	Very high	6 Å²	6	32.7 Å²	32.7	5%	0.05	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-60.6	137.5	-177.4	0	0	0	0	0	112.3	I52 N188 N241 W242 F248	I52-A245 WeakPolarHBondContact CD1-O 3.42Å; N188-A245 HydrophobicContact CB-CB 4.03Å; N188-A245 WeakPolarHBondContact OD1-CB 3.45Å; N241-A245 VanDerWaalsContact O-CB 3.3Å; N241-A245 WeakPolarHBondContact O-CB 3.29Å; W242-A245 WeakPolarHBondContact O-CA 3.34Å; W242-A245 PolarHBondContact O-N 2.89Å; W242-A245 VanDerWaalsContact O-N 3.11Å; A245-F248 HydrophobicContact CB-CD1 4.15Å; A245-F248 HydrophobicContact CB-CE1 3.92Å
246	R	97.4	Very high	97.9	Very high	116 Å²	116	29.2 Å²	29.2	44%	0.438	14%	0.135	S	C	.	.	S	Bend	trans	-102.5	-14.5	169.8	-67	177.4	-70	-168.4	-3.5	112.3	R239 W240 P244	R239-R246 PolarHBondContact O-NH2 3.16Å; W240-R246 HydrophobicContact CE3-CB 4.17Å; W240-R246 PolarHBondContact O-N 3.07Å; P244-R246 PolarHBondContact O-N 3.01Å
247	V	98.3	Very high	97.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-144.9	148.5	175.5	-56.9	0	0	0	0	109.5	V27 I52 M56 L237 W240 N241	V27-V247 HydrophobicContact CG1-CG1 4.22Å; I52-V247 VanDerWaalsContact CG2-C 3.45Å; M56-V247 HydrophobicContact CB-CB 3.8Å; M56-V247 HydrophobicContact CB-CG1 4.3Å; M56-V247 HydrophobicContact CB-CG2 3.93Å; M56-V247 HydrophobicContact CG-CB 3.55Å; M56-V247 HydrophobicContact CG-CG1 3.71Å; M56-V247 HydrophobicContact CG-CG2 4.23Å; L237-V247 HydrophobicContact CD1-CG2 4.21Å; W240-V247 HydrophobicContact CB-CG2 3.54Å; W240-V247 PolarHBondContact O-N 3.49Å; N241-V247 HydrophobicContact CB-CG2 4.41Å; N241-V247 PolarHBondContact ND2-O 3.19Å
248	F	98.2	Very high	97.9	Very high	32 Å²	32	28.4 Å²	28.4	14%	0.14	13%	0.13	C	C	.	.			trans	-100.8	147.2	166.1	-61.3	-33.1	0	0	0	110.4	G41 D43 I52 P53 Q54 M56 N188 A245	G41-F248 WeakPolarHBondContact O-CE2 3.37Å; D43-F248 HydrophobicContact CB-CZ 3.83Å; I52-F248 HydrophobicContact CB-CD1 4.37Å; I52-F248 HydrophobicContact CB-CD2 3.97Å; I52-F248 HydrophobicContact CB-CE1 4.12Å; I52-F248 HydrophobicContact CB-CE2 3.72Å; I52-F248 HydrophobicContact CB-CG 4.29Å; I52-F248 HydrophobicContact CB-CZ 3.79Å; I52-F248 HydrophobicContact CG1-CE1 4.24Å; I52-F248 HydrophobicContact CG1-CE2 4.27Å; I52-F248 HydrophobicContact CG1-CZ 3.89Å; I52-F248 HydrophobicContact CG2-CD1 3.84Å; I52-F248 HydrophobicContact CG2-CD2 4.06Å; I52-F248 HydrophobicContact CG2-CE1 3.96Å; I52-F248 HydrophobicContact CG2-CE2 4.21Å; I52-F248 HydrophobicContact CG2-CG 3.88Å; I52-F248 HydrophobicContact CG2-CZ 4.15Å; P53-F248 PolarHBondContact O-N 2.95Å; Q54-F248 HydrophobicContact CB-CB 3.86Å; M56-F248 PolarHBondContact N-O 3.24Å; N188-F248 VanDerWaalsContact OD1-CE1 3.29Å; N188-F248 WeakPolarHBondContact OD1-CE1 3.35Å; A245-F248 HydrophobicContact CB-CD1 4.15Å; A245-F248 HydrophobicContact CB-CE1 3.92Å
249	V	98.2	Very high	97.9	Very high	6 Å²	6	26.8 Å²	26.8	4%	0.036	12%	0.122	C	C	.	.			trans	-78.1	-33.7	-172.5	-57.2	0	0	0	0	112.8	P55 G57 E191 V192 L237 N241 F253	P55-V249 CarbonylContact C-O 3.41Å; G57-V249 VanDerWaalsContact CA-O 3.3Å; G57-V249 WeakPolarHBondContact CA-O 3.45Å; G57-V249 PolarHBondContact N-O 3.23Å; E191-V249 HydrophobicContact CB-CG2 3.98Å; E191-V249 HydrophobicContact CG-CG2 4.18Å; V192-V249 HydrophobicContact CG2-CG1 3.48Å; V192-V249 VanDerWaalsContact CG2-CG1 3.48Å; L237-V249 HydrophobicContact CD1-CG1 4.22Å; L237-V249 HydrophobicContact CD2-CB 4.1Å; L237-V249 HydrophobicContact CD2-CG1 3.61Å; L237-V249 HydrophobicContact CG-CG1 3.85Å; N241-V249 HydrophobicContact CB-CG1 3.98Å; V249-F253 HydrophobicContact CB-CB 3.69Å; V249-F253 HydrophobicContact CB-CD1 4.27Å; V249-F253 HydrophobicContact CB-CG 4.04Å; V249-F253 HydrophobicContact CG2-CB 4Å; V249-F253 HydrophobicContact CG2-CD1 4.14Å; V249-F253 HydrophobicContact CG2-CG 4.34Å
250	G	96.9	Very high	97.9	Very high	14 Å²	14	20.1 Å²	20.1	14%	0.144	10%	0.097	C	C	.	.	H	α-helix	trans	73.3	169.6	-173.6	0	0	0	0	0	114	D113 T252 F253	D113-G250 VanDerWaalsContact OD1-CA 3.31Å; D113-G250 WeakPolarHBondContact OD1-CA 3.21Å; G250-T252 PolarHBondContact O-N 2.86Å; G250-F253 PolarHBondContact O-N 3.25Å
251	D	96.7	Very high	97.9	Very high	28 Å²	28	19 Å²	19	15%	0.15	9%	0.093	C	C	.	.	H	α-helix	trans	-59.1	-31.2	176	-76.8	-11.2	0	0	0	110.8	D112 D113 K122 N182 F253 C254 Y255	D112-D251 HydrophobicContact CB-CB 4.33Å; D113-D251 VanDerWaalsContact CG-N 3.33Å; D113-D251 PolarHBondContact OD1-N 3.42Å; D113-D251 PolarHBondContact OD2-N 2.89Å; D113-D251 VanDerWaalsContact OD2-N 3.17Å; K122-D251 IonicContact NZ-OD2 3.01Å; K122-D251 PolarHBondContact NZ-OD2 3.04Å; N182-D251 VanDerWaalsContact CG-OD1 3.26Å; N182-D251 PolarHBondContact ND2-OD1 3.46Å; N182-D251 PolarHBondContact OD1-OD1 2.91Å; N182-D251 VanDerWaalsContact OD1-OD1 3.11Å; D251-F253 VanDerWaalsContact C-N 3.26Å; D251-F253 PolarHBondContact O-N 3.26Å; D251-C254 PolarHBondContact O-N 2.99Å; D251-Y255 HydrophobicContact CB-CD2 4.24Å; D251-Y255 HydrophobicContact CB-CE2 4.06Å; D251-Y255 WeakPolarHBondContact O-CD2 3.23Å; D251-Y255 PolarHBondContact O-N 3.41Å
252	T	97.9	Very high	97.9	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-46.5	-48.2	172.8	-54.7	0	0	0	0	112.7	V58 I106 G109 F110 D113 G250 F256	V58-T252 HydrophobicContact CB-CG2 3.9Å; V58-T252 HydrophobicContact CG2-CG2 4.18Å; I106-T252 HydrophobicContact CG2-CG2 4.16Å; G109-T252 PolarHBondContact O-OG1 3.29Å; F110-T252 WeakPolarHBondContact CA-OG1 3.4Å; F110-T252 HydrophobicContact CB-CG2 4.45Å; F110-T252 PolarHBondContact N-OG1 3.47Å; F110-T252 VanDerWaalsContact N-OG1 3.14Å; D113-T252 WeakPolarHBondContact OD2-CB 3.43Å; D113-T252 PolarHBondContact OD2-N 3.32Å; D113-T252 PolarHBondContact OD2-OG1 3.41Å; G250-T252 PolarHBondContact O-N 2.86Å; T252-F256 WeakPolarHBondContact O-CB 3.3Å; T252-F256 PolarHBondContact O-N 3.44Å
253	F	98.7	Very high	97.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-68.4	-40.5	-178.9	178	-97.8	0	0	0	112.4	E191 V192 Y230 L237 V249 G250 D251 F256 S257	E191-F253 HydrophobicContact CB-CD1 4.33Å; E191-F253 HydrophobicContact CB-CE1 4.46Å; V192-F253 HydrophobicContact CB-CE1 4.15Å; V192-F253 HydrophobicContact CB-CZ 4.05Å; V192-F253 HydrophobicContact CG1-CE1 4.45Å; V192-F253 HydrophobicContact CG1-CE2 4.4Å; V192-F253 HydrophobicContact CG1-CZ 3.85Å; V192-F253 HydrophobicContact CG2-CD1 4.24Å; V192-F253 HydrophobicContact CG2-CE1 3.84Å; V192-F253 HydrophobicContact CG2-CE2 4.41Å; V192-F253 HydrophobicContact CG2-CZ 3.92Å; Y230-F253 HydrophobicContact CE2-CE2 4.45Å; Y230-F253 WeakPolarHBondContact OH-CZ 3.37Å; L237-F253 HydrophobicContact CD2-CB 4.46Å; L237-F253 HydrophobicContact CD2-CD2 3.37Å; L237-F253 HydrophobicContact CD2-CE2 3.73Å; L237-F253 HydrophobicContact CD2-CG 3.93Å; V249-F253 HydrophobicContact CB-CB 3.69Å; V249-F253 HydrophobicContact CB-CD1 4.27Å; V249-F253 HydrophobicContact CB-CG 4.04Å; V249-F253 HydrophobicContact CG2-CB 4Å; V249-F253 HydrophobicContact CG2-CD1 4.14Å; V249-F253 HydrophobicContact CG2-CG 4.34Å; G250-F253 PolarHBondContact O-N 3.25Å; D251-F253 VanDerWaalsContact C-N 3.26Å; D251-F253 PolarHBondContact O-N 3.26Å; F253-F256 HydrophobicContact CD2-CD1 4.37Å; F253-S257 WeakPolarHBondContact CE1-OG 3.32Å; F253-S257 VanDerWaalsContact CZ-OG 3.26Å; F253-S257 WeakPolarHBondContact CZ-OG 3.36Å; F253-S257 VanDerWaalsContact O-CB 3.3Å; F253-S257 WeakPolarHBondContact O-CB 3.46Å; F253-S257 PolarHBondContact O-N 3.14Å; F253-S257 PolarHBondContact O-OG 2.92Å
254	C	98.3	Very high	98	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.014	7%	0.072	C	C	.	.	H	α-helix	trans	-65.8	-46.1	-178.2	-62.3	0	0	0	0	111	I181 N182 D251 S257 G258	I181-C254 HydrophobicContact CB-CB 4.36Å; I181-C254 HydrophobicContact CG2-CB 4.19Å; N182-C254 HydrophobicContact CB-CB 3.81Å; D251-C254 PolarHBondContact O-N 2.99Å; C254-S257 PolarHBondContact O-N 2.89Å; C254-G258 PolarHBondContact O-N 3.43Å
255	Y	97.8	Very high	98.1	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-65.2	-44.7	177.6	-81.1	-122.5	0	0	0	111.2	M105 L108 D112 K122 P126 D251 M259	M105-Y255 HydrophobicContact CG-CD1 4.3Å; M105-Y255 HydrophobicContact SD-CD1 4.18Å; L108-Y255 HydrophobicContact CD2-CD1 4.17Å; L108-Y255 HydrophobicContact CD2-CE1 3.91Å; L108-Y255 HydrophobicContact CG-CD1 4.23Å; L108-Y255 HydrophobicContact CG-CE1 4.02Å; D112-Y255 PolarHBondContact OD2-OH 3.15Å; K122-Y255 WeakPolarHBondContact CB-OH 3.25Å; K122-Y255 WeakPolarHBondContact CD-OH 3.47Å; K122-Y255 WeakPolarHBondContact CG-OH 3.37Å; P126-Y255 HydrophobicContact CG-CE1 4.15Å; D251-Y255 HydrophobicContact CB-CD2 4.24Å; D251-Y255 HydrophobicContact CB-CE2 4.06Å; D251-Y255 WeakPolarHBondContact O-CD2 3.23Å; D251-Y255 PolarHBondContact O-N 3.41Å; Y255-M259 WeakPolarHBondContact O-CB 3.32Å; Y255-M259 PolarHBondContact O-N 2.85Å
256	F	98.4	Very high	98.1	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-54.7	-55.8	174.2	165.2	-140	0	0	0	111.6	A61 Y64 I102 I106 Y230 T252 F253 G258 M259 L260	A61-F256 HydrophobicContact CB-CD1 3.77Å; A61-F256 HydrophobicContact CB-CE1 4.07Å; A61-F256 HydrophobicContact CB-CG 4.11Å; Y64-F256 AromaticContact CD1-CE2 3.48Å; Y64-F256 HydrophobicContact CD1-CE2 3.48Å; Y64-F256 VanDerWaalsContact CD1-CE2 3.48Å; Y64-F256 AromaticContact CD1-CZ 3.44Å; Y64-F256 HydrophobicContact CD1-CZ 3.44Å; Y64-F256 VanDerWaalsContact CD1-CZ 3.44Å; Y64-F256 AromaticContact CD2-CZ 3.98Å; Y64-F256 HydrophobicContact CD2-CZ 3.98Å; Y64-F256 AromaticContact CE1-CE2 3.61Å; Y64-F256 HydrophobicContact CE1-CE2 3.61Å; Y64-F256 AromaticContact CE1-CZ 3.89Å; Y64-F256 HydrophobicContact CE1-CZ 3.89Å; Y64-F256 HydrophobicContact CE2-CZ 4.36Å; Y64-F256 HydrophobicContact CG-CE1 4.49Å; Y64-F256 HydrophobicContact CG-CE2 4.05Å; Y64-F256 AromaticContact CG-CZ 3.49Å; Y64-F256 HydrophobicContact CG-CZ 3.49Å; Y64-F256 VanDerWaalsContact CG-CZ 3.49Å; I102-F256 HydrophobicContact CG2-CD2 3.74Å; I102-F256 HydrophobicContact CG2-CE2 3.81Å; I106-F256 HydrophobicContact CD1-CD2 4Å; I106-F256 HydrophobicContact CD1-CE2 4.43Å; I106-F256 HydrophobicContact CD1-CG 4.43Å; I106-F256 HydrophobicContact CG1-CB 3.9Å; I106-F256 HydrophobicContact CG1-CD2 3.96Å; I106-F256 HydrophobicContact CG1-CG 4.05Å; Y230-F256 AromaticContact CD2-CE1 3.8Å; Y230-F256 HydrophobicContact CD2-CE1 3.8Å; Y230-F256 HydrophobicContact CD2-CE2 4.32Å; Y230-F256 AromaticContact CD2-CZ 3.58Å; Y230-F256 HydrophobicContact CD2-CZ 3.58Å; Y230-F256 HydrophobicContact CE2-CD1 4.35Å; Y230-F256 AromaticContact CE2-CE1 3.82Å; Y230-F256 HydrophobicContact CE2-CE1 3.82Å; Y230-F256 HydrophobicContact CE2-CZ 4.01Å; T252-F256 WeakPolarHBondContact O-CB 3.3Å; T252-F256 PolarHBondContact O-N 3.44Å; F253-F256 HydrophobicContact CD2-CD1 4.37Å; F256-G258 PolarHBondContact O-N 3.48Å; F256-M259 PolarHBondContact O-N 2.93Å; F256-L260 HydrophobicContact CE2-CB 4.45Å; F256-L260 HydrophobicContact CE2-CD1 3.94Å; F256-L260 HydrophobicContact CZ-CD1 4.24Å; F256-L260 WeakPolarHBondContact O-CB 3.43Å; F256-L260 PolarHBondContact O-N 2.98Å
257	S	98.8	Very high	98	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-61.5	-46.9	-176.8	-58.9	0	0	0	0	111.1	Y230 F253 C254 M259 L260 F261	Y230-S257 WeakPolarHBondContact CE2-OG 3.38Å; Y230-S257 VanDerWaalsContact OH-CB 3.23Å; Y230-S257 WeakPolarHBondContact OH-CB 3.05Å; Y230-S257 PolarHBondContact OH-OG 3.42Å; F253-S257 WeakPolarHBondContact CE1-OG 3.32Å; F253-S257 VanDerWaalsContact CZ-OG 3.26Å; F253-S257 WeakPolarHBondContact CZ-OG 3.36Å; F253-S257 VanDerWaalsContact O-CB 3.3Å; F253-S257 WeakPolarHBondContact O-CB 3.46Å; F253-S257 PolarHBondContact O-N 3.14Å; F253-S257 PolarHBondContact O-OG 2.92Å; C254-S257 PolarHBondContact O-N 2.89Å; S257-M259 PolarHBondContact O-N 2.87Å; S257-L260 PolarHBondContact O-N 3.24Å; S257-F261 WeakPolarHBondContact O-CD2 3.4Å; S257-F261 WeakPolarHBondContact O-CG 3.26Å; S257-F261 PolarHBondContact O-N 3.47Å
258	G	98.2	Very high	97.9	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-60.6	-44.5	178.6	0	0	0	0	0	113.2	C177 C254 F256 F261 A262	C177-G258 VanDerWaalsContact C-CA 3.47Å; C177-G258 WeakPolarHBondContact CB-O 3.19Å; C177-G258 WeakPolarHBondContact O-CA 3.31Å; C254-G258 PolarHBondContact O-N 3.43Å; F256-G258 PolarHBondContact O-N 3.48Å; G258-F261 PolarHBondContact O-N 3.11Å; G258-A262 PolarHBondContact O-N 2.9Å
259	M	98.1	Very high	97.7	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-66	-43.2	177.4	-178.2	54.9	80.1	0	0	112.2	I102 M105 T130 T178 Y255 F256 S257 F261 A262 V263	I102-M259 HydrophobicContact CG1-CG 4.01Å; M105-M259 HydrophobicContact CB-CB 3.65Å; M105-M259 HydrophobicContact CB-CE 4.19Å; M105-M259 HydrophobicContact CB-CG 3.89Å; M105-M259 HydrophobicContact CE-CE 3.52Å; M105-M259 HydrophobicContact CG-CB 3.71Å; M105-M259 HydrophobicContact CG-CE 3.7Å; M105-M259 HydrophobicContact CG-CG 4.15Å; M105-M259 HydrophobicContact SD-CE 4.06Å; T130-M259 HydrophobicContact CG2-CE 3.62Å; T178-M259 HydrophobicContact CG2-CB 3.94Å; T178-M259 HydrophobicContact CG2-CE 4.14Å; Y255-M259 WeakPolarHBondContact O-CB 3.32Å; Y255-M259 PolarHBondContact O-N 2.85Å; F256-M259 PolarHBondContact O-N 2.93Å; S257-M259 PolarHBondContact O-N 2.87Å; M259-F261 VanDerWaalsContact C-N 3.27Å; M259-F261 PolarHBondContact O-N 3.18Å; M259-A262 PolarHBondContact O-N 3.4Å; M259-V263 HydrophobicContact CG-CG2 4.23Å; M259-V263 WeakPolarHBondContact O-CB 3.33Å; M259-V263 WeakPolarHBondContact O-CG2 3.43Å; M259-V263 PolarHBondContact O-N 3.4Å; M259-V263 HydrophobicContact SD-CG2 3.99Å
260	L	98.7	Very high	97.5	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-56.1	-48	176.5	-179.3	157.2	0	0	0	110.5	Y64 I102 T227 Y230 F256 S257 A262 V263 V264	Y64-L260 HydrophobicContact CE1-CD1 4.07Å; Y64-L260 HydrophobicContact CE2-CD1 3.87Å; Y64-L260 VanDerWaalsContact CZ-CD1 3.43Å; Y64-L260 WeakPolarHBondContact OH-CD1 3.31Å; I102-L260 HydrophobicContact CD1-CB 4.08Å; I102-L260 HydrophobicContact CD1-CG 4.2Å; I102-L260 HydrophobicContact CG1-CB 4.37Å; T227-L260 HydrophobicContact CG2-CD2 4.1Å; Y230-L260 HydrophobicContact CD2-CD1 3.5Å; Y230-L260 HydrophobicContact CE2-CD1 4.37Å; Y230-L260 HydrophobicContact CG-CD1 3.72Å; Y230-L260 HydrophobicContact CG-CD2 4.48Å; F256-L260 HydrophobicContact CE2-CB 4.45Å; F256-L260 HydrophobicContact CE2-CD1 3.94Å; F256-L260 HydrophobicContact CZ-CD1 4.24Å; F256-L260 WeakPolarHBondContact O-CB 3.43Å; F256-L260 PolarHBondContact O-N 2.98Å; S257-L260 PolarHBondContact O-N 3.24Å; L260-A262 VanDerWaalsContact C-N 3.34Å; L260-A262 PolarHBondContact O-N 3.45Å; L260-V263 PolarHBondContact O-N 3.35Å; L260-V264 HydrophobicContact CD2-CG1 4.34Å; L260-V264 HydrophobicContact CD2-CG2 4.49Å; L260-V264 WeakPolarHBondContact O-CG2 3.32Å; L260-V264 PolarHBondContact O-N 3.43Å
261	F	98.8	Very high	97.4	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-61.7	-41.3	178.3	-63.4	-30.1	0	0	0	112.3	I181 S195 I198 A199 I202 Y230 S257 G258 M259 V264 G265 L274 F278	I181-F261 HydrophobicContact CD1-CD2 4.14Å; I181-F261 HydrophobicContact CD1-CE2 4.01Å; S195-F261 VanDerWaalsContact O-CZ 3.27Å; S195-F261 WeakPolarHBondContact O-CZ 3.15Å; I198-F261 HydrophobicContact CB-CE2 4.17Å; I198-F261 HydrophobicContact CB-CZ 4.22Å; I198-F261 HydrophobicContact CG2-CD1 4.21Å; I198-F261 HydrophobicContact CG2-CD2 3.94Å; I198-F261 HydrophobicContact CG2-CE1 4.17Å; I198-F261 HydrophobicContact CG2-CE2 3.86Å; I198-F261 HydrophobicContact CG2-CG 4.13Å; I198-F261 HydrophobicContact CG2-CZ 4Å; A199-F261 HydrophobicContact CB-CE1 3.83Å; A199-F261 HydrophobicContact CB-CZ 4.08Å; I202-F261 HydrophobicContact CD1-CD1 3.55Å; I202-F261 HydrophobicContact CD1-CE1 4.1Å; I202-F261 HydrophobicContact CD1-CG 4.23Å; Y230-F261 HydrophobicContact CD1-CE1 4.31Å; Y230-F261 HydrophobicContact CD1-CZ 4.43Å; Y230-F261 AromaticContact CE1-CE1 3.97Å; Y230-F261 HydrophobicContact CE1-CE1 3.97Å; Y230-F261 AromaticContact CE1-CZ 3.65Å; Y230-F261 HydrophobicContact CE1-CZ 3.65Å; Y230-F261 AromaticContact CZ-CZ 3.79Å; S257-F261 WeakPolarHBondContact O-CD2 3.4Å; S257-F261 WeakPolarHBondContact O-CG 3.26Å; S257-F261 PolarHBondContact O-N 3.47Å; G258-F261 PolarHBondContact O-N 3.11Å; M259-F261 VanDerWaalsContact C-N 3.27Å; M259-F261 PolarHBondContact O-N 3.18Å; F261-V264 WeakPolarHBondContact O-CG2 3.33Å; F261-G265 PolarHBondContact O-N 3.16Å; F261-L274 HydrophobicContact CB-CD1 4.1Å; F261-L274 WeakPolarHBondContact O-CD2 3.5Å; F261-F278 HydrophobicContact CB-CE2 3.9Å; F261-F278 HydrophobicContact CB-CZ 3.99Å; F261-F278 AromaticContact CD2-CE2 3.83Å; F261-F278 HydrophobicContact CD2-CE2 3.83Å; F261-F278 AromaticContact CD2-CZ 3.65Å; F261-F278 HydrophobicContact CD2-CZ 3.65Å; F261-F278 HydrophobicContact CG-CE2 4.13Å; F261-F278 HydrophobicContact CG-CZ 4.24Å
262	A	98.4	Very high	97.3	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-62.1	-47.5	174.1	0	0	0	0	0	112.4	A174 C177 G258 M259 L260 V264 G265 I266	A174-A262 HydrophobicContact CB-CB 3.88Å; C177-A262 HydrophobicContact CB-CB 4.18Å; G258-A262 PolarHBondContact O-N 2.9Å; M259-A262 PolarHBondContact O-N 3.4Å; L260-A262 VanDerWaalsContact C-N 3.34Å; L260-A262 PolarHBondContact O-N 3.45Å; A262-V264 PolarHBondContact O-N 3.06Å; A262-G265 PolarHBondContact O-N 2.88Å; A262-I266 HydrophobicContact CB-CD1 4.43Å; A262-I266 VanDerWaalsContact O-CB 3.27Å; A262-I266 WeakPolarHBondContact O-CB 3.34Å; A262-I266 VanDerWaalsContact O-CG1 3.25Å; A262-I266 WeakPolarHBondContact O-CG1 3.35Å; A262-I266 PolarHBondContact O-N 2.83Å
263	V	98.4	Very high	97.1	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-56.2	-52.9	177.9	164	0	0	0	0	110.7	G98 I102 L133 F222 M259 L260 G265 I266 L267	G98-V263 VanDerWaalsContact CA-CG1 3.45Å; I102-V263 HydrophobicContact CG1-CG2 4.22Å; L133-V263 HydrophobicContact CD1-CG2 4.28Å; L133-V263 HydrophobicContact CD2-CG2 4.08Å; F222-V263 HydrophobicContact CE1-CG1 4.33Å; F222-V263 HydrophobicContact CZ-CG1 4.01Å; M259-V263 HydrophobicContact CG-CG2 4.23Å; M259-V263 WeakPolarHBondContact O-CB 3.33Å; M259-V263 WeakPolarHBondContact O-CG2 3.43Å; M259-V263 PolarHBondContact O-N 3.4Å; M259-V263 HydrophobicContact SD-CG2 3.99Å; L260-V263 PolarHBondContact O-N 3.35Å; V263-G265 PolarHBondContact O-N 3.45Å; V263-I266 PolarHBondContact O-N 3.19Å; V263-L267 HydrophobicContact CG1-CD1 4.4Å; V263-L267 WeakPolarHBondContact O-CB 3.21Å; V263-L267 PolarHBondContact O-N 3.17Å
264	V	98.5	Very high	97.1	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-69.6	-34.1	-177	-57.6	0	0	0	0	112.5	I202 S223 F226 T227 L260 F261 A262 G268 F270	I202-V264 HydrophobicContact CD1-CG2 4.26Å; I202-V264 HydrophobicContact CG2-CG2 4.29Å; S223-V264 WeakPolarHBondContact OG-CB 3.44Å; F226-V264 HydrophobicContact CB-CG1 3.54Å; F226-V264 HydrophobicContact CG-CG1 4.12Å; T227-V264 HydrophobicContact CG2-CG1 4.27Å; T227-V264 HydrophobicContact CG2-CG2 4.15Å; L260-V264 HydrophobicContact CD2-CG1 4.34Å; L260-V264 HydrophobicContact CD2-CG2 4.49Å; L260-V264 WeakPolarHBondContact O-CG2 3.32Å; L260-V264 PolarHBondContact O-N 3.43Å; F261-V264 WeakPolarHBondContact O-CG2 3.33Å; A262-V264 PolarHBondContact O-N 3.06Å; V264-G268 WeakPolarHBondContact O-CA 3.3Å; V264-G268 PolarHBondContact O-N 3.47Å; V264-F270 HydrophobicContact CB-CZ 4.25Å; V264-F270 HydrophobicContact CG2-CZ 4.12Å; V264-F270 WeakPolarHBondContact O-CE1 3.49Å; V264-F270 WeakPolarHBondContact O-CZ 3.45Å
265	G	97.9	Very high	97.1	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-73	-36.3	176.8	0	0	0	0	0	113.9	F261 A262 V263 H269 F270 S271	F261-G265 PolarHBondContact O-N 3.16Å; A262-G265 PolarHBondContact O-N 2.88Å; V263-G265 PolarHBondContact O-N 3.45Å; G265-H269 PolarHBondContact O-N 3.26Å; G265-F270 CarbonylContact O-C 3.59Å; G265-F270 PolarHBondContact O-N 2.97Å; G265-S271 PolarHBondContact O-N 3.18Å
266	I	96.9	Very high	97.1	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.015	7%	0.069	C	C	.	.	H	α-helix	trans	-77.2	-54.9	-179.2	-69.3	166.6	0	0	0	110.4	L133 Y137 I170 L173 A174 A262 V263 G268 H269	L133-I266 HydrophobicContact CD1-CB 4.49Å; L133-I266 HydrophobicContact CD1-CG2 4.27Å; L133-I266 HydrophobicContact CD2-CD1 3.81Å; L133-I266 HydrophobicContact CG-CG2 4.4Å; Y137-I266 HydrophobicContact CD2-CG2 3.82Å; Y137-I266 HydrophobicContact CE2-CG2 4.43Å; Y137-I266 HydrophobicContact CG-CG2 4.33Å; I170-I266 HydrophobicContact CB-CD1 4.11Å; I170-I266 HydrophobicContact CB-CG1 4.29Å; I170-I266 HydrophobicContact CD1-CG2 4.28Å; I170-I266 HydrophobicContact CG2-CG1 4.47Å; L173-I266 HydrophobicContact CD2-CD1 4.43Å; L173-I266 HydrophobicContact CD2-CG1 4.14Å; A174-I266 HydrophobicContact CB-CD1 4.18Å; A262-I266 HydrophobicContact CB-CD1 4.43Å; A262-I266 VanDerWaalsContact O-CB 3.27Å; A262-I266 WeakPolarHBondContact O-CB 3.34Å; A262-I266 VanDerWaalsContact O-CG1 3.25Å; A262-I266 WeakPolarHBondContact O-CG1 3.35Å; A262-I266 PolarHBondContact O-N 2.83Å; V263-I266 PolarHBondContact O-N 3.19Å; I266-G268 VanDerWaalsContact C-N 3.34Å; I266-H269 PolarHBondContact O-N 2.81Å
267	L	96.5	Very high	97.1	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-77.5	-20.6	-179.6	-61.1	-179.8	0	0	0	112.8	E94 L133 F222 V263 H269	E94-L267 HydrophobicContact CB-CD1 4.17Å; E94-L267 HydrophobicContact CG-CD1 4.36Å; E94-L267 HydrophobicContact CG-CD2 4.31Å; L133-L267 HydrophobicContact CD1-CD1 3.67Å; L133-L267 HydrophobicContact CD1-CD2 3.89Å; L133-L267 HydrophobicContact CD1-CG 3.51Å; F222-L267 HydrophobicContact CD1-CB 4.24Å; F222-L267 HydrophobicContact CE1-CB 3.58Å; F222-L267 HydrophobicContact CE1-CD1 4.29Å; F222-L267 HydrophobicContact CE2-CD1 4.4Å; F222-L267 HydrophobicContact CZ-CB 3.87Å; F222-L267 HydrophobicContact CZ-CD1 3.72Å; F222-L267 HydrophobicContact CZ-CG 4.42Å; V263-L267 HydrophobicContact CG1-CD1 4.4Å; V263-L267 WeakPolarHBondContact O-CB 3.21Å; V263-L267 PolarHBondContact O-N 3.17Å; L267-H269 VanDerWaalsContact C-N 3.29Å; L267-H269 PolarHBondContact O-CD2 3.43Å; L267-H269 VanDerWaalsContact O-CD2 3.29Å
268	G	95.8	Very high	97.1	Very high	2 Å²	2	14.1 Å²	14.1	2%	0.021	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	0.2	168.9	0	0	0	0	0	114.1	V264 I266 F270	V264-G268 WeakPolarHBondContact O-CA 3.3Å; V264-G268 PolarHBondContact O-N 3.47Å; I266-G268 VanDerWaalsContact C-N 3.34Å; G268-F270 VanDerWaalsContact C-N 3.29Å; G268-F270 WeakPolarHBondContact O-CD1 3.43Å; G268-F270 PolarHBondContact O-N 3.28Å
269	H	93.9	Very high	97.1	Very high	69 Å²	69	16.1 Å²	16.1	32%	0.319	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	28.4	178	-65.6	-95.3	0	0	0	116	Y137 S141 F219 G265 I266 L267	Y137-H269 AromaticContact CE2-CE1 3.59Å; S141-H269 PolarHBondContact OG-CE1 3.45Å; S141-H269 PolarHBondContact OG-NE2 3.48Å; F219-H269 AromaticContact CD1-CD2 3.6Å; F219-H269 AromaticContact CE1-CD2 3.51Å; F219-H269 AromaticContact CE1-NE2 3.66Å; F219-H269 AromaticContact CG-CD2 3.95Å; F219-H269 AromaticContact CZ-CD2 3.77Å; F219-H269 AromaticContact CZ-NE2 3.87Å; G265-H269 PolarHBondContact O-N 3.26Å; I266-H269 PolarHBondContact O-N 2.81Å; L267-H269 VanDerWaalsContact C-N 3.29Å; L267-H269 PolarHBondContact O-CD2 3.43Å; L267-H269 VanDerWaalsContact O-CD2 3.29Å
270	F	94.7	Very high	97.1	Very high	9 Å²	9	16.1 Å²	16.1	4%	0.039	8%	0.079	C	C	.	.			trans	-123.8	28.5	176.8	60.5	-97.5	0	0	0	113.8	I202 F205 S223 V264 G265 G268 K272 T273 L274	I202-F270 HydrophobicContact CG2-CE2 4Å; I202-F270 HydrophobicContact CG2-CZ 3.85Å; F205-F270 HydrophobicContact CD1-CB 4.5Å; F205-F270 HydrophobicContact CD1-CD1 4.41Å; F205-F270 HydrophobicContact CD1-CD2 4.24Å; F205-F270 HydrophobicContact CD1-CG 4.15Å; F205-F270 HydrophobicContact CE1-CB 3.5Å; F205-F270 VanDerWaalsContact CE1-CB 3.5Å; F205-F270 AromaticContact CE1-CD1 3.84Å; F205-F270 HydrophobicContact CE1-CD1 3.84Å; F205-F270 HydrophobicContact CE1-CD2 4.02Å; F205-F270 AromaticContact CE1-CG 3.52Å; F205-F270 HydrophobicContact CE1-CG 3.52Å; F205-F270 HydrophobicContact CZ-CB 3.91Å; F205-F270 HydrophobicContact CZ-CG 4.41Å; S223-F270 WeakPolarHBondContact OG-CZ 3.36Å; V264-F270 HydrophobicContact CB-CZ 4.25Å; V264-F270 HydrophobicContact CG2-CZ 4.12Å; V264-F270 WeakPolarHBondContact O-CE1 3.49Å; V264-F270 WeakPolarHBondContact O-CZ 3.45Å; G265-F270 CarbonylContact O-C 3.59Å; G265-F270 PolarHBondContact O-N 2.97Å; G268-F270 VanDerWaalsContact C-N 3.29Å; G268-F270 WeakPolarHBondContact O-CD1 3.43Å; G268-F270 PolarHBondContact O-N 3.28Å; F270-K272 PolarHBondContact O-N 2.85Å; F270-K272 VanDerWaalsContact O-N 3.11Å; F270-T273 WeakPolarHBondContact O-CA 3.44Å; F270-T273 WeakPolarHBondContact O-CB 3.48Å; F270-T273 PolarHBondContact O-N 3.09Å; F270-L274 HydrophobicContact CD2-CB 4.42Å; F270-L274 PolarHBondContact O-N 2.98Å
271	S	95.3	Very high	97.1	Very high	7 Å²	7	16.1 Å²	16.1	5%	0.049	8%	0.079	C	C	.	.	H	α-helix	trans	-49.6	-37.1	-179.7	57.3	0	0	0	0	114.7	G265 L274 L275	G265-S271 PolarHBondContact O-N 3.18Å; S271-L274 WeakPolarHBondContact O-CB 3.23Å; S271-L274 PolarHBondContact O-N 3.22Å; S271-L275 PolarHBondContact O-N 3.08Å; S271-L275 VanDerWaalsContact O-N 3.08Å
272	K	92.6	Very high	97.1	Very high	102 Å²	102	18.2 Å²	18.2	44%	0.443	9%	0.091	S	C	.	.	H	α-helix	trans	-66.2	-45.3	174.7	-55.7	-178	-160.1	176.7	0	111.9	F270 L274 L275 L276	F270-K272 PolarHBondContact O-N 2.85Å; F270-K272 VanDerWaalsContact O-N 3.11Å; K272-L274 VanDerWaalsContact C-N 3.29Å; K272-L274 PolarHBondContact O-N 3.02Å; K272-L275 PolarHBondContact O-N 3.03Å; K272-L276 PolarHBondContact O-N 3.28Å
273	T	95.4	Very high	97.1	Very high	6 Å²	6	22.4 Å²	22.4	4%	0.037	11%	0.113	C	C	.	.	H	α-helix	trans	-63.6	-39	175.2	-50.1	0	0	0	0	110.6	F205 F270 L275 L276 F277 R397	F205-T273 HydrophobicContact CD2-CG2 3.88Å; F205-T273 HydrophobicContact CE2-CG2 3.82Å; F205-T273 HydrophobicContact CG-CG2 4.26Å; F205-T273 HydrophobicContact CZ-CG2 4.15Å; F270-T273 WeakPolarHBondContact O-CA 3.44Å; F270-T273 WeakPolarHBondContact O-CB 3.48Å; F270-T273 PolarHBondContact O-N 3.09Å; T273-L275 VanDerWaalsContact C-N 3.32Å; T273-L275 PolarHBondContact O-N 3.19Å; T273-L276 WeakPolarHBondContact O-CB 3.34Å; T273-L276 PolarHBondContact O-N 2.85Å; T273-F277 HydrophobicContact CG2-CD2 4.44Å; T273-F277 HydrophobicContact CG2-CE2 3.76Å; T273-F277 HydrophobicContact CG2-CZ 3.85Å; T273-F277 PolarHBondContact O-N 3.26Å; T273-F277 VanDerWaalsContact O-N 3.15Å; T273-R397 HydrophobicContact CG2-CG 4.19Å; T273-R397 PolarHBondContact OG1-NE 2.92Å
274	L	98.1	Very high	97.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.2	-45.8	175.5	179.6	70.6	0	0	0	111.5	I202 F261 F270 S271 K272 L276 F277 F278	I202-L274 HydrophobicContact CD1-CD1 3.71Å; I202-L274 HydrophobicContact CG1-CD1 4.28Å; F261-L274 HydrophobicContact CB-CD1 4.1Å; F261-L274 WeakPolarHBondContact O-CD2 3.5Å; F270-L274 HydrophobicContact CD2-CB 4.42Å; F270-L274 PolarHBondContact O-N 2.98Å; S271-L274 WeakPolarHBondContact O-CB 3.23Å; S271-L274 PolarHBondContact O-N 3.22Å; K272-L274 VanDerWaalsContact C-N 3.29Å; K272-L274 PolarHBondContact O-N 3.02Å; L274-L276 PolarHBondContact O-N 2.92Å; L274-F277 WeakPolarHBondContact O-CB 3.24Å; L274-F277 PolarHBondContact O-N 2.94Å; L274-F278 HydrophobicContact CD1-CD2 4.11Å; L274-F278 HydrophobicContact CD1-CE2 3.89Å; L274-F278 HydrophobicContact CG-CD2 4.2Å; L274-F278 HydrophobicContact CG-CE2 4.23Å; L274-F278 WeakPolarHBondContact O-CD2 3.37Å; L274-F278 PolarHBondContact O-N 3.48Å
275	L	97.3	Very high	97	Very high	49 Å²	49	25.5 Å²	25.5	26%	0.257	13%	0.127	S	C	.	.	H	α-helix	trans	-59.8	-33.3	176.1	-80.6	175.9	0	0	0	112.9	Y169 L173 F176 S271 K272 T273 F278 M279 V282	Y169-L275 HydrophobicContact CE2-CD1 4.04Å; Y169-L275 WeakPolarHBondContact OH-CD1 3.2Å; L173-L275 HydrophobicContact CD1-CD1 4.1Å; L173-L275 HydrophobicContact CD1-CD2 3.37Å; L173-L275 HydrophobicContact CD1-CG 3.57Å; F176-L275 HydrophobicContact CD1-CD2 4.33Å; F176-L275 HydrophobicContact CE1-CD2 4.29Å; S271-L275 PolarHBondContact O-N 3.08Å; S271-L275 VanDerWaalsContact O-N 3.08Å; K272-L275 PolarHBondContact O-N 3.03Å; T273-L275 VanDerWaalsContact C-N 3.32Å; T273-L275 PolarHBondContact O-N 3.19Å; L275-F278 CarbonylContact O-C 3.46Å; L275-F278 PolarHBondContact O-N 3.01Å; L275-M279 PolarHBondContact O-N 3.15Å; L275-V282 HydrophobicContact CD2-CG2 4.48Å
276	L	97.7	Very high	97	Very high	49 Å²	49	29.9 Å²	29.9	26%	0.257	15%	0.149	S	C	.	.	H	α-helix	trans	-66.1	-38.7	173.8	-59.7	178.9	0	0	0	111.6	K272 T273 L274 F278 M279 A393 L396	K272-L276 PolarHBondContact O-N 3.28Å; T273-L276 WeakPolarHBondContact O-CB 3.34Å; T273-L276 PolarHBondContact O-N 2.85Å; L274-L276 PolarHBondContact O-N 2.92Å; L276-F278 PolarHBondContact O-N 3.38Å; L276-M279 VanDerWaalsContact O-CB 3.22Å; L276-M279 WeakPolarHBondContact O-CB 3.4Å; L276-M279 PolarHBondContact O-N 3.23Å; L276-A393 HydrophobicContact CB-CB 3.52Å; L276-L396 HydrophobicContact CD1-CB 4.12Å; L276-L396 HydrophobicContact CD2-CD1 4.08Å
277	F	98.6	Very high	97.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.2	-26.9	173.1	-61.3	-39.3	0	0	0	112.6	I198 I202 F205 T273 L274 M279 Q386 A393 F394	I198-F277 HydrophobicContact CG2-CB 4.43Å; I202-F277 HydrophobicContact CG1-CD2 3.95Å; I202-F277 HydrophobicContact CG1-CE2 4.25Å; F205-F277 HydrophobicContact CB-CE2 4.07Å; F205-F277 HydrophobicContact CB-CZ 3.97Å; F205-F277 HydrophobicContact CG-CE2 4.42Å; F205-F277 HydrophobicContact CG-CZ 4.45Å; T273-F277 HydrophobicContact CG2-CD2 4.44Å; T273-F277 HydrophobicContact CG2-CE2 3.76Å; T273-F277 HydrophobicContact CG2-CZ 3.85Å; T273-F277 PolarHBondContact O-N 3.26Å; T273-F277 VanDerWaalsContact O-N 3.15Å; L274-F277 WeakPolarHBondContact O-CB 3.24Å; L274-F277 PolarHBondContact O-N 2.94Å; F277-M279 PolarHBondContact O-N 3.26Å; F277-Q386 PolarHBondContact O-NE2 3.06Å; F277-A393 HydrophobicContact CD1-CB 3.64Å; F277-A393 HydrophobicContact CE1-CB 3.83Å; F277-F394 HydrophobicContact CE1-CD1 4.45Å; F277-F394 HydrophobicContact CE1-CD2 4.18Å; F277-F394 HydrophobicContact CE1-CE1 4.27Å; F277-F394 AromaticContact CE1-CE2 3.94Å; F277-F394 HydrophobicContact CE1-CE2 3.94Å; F277-F394 HydrophobicContact CE1-CG 4.43Å; F277-F394 HydrophobicContact CE1-CZ 4Å; F277-F394 HydrophobicContact CZ-CD1 4.38Å; F277-F394 AromaticContact CZ-CE1 3.88Å; F277-F394 HydrophobicContact CZ-CE1 3.88Å; F277-F394 HydrophobicContact CZ-CE2 4.21Å; F277-F394 AromaticContact CZ-CZ 3.79Å; F277-F394 HydrophobicContact CZ-CZ 3.79Å
278	F	98.6	Very high	97.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	12.4	174	-90.1	-111.3	0	0	0	114.1	F176 C177 A180 I181 I198 F261 L274 L275 L276 Q281 V282	F176-F278 HydrophobicContact CD1-CD1 4.46Å; F176-F278 HydrophobicContact CE1-CB 4.22Å; F176-F278 AromaticContact CE1-CD1 3.74Å; F176-F278 HydrophobicContact CE1-CD1 3.74Å; F176-F278 HydrophobicContact CE1-CG 4.33Å; C177-F278 HydrophobicContact CB-CE1 4.07Å; C177-F278 HydrophobicContact CB-CZ 3.98Å; A180-F278 HydrophobicContact CB-CD1 4.24Å; A180-F278 HydrophobicContact CB-CE1 4.18Å; I181-F278 HydrophobicContact CG1-CE1 4.39Å; I198-F278 HydrophobicContact CD1-CD2 4.17Å; I198-F278 HydrophobicContact CD1-CE2 4.09Å; I198-F278 HydrophobicContact CD1-CZ 4.39Å; I198-F278 HydrophobicContact CG2-CD2 4.28Å; I198-F278 HydrophobicContact CG2-CE2 3.88Å; F261-F278 HydrophobicContact CB-CE2 3.9Å; F261-F278 HydrophobicContact CB-CZ 3.99Å; F261-F278 AromaticContact CD2-CE2 3.83Å; F261-F278 HydrophobicContact CD2-CE2 3.83Å; F261-F278 AromaticContact CD2-CZ 3.65Å; F261-F278 HydrophobicContact CD2-CZ 3.65Å; F261-F278 HydrophobicContact CG-CE2 4.13Å; F261-F278 HydrophobicContact CG-CZ 4.24Å; L274-F278 HydrophobicContact CD1-CD2 4.11Å; L274-F278 HydrophobicContact CD1-CE2 3.89Å; L274-F278 HydrophobicContact CG-CD2 4.2Å; L274-F278 HydrophobicContact CG-CE2 4.23Å; L274-F278 WeakPolarHBondContact O-CD2 3.37Å; L274-F278 PolarHBondContact O-N 3.48Å; L275-F278 CarbonylContact O-C 3.46Å; L275-F278 PolarHBondContact O-N 3.01Å; L276-F278 PolarHBondContact O-N 3.38Å; F278-Q281 HydrophobicContact CD1-CB 3.94Å; F278-Q281 HydrophobicContact CD1-CG 4.03Å; F278-Q281 CarbonylContact O-C 3.51Å; F278-Q281 WeakPolarHBondContact O-CA 3.43Å; F278-Q281 WeakPolarHBondContact O-CB 3.49Å; F278-Q281 PolarHBondContact O-N 3.08Å; F278-Q281 PolarHBondContact O-OE1 2.89Å; F278-Q281 VanDerWaalsContact O-OE1 3.09Å; F278-V282 HydrophobicContact CB-CG2 4.37Å; F278-V282 WeakPolarHBondContact O-CG2 3.49Å; F278-V282 PolarHBondContact O-N 3.5Å
279	M	98.5	Very high	97.1	Very high	42 Å²	42	32 Å²	32	21%	0.207	16%	0.16	C	C	.	.	H	α-helix	trans	-53.2	-46.1	-173.2	-178.3	179.8	-55.7	0	0	113.9	L275 L276 F277 Q281 V282 L283 F392 L396	L275-M279 PolarHBondContact O-N 3.15Å; L276-M279 VanDerWaalsContact O-CB 3.22Å; L276-M279 WeakPolarHBondContact O-CB 3.4Å; L276-M279 PolarHBondContact O-N 3.23Å; F277-M279 PolarHBondContact O-N 3.26Å; M279-Q281 VanDerWaalsContact C-N 3.31Å; M279-Q281 PolarHBondContact O-N 2.96Å; M279-V282 PolarHBondContact O-N 3.45Å; M279-L283 HydrophobicContact CG-CD1 4.15Å; M279-L283 HydrophobicContact CG-CG 4.47Å; M279-L283 WeakPolarHBondContact O-CB 3.47Å; M279-L283 VanDerWaalsContact O-CG 3.27Å; M279-L283 WeakPolarHBondContact O-CG 3.38Å; M279-L283 PolarHBondContact O-N 3.29Å; M279-F392 HydrophobicContact CE-CD1 3.73Å; M279-F392 HydrophobicContact CE-CE1 4.02Å; M279-F392 HydrophobicContact SD-CD1 3.92Å; M279-F392 HydrophobicContact SD-CE1 4.32Å; M279-L396 HydrophobicContact CE-CD1 4Å
280	P	98.7	Very high	97.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.6	-39.1	174.7	-26.3	38.1	0	0	0	113.3	Y184 L283 N284 L362 L385 Q386 S389	Y184-P280 HydrophobicContact CE1-CB 3.85Å; P280-L283 PolarHBondContact O-N 2.95Å; P280-N284 WeakPolarHBondContact O-CB 3.28Å; P280-N284 PolarHBondContact O-N 3.32Å; P280-L362 HydrophobicContact CB-CD1 4.31Å; P280-L362 WeakPolarHBondContact O-CD1 3.36Å; P280-L385 HydrophobicContact CG-CG 4.49Å; P280-Q386 HydrophobicContact CG-CB 4.49Å; P280-S389 WeakPolarHBondContact CG-OG 3.4Å
281	Q	98.7	Very high	97.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.9	-39.1	179.3	-63.7	69.8	22.2	0	0	111.4	F176 A180 Y184 F278 M279 N284 F285	F176-Q281 HydrophobicContact CZ-CB 4.35Å; A180-Q281 HydrophobicContact CB-CB 3.99Å; A180-Q281 HydrophobicContact CB-CG 4.44Å; Y184-Q281 HydrophobicContact CD1-CG 4.2Å; F278-Q281 HydrophobicContact CD1-CB 3.94Å; F278-Q281 HydrophobicContact CD1-CG 4.03Å; F278-Q281 CarbonylContact O-C 3.51Å; F278-Q281 WeakPolarHBondContact O-CA 3.43Å; F278-Q281 WeakPolarHBondContact O-CB 3.49Å; F278-Q281 PolarHBondContact O-N 3.08Å; F278-Q281 PolarHBondContact O-OE1 2.89Å; F278-Q281 VanDerWaalsContact O-OE1 3.09Å; M279-Q281 VanDerWaalsContact C-N 3.31Å; M279-Q281 PolarHBondContact O-N 2.96Å; Q281-N284 PolarHBondContact O-N 3.08Å; Q281-F285 VanDerWaalsContact O-CB 3.28Å; Q281-F285 WeakPolarHBondContact O-CB 3.28Å; Q281-F285 PolarHBondContact O-N 3.36Å
282	V	98.5	Very high	97.2	Very high	43 Å²	43	31.3 Å²	31.3	26%	0.261	16%	0.159	S	C	.	.	H	α-helix	trans	-60.8	-48.3	172.8	172.2	0	0	0	0	109.7	F176 L275 F278 M279 N284 F285 L286	F176-V282 HydrophobicContact CE1-CG2 3.87Å; F176-V282 HydrophobicContact CE2-CG2 4.47Å; F176-V282 HydrophobicContact CZ-CB 4.3Å; F176-V282 HydrophobicContact CZ-CG2 3.53Å; L275-V282 HydrophobicContact CD2-CG2 4.48Å; F278-V282 HydrophobicContact CB-CG2 4.37Å; F278-V282 WeakPolarHBondContact O-CG2 3.49Å; F278-V282 PolarHBondContact O-N 3.5Å; M279-V282 PolarHBondContact O-N 3.45Å; V282-N284 PolarHBondContact O-N 2.93Å; V282-F285 PolarHBondContact O-N 3.08Å; V282-L286 HydrophobicContact CG1-CD1 4.11Å; V282-L286 HydrophobicContact CG1-CG 4.43Å; V282-L286 WeakPolarHBondContact O-CG 3.43Å; V282-L286 PolarHBondContact O-N 3.31Å
283	L	98.3	Very high	97.3	Very high	88 Å²	88	33.2 Å²	33.2	46%	0.461	17%	0.168	S	C	.	.	H	α-helix	trans	-62	-42.7	177.4	-69	174.1	0	0	0	112	M279 P280 L286 L287 L362	M279-L283 HydrophobicContact CG-CD1 4.15Å; M279-L283 HydrophobicContact CG-CG 4.47Å; M279-L283 WeakPolarHBondContact O-CB 3.47Å; M279-L283 VanDerWaalsContact O-CG 3.27Å; M279-L283 WeakPolarHBondContact O-CG 3.38Å; M279-L283 PolarHBondContact O-N 3.29Å; P280-L283 PolarHBondContact O-N 2.95Å; L283-L286 PolarHBondContact O-N 2.87Å; L283-L287 VanDerWaalsContact O-CB 3.25Å; L283-L287 WeakPolarHBondContact O-CB 3.42Å; L283-L287 PolarHBondContact O-N 2.99Å; L283-L362 HydrophobicContact CB-CD1 4.22Å
284	N	98.6	Very high	97.2	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-40.8	175.7	-176.7	68.1	0	0	0	112.4	I183 Y184 P280 Q281 V282 S288 T361 L362	I183-N284 PolarHBondContact O-ND2 3.42Å; I183-N284 VanDerWaalsContact O-ND2 3.09Å; Y184-N284 WeakPolarHBondContact CA-ND2 3.15Å; Y184-N284 WeakPolarHBondContact CB-ND2 3.15Å; Y184-N284 HydrophobicContact CD2-CB 4.07Å; Y184-N284 HydrophobicContact CG-CB 4.01Å; P280-N284 WeakPolarHBondContact O-CB 3.28Å; P280-N284 PolarHBondContact O-N 3.32Å; Q281-N284 PolarHBondContact O-N 3.08Å; V282-N284 PolarHBondContact O-N 2.93Å; N284-S288 VanDerWaalsContact O-CB 3.25Å; N284-S288 WeakPolarHBondContact O-CB 3.49Å; N284-S288 PolarHBondContact O-N 3.11Å; N284-S288 PolarHBondContact O-OG 3.06Å; N284-T361 WeakPolarHBondContact OD1-CA 3.16Å; N284-T361 WeakPolarHBondContact OD1-CB 3.4Å; N284-L362 HydrophobicContact CB-CB 4.21Å; N284-L362 HydrophobicContact CB-CD1 3.86Å; N284-L362 HydrophobicContact CB-CG 3.8Å; N284-L362 PolarHBondContact OD1-N 2.97Å
285	F	97.3	Very high	97.1	Very high	65 Å²	65	40.8 Å²	40.8	29%	0.285	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-50.7	176.3	174.3	-107.2	0	0	0	111.1	F176 I183 Q281 V282 L287 S288 L289 L292	F176-F285 HydrophobicContact CD2-CD1 4.47Å; F176-F285 HydrophobicContact CD2-CG 4.45Å; F176-F285 HydrophobicContact CE2-CB 3.89Å; F176-F285 HydrophobicContact CE2-CD1 4.07Å; F176-F285 AromaticContact CE2-CG 3.92Å; F176-F285 HydrophobicContact CE2-CG 3.92Å; I183-F285 HydrophobicContact CD1-CD2 4.28Å; Q281-F285 VanDerWaalsContact O-CB 3.28Å; Q281-F285 WeakPolarHBondContact O-CB 3.28Å; Q281-F285 PolarHBondContact O-N 3.36Å; V282-F285 PolarHBondContact O-N 3.08Å; F285-L287 PolarHBondContact O-N 2.91Å; F285-S288 WeakPolarHBondContact O-CA 3.28Å; F285-S288 WeakPolarHBondContact O-CB 3.2Å; F285-S288 PolarHBondContact O-N 2.84Å; F285-L289 HydrophobicContact CD1-CD2 4.41Å; F285-L289 HydrophobicContact CD2-CD2 4.5Å; F285-L289 HydrophobicContact CE1-CD2 3.85Å; F285-L289 HydrophobicContact CE2-CD2 3.95Å; F285-L289 HydrophobicContact CZ-CD2 3.6Å; F285-L289 WeakPolarHBondContact O-CG 3.16Å; F285-L289 PolarHBondContact O-N 2.88Å; F285-L289 VanDerWaalsContact O-N 3.12Å; F285-L292 HydrophobicContact CD2-CD1 4.35Å; F285-L292 HydrophobicContact CE2-CD1 4.37Å
286	L	97.4	Very high	97.1	Very high	91 Å²	91	38.5 Å²	38.5	48%	0.476	19%	0.192	S	C	.	.	H	α-helix	trans	-59.1	-44.8	177.1	-68.7	177.8	0	0	0	112	V282 L283 S288 L289	V282-L286 HydrophobicContact CG1-CD1 4.11Å; V282-L286 HydrophobicContact CG1-CG 4.43Å; V282-L286 WeakPolarHBondContact O-CG 3.43Å; V282-L286 PolarHBondContact O-N 3.31Å; L283-L286 PolarHBondContact O-N 2.87Å; L286-S288 VanDerWaalsContact C-N 3.28Å; L286-S288 PolarHBondContact O-N 3.17Å; L286-L289 HydrophobicContact CD2-CD1 3.97Å; L286-L289 PolarHBondContact O-N 2.91Å
287	L	97.8	Very high	96.9	Very high	13 Å²	13	38 Å²	38	7%	0.068	19%	0.193	C	C	.	.	H	α-helix	trans	-59.5	-40.5	174.3	178.5	57.8	0	0	0	111	L283 F285 L289 P290 F336 L341 F360 T361 L362 L365	L283-L287 VanDerWaalsContact O-CB 3.25Å; L283-L287 WeakPolarHBondContact O-CB 3.42Å; L283-L287 PolarHBondContact O-N 2.99Å; F285-L287 PolarHBondContact O-N 2.91Å; L287-L289 VanDerWaalsContact C-N 3.34Å; L287-L289 PolarHBondContact O-N 3.48Å; L287-P290 VanDerWaalsContact O-CD 3.26Å; L287-P290 WeakPolarHBondContact O-CD 3.19Å; L287-F336 HydrophobicContact CD1-CD1 3.81Å; L287-F336 HydrophobicContact CD1-CE1 3.63Å; L287-L341 HydrophobicContact CD1-CB 4.31Å; L287-F360 HydrophobicContact CD1-CD1 4.33Å; L287-F360 HydrophobicContact CG-CB 4.45Å; L287-F360 WeakPolarHBondContact O-CB 3.41Å; L287-F360 WeakPolarHBondContact O-CD1 3.11Å; L287-T361 VanDerWaalsContact CD2-C 3.48Å; L287-L362 HydrophobicContact CD2-CD2 4.2Å; L287-L365 HydrophobicContact CD2-CB 4.17Å; L287-L365 HydrophobicContact CD2-CD2 4.05Å
288	S	97	Very high	96.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-71.9	-19	-178.8	-67.6	0	0	0	0	114.9	N284 F285 L286 P290 Q291 L292 R302 F360	N284-S288 VanDerWaalsContact O-CB 3.25Å; N284-S288 WeakPolarHBondContact O-CB 3.49Å; N284-S288 PolarHBondContact O-N 3.11Å; N284-S288 PolarHBondContact O-OG 3.06Å; F285-S288 WeakPolarHBondContact O-CA 3.28Å; F285-S288 WeakPolarHBondContact O-CB 3.2Å; F285-S288 PolarHBondContact O-N 2.84Å; L286-S288 VanDerWaalsContact C-N 3.28Å; L286-S288 PolarHBondContact O-N 3.17Å; S288-P290 VanDerWaalsContact C-CD 3.47Å; S288-Q291 PolarHBondContact O-N 2.89Å; S288-Q291 VanDerWaalsContact O-N 3.08Å; S288-L292 WeakPolarHBondContact O-CG 3.32Å; S288-L292 PolarHBondContact O-N 3.39Å; S288-R302 PolarHBondContact OG-NH1 3.2Å; S288-R302 VanDerWaalsContact OG-NH1 3.1Å; S288-F360 VanDerWaalsContact CA-O 3.23Å; S288-F360 WeakPolarHBondContact CA-O 3.13Å; S288-F360 PolarHBondContact N-O 2.95Å; S288-F360 PolarHBondContact OG-O 3.01Å
289	L	96.2	Very high	96.3	Very high	39 Å²	39	41.9 Å²	41.9	20%	0.204	22%	0.218	C	C	.	.	H	α-helix	trans	-52.8	-43.7	-171.4	-70.7	-179.6	0	0	0	114.9	F285 L286 L287 Q291 L292 F293	F285-L289 HydrophobicContact CD1-CD2 4.41Å; F285-L289 HydrophobicContact CD2-CD2 4.5Å; F285-L289 HydrophobicContact CE1-CD2 3.85Å; F285-L289 HydrophobicContact CE2-CD2 3.95Å; F285-L289 HydrophobicContact CZ-CD2 3.6Å; F285-L289 WeakPolarHBondContact O-CG 3.16Å; F285-L289 PolarHBondContact O-N 2.88Å; F285-L289 VanDerWaalsContact O-N 3.12Å; L286-L289 HydrophobicContact CD2-CD1 3.97Å; L286-L289 PolarHBondContact O-N 2.91Å; L287-L289 VanDerWaalsContact C-N 3.34Å; L287-L289 PolarHBondContact O-N 3.48Å; L289-Q291 PolarHBondContact O-N 3.29Å; L289-L292 PolarHBondContact O-N 2.84Å; L289-F293 HydrophobicContact CB-CD2 4.29Å; L289-F293 HydrophobicContact CB-CE2 4.27Å; L289-F293 HydrophobicContact CD1-CE2 4.41Å; L289-F293 HydrophobicContact CD2-CD2 4.38Å; L289-F293 HydrophobicContact CD2-CE1 4.39Å; L289-F293 HydrophobicContact CD2-CE2 3.72Å; L289-F293 HydrophobicContact CD2-CZ 3.72Å; L289-F293 HydrophobicContact CG-CE2 4.34Å; L289-F293 WeakPolarHBondContact O-CB 3.23Å; L289-F293 PolarHBondContact O-N 2.97Å
290	P	97.4	Very high	95.7	Very high	12 Å²	12	50 Å²	50	8%	0.078	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-36.6	179.6	-25.1	36.2	0	0	0	113.1	L287 S288 V295 I296 T332 F336 F360	L287-P290 VanDerWaalsContact O-CD 3.26Å; L287-P290 WeakPolarHBondContact O-CD 3.19Å; S288-P290 VanDerWaalsContact C-CD 3.47Å; P290-V295 WeakPolarHBondContact O-CA 3.42Å; P290-V295 WeakPolarHBondContact O-CB 3.28Å; P290-V295 PolarHBondContact O-N 3.39Å; P290-I296 HydrophobicContact CB-CB 4.49Å; P290-I296 HydrophobicContact CB-CG1 3.84Å; P290-I296 PolarHBondContact O-N 3.43Å; P290-T332 HydrophobicContact CB-CG2 4.05Å; P290-T332 HydrophobicContact CG-CG2 3.98Å; P290-F336 HydrophobicContact CG-CE1 4.4Å; P290-F336 HydrophobicContact CG-CE2 3.85Å; P290-F336 HydrophobicContact CG-CZ 3.72Å; P290-F360 HydrophobicContact CB-CD1 4.2Å; P290-F360 HydrophobicContact CB-CE1 4.07Å; P290-F360 HydrophobicContact CG-CD1 4Å; P290-F360 HydrophobicContact CG-CE1 4.01Å
291	Q	96.3	Very high	95.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-78.5	-42.7	175.5	-74.1	-170.2	-45	0	0	111.9	S288 L289 F293 H294 I296 C298 N359 F360	S288-Q291 PolarHBondContact O-N 2.89Å; S288-Q291 VanDerWaalsContact O-N 3.08Å; L289-Q291 PolarHBondContact O-N 3.29Å; Q291-F293 VanDerWaalsContact C-N 3.31Å; Q291-F293 PolarHBondContact O-N 3.36Å; Q291-H294 PolarHBondContact O-N 3.17Å; Q291-I296 HydrophobicContact CG-CB 4.3Å; Q291-I296 HydrophobicContact CG-CG2 4.38Å; Q291-C298 HydrophobicContact CB-CB 3.96Å; Q291-C298 WeakPolarHBondContact O-CB 3.1Å; Q291-N359 PolarHBondContact NE2-OD1 2.97Å; Q291-F360 HydrophobicContact CG-CB 4.03Å; Q291-F360 HydrophobicContact CG-CD2 3.79Å; Q291-F360 HydrophobicContact CG-CE2 4.49Å; Q291-F360 HydrophobicContact CG-CG 4.02Å
292	L	93	Very high	94.8	Very high	58 Å²	58	57.5 Å²	57.5	30%	0.304	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-35.2	-178.9	-66.8	177	0	0	0	112.8	I183 F285 S288 L289 H294	I183-L292 HydrophobicContact CD1-CD1 4.45Å; F285-L292 HydrophobicContact CD2-CD1 4.35Å; F285-L292 HydrophobicContact CE2-CD1 4.37Å; S288-L292 WeakPolarHBondContact O-CG 3.32Å; S288-L292 PolarHBondContact O-N 3.39Å; L289-L292 PolarHBondContact O-N 2.84Å; L292-H294 VanDerWaalsContact C-N 3.26Å; L292-H294 PolarHBondContact O-N 2.87Å; L292-H294 PolarHBondContact O-ND1 2.83Å; L292-H294 VanDerWaalsContact O-ND1 3.15Å
293	F	94	Very high	94.5	Very high	142 Å²	142	57.9 Å²	57.9	62%	0.623	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	6.8	174.3	-63	-26.9	0	0	0	113.6	L289 Q291 V295	L289-F293 HydrophobicContact CB-CD2 4.29Å; L289-F293 HydrophobicContact CB-CE2 4.27Å; L289-F293 HydrophobicContact CD1-CE2 4.41Å; L289-F293 HydrophobicContact CD2-CD2 4.38Å; L289-F293 HydrophobicContact CD2-CE1 4.39Å; L289-F293 HydrophobicContact CD2-CE2 3.72Å; L289-F293 HydrophobicContact CD2-CZ 3.72Å; L289-F293 HydrophobicContact CG-CE2 4.34Å; L289-F293 WeakPolarHBondContact O-CB 3.23Å; L289-F293 PolarHBondContact O-N 2.97Å; Q291-F293 VanDerWaalsContact C-N 3.31Å; Q291-F293 PolarHBondContact O-N 3.36Å; F293-V295 HydrophobicContact CB-CG2 4.19Å; F293-V295 PolarHBondContact O-N 2.97Å; F293-V295 VanDerWaalsContact O-N 3.09Å
294	H	93.3	Very high	94.5	Very high	132 Å²	132	54.2 Å²	54.2	61%	0.611	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	24.6	179.7	-57.1	73.9	0	0	0	113.6	Q291 L292 I296	Q291-H294 PolarHBondContact O-N 3.17Å; L292-H294 VanDerWaalsContact C-N 3.26Å; L292-H294 PolarHBondContact O-N 2.87Å; L292-H294 PolarHBondContact O-ND1 2.83Å; L292-H294 VanDerWaalsContact O-ND1 3.15Å; H294-I296 VanDerWaalsContact C-N 3.28Å
295	V	96.4	Very high	94.3	Very high	33 Å²	33	60.6 Å²	60.6	20%	0.2	29%	0.289	C	S	.	.	S	Bend	trans	-68.2	-36.3	168.6	173.4	0	0	0	0	109.6	P290 F293 F328	P290-V295 WeakPolarHBondContact O-CA 3.42Å; P290-V295 WeakPolarHBondContact O-CB 3.28Å; P290-V295 PolarHBondContact O-N 3.39Å; F293-V295 HydrophobicContact CB-CG2 4.19Å; F293-V295 PolarHBondContact O-N 2.97Å; F293-V295 VanDerWaalsContact O-N 3.09Å; V295-F328 HydrophobicContact CG1-CD1 3.66Å; V295-F328 HydrophobicContact CG1-CE1 3.73Å; V295-F328 HydrophobicContact CG2-CD1 4.3Å; V295-F328 HydrophobicContact CG2-CE1 3.96Å
296	I	96.4	Very high	94.2	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-114.6	137.9	167.2	-55.3	-60	0	0	0	107.6	P290 Q291 H294 C298 F320 L325 G329 L333 F360	P290-I296 HydrophobicContact CB-CB 4.49Å; P290-I296 HydrophobicContact CB-CG1 3.84Å; P290-I296 PolarHBondContact O-N 3.43Å; Q291-I296 HydrophobicContact CG-CB 4.3Å; Q291-I296 HydrophobicContact CG-CG2 4.38Å; H294-I296 VanDerWaalsContact C-N 3.28Å; I296-C298 PolarHBondContact O-N 3.25Å; I296-F320 HydrophobicContact CG2-CE1 3.94Å; I296-F320 HydrophobicContact CG2-CZ 3.99Å; I296-L325 HydrophobicContact CD1-CD2 3.79Å; I296-G329 WeakPolarHBondContact CD1-O 3.23Å; I296-L333 HydrophobicContact CD1-CB 3.99Å; I296-F360 HydrophobicContact CG1-CZ 4.25Å; I296-F360 HydrophobicContact CG2-CE2 4.26Å
297	P	94.9	Very high	94.2	Very high	40 Å²	40	57.7 Å²	57.7	26%	0.26	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-52	126.8	175.3	-30.3	38.1	0	0	0	112.2	F320	P297-F320 HydrophobicContact CB-CB 4.13Å; P297-F320 HydrophobicContact CB-CD1 3.8Å; P297-F320 HydrophobicContact CB-CE1 4.5Å; P297-F320 HydrophobicContact CB-CG 4.08Å; P297-F320 HydrophobicContact CG-CB 3.81Å; P297-F320 HydrophobicContact CG-CD1 3.79Å; P297-F320 HydrophobicContact CG-CD2 4.15Å; P297-F320 HydrophobicContact CG-CE1 4.41Å; P297-F320 HydrophobicContact CG-CG 3.64Å
298	C	92.9	Very high	93.9	Very high	42 Å²	42	61.4 Å²	61.4	28%	0.284	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-103.6	117.2	-179.9	-173.6	0	0	0	0	109.5	Q291 I296	Q291-C298 HydrophobicContact CB-CB 3.96Å; Q291-C298 WeakPolarHBondContact O-CB 3.1Å; I296-C298 PolarHBondContact O-N 3.25Å
299	P	91	Very high	93.8	Very high	39 Å²	39	66.2 Å²	66.2	25%	0.253	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-66.8	157.2	172.2	28.7	-32.3	0	0	0	110.1	H301 R302 A318 N359	P299-H301 PolarHBondContact O-N 2.89Å; P299-R302 HydrophobicContact CG-CG 4.23Å; P299-A318 HydrophobicContact CG-CB 4.16Å; P299-N359 WeakPolarHBondContact CD-OD1 3.34Å; P299-N359 WeakPolarHBondContact CG-OD1 3.16Å
300	R	85.3	Confident	93.8	Very high	211 Å²	211	67.7 Å²	67.7	80%	0.796	34%	0.336	S	S	*	.	S	Bend	trans	-58.4	-35.8	178.3	-174.9	176.6	-178.9	173	-1.4	112.6
301	H	85.6	Confident	93.7	Very high	112 Å²	112	70.1 Å²	70.1	52%	0.519	35%	0.348	S	S	.	.			trans	-122.6	134.3	179.4	-63.4	-64.3	0	0	0	109.8	P299 L303	P299-H301 PolarHBondContact O-N 2.89Å; H301-L303 HydrophobicContact CB-CD1 4.11Å
302	R	93.2	Very high	93.8	Very high	47 Å²	47	76 Å²	76	18%	0.177	37%	0.371	C	S	.	.			trans	-115.6	12.5	179.2	-61.5	-176.1	-67.3	155.7	5.1	112.9	S288 P299 S316 N359 T361 N364	S288-R302 PolarHBondContact OG-NH1 3.2Å; S288-R302 VanDerWaalsContact OG-NH1 3.1Å; P299-R302 HydrophobicContact CG-CG 4.23Å; R302-S316 PolarHBondContact O-OG 2.87Å; R302-N359 HydrophobicContact CB-CB 4.2Å; R302-N359 HydrophobicContact CG-CB 4.36Å; R302-T361 HydrophobicContact CB-CG2 4.26Å; R302-N364 PolarHBondContact O-ND2 2.6Å
303	L	93	Very high	94	Very high	51 Å²	51	73.3 Å²	73.3	27%	0.267	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-57.6	150.9	175.3	-72.6	134.1	0	0	0	110.8	M44 G186 H301 S316	M44-L303 HydrophobicContact CE-CD1 3.38Å; M44-L303 HydrophobicContact CE-CD2 4.46Å; M44-L303 HydrophobicContact CE-CG 4.48Å; G186-L303 WeakPolarHBondContact O-CD2 3.35Å; H301-L303 HydrophobicContact CB-CD1 4.11Å; L303-S316 WeakPolarHBondContact O-CB 3.45Å; L303-S316 PolarHBondContact O-OG 3.17Å
304	P	96.7	Very high	94.2	Very high	11 Å²	11	68.3 Å²	68.3	7%	0.071	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-54.3	153.7	170	-27	37.6	0	0	0	112.6	I187 L313 I363 L367 L378	I187-P304 HydrophobicContact CG2-CG 4.04Å; P304-L313 HydrophobicContact CB-CB 3.95Å; P304-L313 HydrophobicContact CB-CD1 4.06Å; P304-L313 HydrophobicContact CB-CD2 4.24Å; P304-L313 HydrophobicContact CB-CG 4.31Å; P304-L313 HydrophobicContact CG-CD1 4.28Å; P304-I363 HydrophobicContact CG-CG2 3.43Å; P304-I363 VanDerWaalsContact CG-CG2 3.43Å; P304-L367 HydrophobicContact CB-CD1 3.67Å; P304-L367 HydrophobicContact CG-CD1 3.91Å; P304-L378 HydrophobicContact CG-CD2 4.3Å
305	K	95.4	Very high	94.4	Very high	134 Å²	134	64 Å²	64	58%	0.583	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	129.5	171.9	-179.7	178.9	-179.3	-179.5	0	109.2	L313 T314	K305-L313 CarbonylContact O-C 3.53Å; K305-L313 WeakPolarHBondContact O-CA 3.2Å; K305-T314 HydrophobicContact CB-CG2 3.84Å; K305-T314 HydrophobicContact CD-CG2 4.29Å; K305-T314 HydrophobicContact CG-CG2 4.23Å; K305-T314 PolarHBondContact N-O 2.7Å; K305-T314 PolarHBondContact O-N 3.49Å
306	Y	96.1	Very high	94.4	Very high	31 Å²	31	63.2 Å²	63.2	12%	0.122	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.2	175.9	179.7	-116	0	0	0	111.7	C45 K47 E308 D311 L313	C45-Y306 VanDerWaalsContact O-CD2 3.27Å; C45-Y306 WeakPolarHBondContact O-CD2 3.28Å; C45-Y306 VanDerWaalsContact O-CE2 3.31Å; C45-Y306 WeakPolarHBondContact O-CE2 3.44Å; K47-Y306 HydrophobicContact CB-CE1 4.32Å; K47-Y306 PolarHBondContact N-OH 3.36Å; Y306-E308 HydrophobicContact CD1-CG 3.83Å; Y306-E308 HydrophobicContact CE1-CB 4.28Å; Y306-E308 HydrophobicContact CE1-CG 3.51Å; Y306-D311 VanDerWaalsContact CE2-OD1 3.24Å; Y306-D311 WeakPolarHBondContact CE2-OD1 3.16Å; Y306-D311 VanDerWaalsContact CZ-OD1 3.3Å; Y306-D311 PolarHBondContact OH-OD1 2.79Å; Y306-L313 HydrophobicContact CD2-CD2 3.84Å; Y306-L313 HydrophobicContact CG-CD2 4.37Å
307	D	95.6	Very high	94.4	Very high	65 Å²	65	65.7 Å²	65.7	35%	0.348	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	107.8	172.2	176.3	7.2	0	0	0	109.9	S309 T310 D311 R312	D307-S309 VanDerWaalsContact CG-OG 3.31Å; D307-S309 PolarHBondContact O-N 3.05Å; D307-S309 WeakPolarHBondContact OD1-CB 3.37Å; D307-S309 PolarHBondContact OD1-N 3.04Å; D307-S309 PolarHBondContact OD1-OG 3.06Å; D307-S309 PolarHBondContact OD2-OG 3.22Å; D307-T310 VanDerWaalsContact CG-OG1 3.26Å; D307-T310 PolarHBondContact O-N 3.12Å; D307-T310 PolarHBondContact OD2-OG1 3.41Å; D307-D311 WeakPolarHBondContact O-CA 3.33Å; D307-D311 PolarHBondContact O-N 3.13Å; D307-R312 PolarHBondContact N-O 3Å; D307-R312 PolarHBondContact O-N 3.33Å
308	E	93.2	Very high	94.5	Very high	91 Å²	91	64 Å²	64	43%	0.425	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.5	-178.6	-73.5	174.7	-157.8	0	0	113.5	R49 Y306	R49-E308 IonicContact CZ-OE1 3.7Å; R49-E308 IonicContact NE-OE1 3.67Å; R49-E308 IonicContact NH2-OE1 2.91Å; R49-E308 PolarHBondContact NH2-OE1 3.4Å; Y306-E308 HydrophobicContact CD1-CG 3.83Å; Y306-E308 HydrophobicContact CE1-CB 4.28Å; Y306-E308 HydrophobicContact CE1-CG 3.51Å
309	S	94.7	Very high	94.6	Very high	101 Å²	101	68.1 Å²	68.1	71%	0.706	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-32.4	-178.2	70.6	0	0	0	0	112.7	D307	D307-S309 VanDerWaalsContact CG-OG 3.31Å; D307-S309 PolarHBondContact O-N 3.05Å; D307-S309 WeakPolarHBondContact OD1-CB 3.37Å; D307-S309 PolarHBondContact OD1-N 3.04Å; D307-S309 PolarHBondContact OD1-OG 3.06Å; D307-S309 PolarHBondContact OD2-OG 3.22Å
310	T	95.6	Very high	94.8	Very high	70 Å²	70	66.6 Å²	66.6	43%	0.429	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-7.5	-176.8	59.7	0	0	0	0	113.7	D307 R312	D307-T310 VanDerWaalsContact CG-OG1 3.26Å; D307-T310 PolarHBondContact O-N 3.12Å; D307-T310 PolarHBondContact OD2-OG1 3.41Å; T310-R312 VanDerWaalsContact C-N 3.27Å; T310-R312 WeakPolarHBondContact O-CG 3.49Å; T310-R312 PolarHBondContact O-N 3.31Å
311	D	95.5	Very high	95.2	Very high	63 Å²	63	62 Å²	62	34%	0.337	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	42.7	-172.3	-165.4	36.7	0	0	0	112.4	Y306 D307 H374	Y306-D311 VanDerWaalsContact CE2-OD1 3.24Å; Y306-D311 WeakPolarHBondContact CE2-OD1 3.16Å; Y306-D311 VanDerWaalsContact CZ-OD1 3.3Å; Y306-D311 PolarHBondContact OH-OD1 2.79Å; D307-D311 WeakPolarHBondContact O-CA 3.33Å; D307-D311 PolarHBondContact O-N 3.13Å; D311-H374 PolarHBondContact O-CD2 2.94Å; D311-H374 IonicContact OD2-CD2 3.62Å; D311-H374 PolarHBondContact OD2-CD2 3.16Å; D311-H374 IonicContact OD2-NE2 3.82Å
312	R	97.7	Very high	95.6	Very high	124 Å²	124	58.5 Å²	58.5	47%	0.468	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	153.1	-176.2	-68.8	174.6	-176.3	-147.1	8.1	111.6	D307 T310 P372	D307-R312 PolarHBondContact N-O 3Å; D307-R312 PolarHBondContact O-N 3.33Å; T310-R312 VanDerWaalsContact C-N 3.27Å; T310-R312 WeakPolarHBondContact O-CG 3.49Å; T310-R312 PolarHBondContact O-N 3.31Å; R312-P372 HydrophobicContact CB-CB 4.21Å; R312-P372 PolarHBondContact NH1-O 2.78Å; R312-P372 VanDerWaalsContact NH1-O 3.14Å
313	L	97.9	Very high	95.5	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	139.9	169.1	-57.8	-179.3	0	0	0	109.7	C45 I187 P304 K305 Y306 L367 P372 M373 E375 L378	C45-L313 HydrophobicContact CB-CD2 3.83Å; I187-L313 HydrophobicContact CG2-CD1 3.99Å; P304-L313 HydrophobicContact CB-CB 3.95Å; P304-L313 HydrophobicContact CB-CD1 4.06Å; P304-L313 HydrophobicContact CB-CD2 4.24Å; P304-L313 HydrophobicContact CB-CG 4.31Å; P304-L313 HydrophobicContact CG-CD1 4.28Å; K305-L313 CarbonylContact O-C 3.53Å; K305-L313 WeakPolarHBondContact O-CA 3.2Å; Y306-L313 HydrophobicContact CD2-CD2 3.84Å; Y306-L313 HydrophobicContact CG-CD2 4.37Å; L313-L367 HydrophobicContact CB-CD1 4.11Å; L313-L367 HydrophobicContact CB-CD2 4.25Å; L313-L367 WeakPolarHBondContact O-CD2 3.35Å; L313-P372 WeakPolarHBondContact O-CA 3.12Å; L313-M373 PolarHBondContact N-O 3.36Å; L313-M373 PolarHBondContact O-N 3.46Å; L313-M373 VanDerWaalsContact O-N 3.13Å; L313-E375 HydrophobicContact CD1-CB 3.77Å; L313-E375 HydrophobicContact CD1-CG 3.9Å; L313-E375 HydrophobicContact CG-CB 4.32Å; L313-L378 HydrophobicContact CD1-CD2 3.84Å
314	T	97.3	Very high	95.5	Very high	37 Å²	37	64.5 Å²	64.5	23%	0.227	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	162.8	165.4	-175.4	0	0	0	0	109.2	K305 S316 L367	K305-T314 HydrophobicContact CB-CG2 3.84Å; K305-T314 HydrophobicContact CD-CG2 4.29Å; K305-T314 HydrophobicContact CG-CG2 4.23Å; K305-T314 PolarHBondContact N-O 2.7Å; K305-T314 PolarHBondContact O-N 3.49Å; T314-S316 PolarHBondContact O-N 3.19Å; T314-L367 VanDerWaalsContact C-CD1 3.48Å; T314-L367 WeakPolarHBondContact O-CD1 3.17Å
315	Y	97.3	Very high	95.4	Very high	42 Å²	42	65 Å²	65	17%	0.165	33%	0.328	C	S	.	.			trans	-58.6	137.7	173.7	57.8	-96.8	0	0	0	110.1	V317 A343 N364 K368	Y315-V317 HydrophobicContact CD2-CG1 4.01Å; Y315-V317 HydrophobicContact CE2-CG1 3.97Å; Y315-A343 HydrophobicContact CE2-CB 4.12Å; Y315-N364 VanDerWaalsContact CA-OD1 3.23Å; Y315-N364 WeakPolarHBondContact CA-OD1 3.31Å; Y315-K368 HydrophobicContact CD1-CB 4.05Å; Y315-K368 HydrophobicContact CE1-CB 4.43Å
316	S	96.8	Very high	95.4	Very high	15 Å²	15	62.8 Å²	62.8	11%	0.105	33%	0.326	C	S	.	.			trans	-80.9	160.2	168.6	57.4	0	0	0	0	110.6	R302 L303 T314 S358 N359 N364	R302-S316 PolarHBondContact O-OG 2.87Å; L303-S316 WeakPolarHBondContact O-CB 3.45Å; L303-S316 PolarHBondContact O-OG 3.17Å; T314-S316 PolarHBondContact O-N 3.19Å; S316-S358 CarbonylContact O-C 3.58Å; S316-S358 WeakPolarHBondContact O-CA 3.35Å; S316-N359 PolarHBondContact O-N 3.26Å; S316-N359 PolarHBondContact OG-ND2 3.45Å; S316-N364 PolarHBondContact N-OD1 3.21Å; S316-N364 PolarHBondContact OG-OD1 3.33Å
317	V	96.7	Very high	95.4	Very high	52 Å²	52	68.3 Å²	68.3	32%	0.315	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.5	-175.6	-62.3	0	0	0	0	111.3	Y315 Q319 E356 C357	Y315-V317 HydrophobicContact CD2-CG1 4.01Å; Y315-V317 HydrophobicContact CE2-CG1 3.97Å; V317-Q319 HydrophobicContact CG2-CG 4.27Å; V317-E356 HydrophobicContact CB-CB 4.46Å; V317-C357 CarbonylContact C-O 3.54Å; V317-C357 WeakPolarHBondContact CA-O 3.48Å; V317-C357 WeakPolarHBondContact CB-O 3.44Å
318	A	96.4	Very high	95.4	Very high	4 Å²	4	71.8 Å²	71.8	3%	0.033	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.4	160.4	0	0	0	0	0	108	P299 F320 E356 C357	P299-A318 HydrophobicContact CG-CB 4.16Å; A318-F320 HydrophobicContact CB-CD1 4.27Å; A318-F320 HydrophobicContact CB-CE1 4.14Å; A318-E356 WeakPolarHBondContact O-CA 3.47Å; A318-C357 PolarHBondContact N-O 2.85Å; A318-C357 PolarHBondContact O-N 2.91Å
319	Q	95	Very high	95.6	Very high	129 Å²	129	67.4 Å²	67.4	60%	0.603	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	131.6	176.8	-66.2	-179.2	-20.7	0	0	109.1	V317 L355 E356	V317-Q319 HydrophobicContact CG2-CG 4.27Å; Q319-L355 WeakPolarHBondContact CA-O 3.37Å; Q319-E356 HydrophobicContact CG-CB 4.42Å; Q319-E356 HydrophobicContact CG-CG 4.02Å; Q319-E356 PolarHBondContact NE2-OE1 2.95Å
320	F	95.4	Very high	95.6	Very high	7 Å²	7	65.4 Å²	65.4	3%	0.031	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	158.8	178.9	48.4	-92.9	0	0	0	110.3	I296 P297 A318 L325 L333 L355	I296-F320 HydrophobicContact CG2-CE1 3.94Å; I296-F320 HydrophobicContact CG2-CZ 3.99Å; P297-F320 HydrophobicContact CB-CB 4.13Å; P297-F320 HydrophobicContact CB-CD1 3.8Å; P297-F320 HydrophobicContact CB-CE1 4.5Å; P297-F320 HydrophobicContact CB-CG 4.08Å; P297-F320 HydrophobicContact CG-CB 3.81Å; P297-F320 HydrophobicContact CG-CD1 3.79Å; P297-F320 HydrophobicContact CG-CD2 4.15Å; P297-F320 HydrophobicContact CG-CE1 4.41Å; P297-F320 HydrophobicContact CG-CG 3.64Å; A318-F320 HydrophobicContact CB-CD1 4.27Å; A318-F320 HydrophobicContact CB-CE1 4.14Å; F320-L325 HydrophobicContact CD2-CD1 4.49Å; F320-L325 HydrophobicContact CD2-CD2 4.27Å; F320-L325 HydrophobicContact CD2-CG 4.1Å; F320-L325 HydrophobicContact CE2-CD1 3.64Å; F320-L325 HydrophobicContact CE2-CD2 3.82Å; F320-L325 HydrophobicContact CE2-CG 3.67Å; F320-L325 HydrophobicContact CZ-CD1 4.38Å; F320-L325 HydrophobicContact CZ-CD2 4.37Å; F320-L333 HydrophobicContact CZ-CD2 4.26Å; F320-L355 HydrophobicContact CD2-CB 4.18Å; F320-L355 HydrophobicContact CE2-CB 3.78Å; F320-L355 HydrophobicContact CE2-CD1 3.9Å; F320-L355 HydrophobicContact CE2-CG 4.42Å; F320-L355 HydrophobicContact CZ-CB 4.28Å; F320-L355 PolarHBondContact N-O 3.37Å; F320-L355 PolarHBondContact O-N 2.78Å
321	R	94.2	Very high	95.7	Very high	115 Å²	115	68.4 Å²	68.4	43%	0.434	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	145.6	176.5	-59.7	171.4	178.8	-153	-12.6	110.2	N323 E324 E352	R321-N323 WeakPolarHBondContact CB-OD1 3.42Å; R321-N323 PolarHBondContact O-N 3.04Å; R321-N323 VanDerWaalsContact O-N 3.15Å; R321-E324 HydrophobicContact CB-CG 4.16Å; R321-E324 WeakPolarHBondContact CB-OE1 3.45Å; R321-E324 WeakPolarHBondContact CG-OE1 3.17Å; R321-E324 PolarHBondContact N-OE1 3.4Å; R321-E324 WeakPolarHBondContact O-CB 3.46Å; R321-E324 PolarHBondContact O-N 3.33Å; R321-E352 VanDerWaalsContact CD-OE2 3.26Å; R321-E352 WeakPolarHBondContact CD-OE2 3.48Å; R321-E352 IonicContact CZ-OE1 3.57Å; R321-E352 IonicContact CZ-OE2 2.81Å; R321-E352 IonicContact NE-OE2 3.05Å; R321-E352 PolarHBondContact NE-OE2 3.26Å; R321-E352 VanDerWaalsContact NH1-CD 3.25Å; R321-E352 IonicContact NH1-OE1 2.81Å; R321-E352 PolarHBondContact NH1-OE1 3.27Å; R321-E352 IonicContact NH1-OE2 2.91Å; R321-E352 PolarHBondContact NH1-OE2 3.48Å; R321-E352 IonicContact NH2-OE2 3.31Å; R321-E352 PolarHBondContact NH2-OE2 2.85Å
322	A	93.2	Very high	95.8	Very high	39 Å²	39	66.4 Å²	66.4	32%	0.322	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-60.3	-27.6	-178.7	0	0	0	0	0	113.2	E324 L325 T353 L355	A322-E324 VanDerWaalsContact C-N 3.31Å; A322-L325 PolarHBondContact O-N 3.12Å; A322-T353 HydrophobicContact CB-CG2 4.23Å; A322-T353 WeakPolarHBondContact CB-O 3.29Å; A322-T353 PolarHBondContact N-O 3.28Å; A322-L355 HydrophobicContact CB-CD1 3.97Å; A322-L355 HydrophobicContact CB-CG 4.07Å
323	N	92	Very high	95.8	Very high	116 Å²	116	60.8 Å²	60.8	62%	0.62	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-76.6	-12.5	177.1	63.9	-11	0	0	0	114	R321 L325	R321-N323 WeakPolarHBondContact CB-OD1 3.42Å; R321-N323 PolarHBondContact O-N 3.04Å; R321-N323 VanDerWaalsContact O-N 3.15Å; N323-L325 VanDerWaalsContact C-N 3.25Å
324	E	92.5	Very high	95.8	Very high	108 Å²	108	63.6 Å²	63.6	51%	0.505	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-74.7	-18.6	172	-65.2	173.5	-124.3	0	0	111.8	R321 A322	R321-E324 HydrophobicContact CB-CG 4.16Å; R321-E324 WeakPolarHBondContact CB-OE1 3.45Å; R321-E324 WeakPolarHBondContact CG-OE1 3.17Å; R321-E324 PolarHBondContact N-OE1 3.4Å; R321-E324 WeakPolarHBondContact O-CB 3.46Å; R321-E324 PolarHBondContact O-N 3.33Å; A322-E324 VanDerWaalsContact C-N 3.31Å
325	L	94.5	Very high	95.8	Very high	21 Å²	21	67.2 Å²	67.2	11%	0.11	34%	0.34	C	S	.	.	S	Bend	trans	-83.6	128	177.8	-69.1	-174.1	0	0	0	111.7	I296 F320 A322 N323 L333 L355	I296-L325 HydrophobicContact CD1-CD2 3.79Å; F320-L325 HydrophobicContact CD2-CD1 4.49Å; F320-L325 HydrophobicContact CD2-CD2 4.27Å; F320-L325 HydrophobicContact CD2-CG 4.1Å; F320-L325 HydrophobicContact CE2-CD1 3.64Å; F320-L325 HydrophobicContact CE2-CD2 3.82Å; F320-L325 HydrophobicContact CE2-CG 3.67Å; F320-L325 HydrophobicContact CZ-CD1 4.38Å; F320-L325 HydrophobicContact CZ-CD2 4.37Å; A322-L325 PolarHBondContact O-N 3.12Å; N323-L325 VanDerWaalsContact C-N 3.25Å; L325-L333 HydrophobicContact CD1-CD2 3.93Å; L325-L355 HydrophobicContact CD1-CD1 3.93Å
326	T	95.8	Very high	95.8	Very high	87 Å²	87	66.5 Å²	66.5	53%	0.534	34%	0.338	S	S	.	.			trans	-63.4	161.6	163.5	65	0	0	0	0	110.6	F328 G329 S330	T326-F328 PolarHBondContact O-N 3.42Å; T326-G329 WeakPolarHBondContact O-CA 3.35Å; T326-G329 PolarHBondContact O-N 3.03Å; T326-G329 PolarHBondContact OG1-N 3.38Å; T326-S330 PolarHBondContact O-N 3.35Å
327	Q	95.4	Very high	95.9	Very high	148 Å²	148	69.5 Å²	69.5	69%	0.692	35%	0.35	S	S	*	.	H	α-helix	trans	-56.8	-37	174.8	-167	-172	18.6	0	0	112	K331	Q327-K331 WeakPolarHBondContact O-CG 3.3Å; Q327-K331 PolarHBondContact O-N 2.86Å; Q327-K331 VanDerWaalsContact O-N 3.08Å
328	F	96.3	Very high	95.9	Very high	137 Å²	137	75.5 Å²	75.5	60%	0.601	37%	0.372	S	S	*	.	H	α-helix	trans	-65.9	-43.7	174.1	179.1	-109.1	0	0	0	111.9	V295 T326 K331 T332	V295-F328 HydrophobicContact CG1-CD1 3.66Å; V295-F328 HydrophobicContact CG1-CE1 3.73Å; V295-F328 HydrophobicContact CG2-CD1 4.3Å; V295-F328 HydrophobicContact CG2-CE1 3.96Å; T326-F328 PolarHBondContact O-N 3.42Å; F328-K331 PolarHBondContact O-N 3.21Å; F328-T332 WeakPolarHBondContact O-CB 3.2Å; F328-T332 PolarHBondContact O-N 2.92Å; F328-T332 PolarHBondContact O-OG1 3.43Å
329	G	96.9	Very high	96	Very high	0 Å²	0	81.3 Å²	81.3	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-60.7	-44.6	174.9	0	0	0	0	0	112.8	I296 T326 T332 L333	I296-G329 WeakPolarHBondContact CD1-O 3.23Å; T326-G329 WeakPolarHBondContact O-CA 3.35Å; T326-G329 PolarHBondContact O-N 3.03Å; T326-G329 PolarHBondContact OG1-N 3.38Å; G329-T332 WeakPolarHBondContact O-CB 3.44Å; G329-T332 PolarHBondContact O-N 3.25Å; G329-L333 PolarHBondContact O-N 3.37Å
330	S	96.4	Very high	96	Very high	59 Å²	59	76.2 Å²	76.2	41%	0.413	38%	0.378	S	S	.	.	H	α-helix	trans	-60.8	-47.8	176.1	-178	0	0	0	0	112.3	T326 T332 L333 S334	T326-S330 PolarHBondContact O-N 3.35Å; S330-T332 VanDerWaalsContact C-N 3.31Å; S330-T332 PolarHBondContact O-N 3.2Å; S330-L333 PolarHBondContact O-N 3.5Å; S330-S334 PolarHBondContact O-N 3.36Å; S330-S334 PolarHBondContact O-OG 2.89Å
331	K	97.2	Very high	96.1	Very high	133 Å²	133	78.6 Å²	78.6	58%	0.578	39%	0.391	S	S	*	.	H	α-helix	trans	-61.1	-39.6	175.4	-73.6	178.7	-179	178.4	0	112.2	Q327 F328 F335	Q327-K331 WeakPolarHBondContact O-CG 3.3Å; Q327-K331 PolarHBondContact O-N 2.86Å; Q327-K331 VanDerWaalsContact O-N 3.08Å; F328-K331 PolarHBondContact O-N 3.21Å; K331-F335 WeakPolarHBondContact O-CB 3.36Å; K331-F335 PolarHBondContact O-N 3.14Å
332	T	97.5	Very high	96.3	Very high	20 Å²	20	73.2 Å²	73.2	12%	0.123	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-49.4	176.1	-58.3	0	0	0	0	110.5	P290 F328 G329 S330 S334 F335 F336	P290-T332 HydrophobicContact CB-CG2 4.05Å; P290-T332 HydrophobicContact CG-CG2 3.98Å; F328-T332 WeakPolarHBondContact O-CB 3.2Å; F328-T332 PolarHBondContact O-N 2.92Å; F328-T332 PolarHBondContact O-OG1 3.43Å; G329-T332 WeakPolarHBondContact O-CB 3.44Å; G329-T332 PolarHBondContact O-N 3.25Å; S330-T332 VanDerWaalsContact C-N 3.31Å; S330-T332 PolarHBondContact O-N 3.2Å; T332-S334 PolarHBondContact O-N 3.17Å; T332-F335 WeakPolarHBondContact O-CB 3.35Å; T332-F335 PolarHBondContact O-N 3.36Å; T332-F336 HydrophobicContact CG2-CD2 3.99Å; T332-F336 HydrophobicContact CG2-CE2 3.86Å; T332-F336 VanDerWaalsContact O-CD2 3.3Å; T332-F336 WeakPolarHBondContact O-CD2 3.42Å; T332-F336 PolarHBondContact O-N 3.24Å
333	L	97.8	Very high	96.5	Very high	7 Å²	7	72.3 Å²	72.3	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-58.4	-47.7	178	-176.6	60.8	0	0	0	111.8	I296 F320 L325 G329 S330 F335 F336 E337 V342 V344 L355 C357 F360	I296-L333 HydrophobicContact CD1-CB 3.99Å; F320-L333 HydrophobicContact CZ-CD2 4.26Å; L325-L333 HydrophobicContact CD1-CD2 3.93Å; G329-L333 PolarHBondContact O-N 3.37Å; S330-L333 PolarHBondContact O-N 3.5Å; L333-F335 VanDerWaalsContact C-N 3.3Å; L333-F335 PolarHBondContact O-N 3.48Å; L333-F336 PolarHBondContact O-N 3.11Å; L333-E337 WeakPolarHBondContact O-CB 3.4Å; L333-E337 PolarHBondContact O-N 3.22Å; L333-V342 HydrophobicContact CD1-CG2 4.17Å; L333-V344 HydrophobicContact CD1-CG2 3.78Å; L333-V344 HydrophobicContact CD2-CG1 4.34Å; L333-V344 HydrophobicContact CD2-CG2 4.45Å; L333-V344 HydrophobicContact CG-CG2 4.06Å; L333-L355 HydrophobicContact CD2-CD1 4.23Å; L333-C357 HydrophobicContact CD1-CB 3.91Å; L333-F360 HydrophobicContact CD1-CE2 4.38Å; L333-F360 HydrophobicContact CD1-CZ 3.97Å
334	S	97.3	Very high	96.8	Very high	60 Å²	60	68 Å²	68	42%	0.42	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-34.4	177.5	-64.2	0	0	0	0	113	S330 T332 K338	S330-S334 PolarHBondContact O-N 3.36Å; S330-S334 PolarHBondContact O-OG 2.89Å; T332-S334 PolarHBondContact O-N 3.17Å; S334-K338 VanDerWaalsContact O-CB 3.24Å; S334-K338 WeakPolarHBondContact O-CB 3.28Å; S334-K338 PolarHBondContact O-N 3.19Å
335	F	97.6	Very high	96.9	Very high	113 Å²	113	70 Å²	70	50%	0.496	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-53.2	173.2	175.8	-88.1	0	0	0	110.8	K331 T332 L333 E337 K338 F339	K331-F335 WeakPolarHBondContact O-CB 3.36Å; K331-F335 PolarHBondContact O-N 3.14Å; T332-F335 WeakPolarHBondContact O-CB 3.35Å; T332-F335 PolarHBondContact O-N 3.36Å; L333-F335 VanDerWaalsContact C-N 3.3Å; L333-F335 PolarHBondContact O-N 3.48Å; F335-E337 VanDerWaalsContact C-N 3.3Å; F335-E337 PolarHBondContact O-N 2.96Å; F335-K338 PolarHBondContact O-N 3.45Å; F335-F339 HydrophobicContact CD1-CD2 4.17Å; F335-F339 AromaticContact CD2-CD2 3.98Å; F335-F339 HydrophobicContact CD2-CD2 3.98Å; F335-F339 AromaticContact CD2-CE2 3.64Å; F335-F339 HydrophobicContact CD2-CE2 3.64Å; F335-F339 AromaticContact CE1-CD2 3.94Å; F335-F339 HydrophobicContact CE1-CD2 3.94Å; F335-F339 HydrophobicContact CE1-CE2 4.24Å; F335-F339 AromaticContact CE2-CD2 3.77Å; F335-F339 HydrophobicContact CE2-CD2 3.77Å; F335-F339 AromaticContact CE2-CE2 3.24Å; F335-F339 HydrophobicContact CE2-CE2 3.24Å; F335-F339 HydrophobicContact CE2-CZ 4.15Å; F335-F339 HydrophobicContact CG-CD2 4.18Å; F335-F339 HydrophobicContact CG-CE2 4.31Å; F335-F339 AromaticContact CZ-CD2 3.73Å; F335-F339 HydrophobicContact CZ-CD2 3.73Å; F335-F339 AromaticContact CZ-CE2 3.57Å; F335-F339 HydrophobicContact CZ-CE2 3.57Å; F335-F339 HydrophobicContact CZ-CZ 4.41Å; F335-F339 VanDerWaalsContact O-CD2 3.28Å; F335-F339 WeakPolarHBondContact O-CD2 3.18Å; F335-F339 PolarHBondContact O-N 3.41Å; F335-F339 VanDerWaalsContact O-N 3.14Å
336	F	98	Very high	97	Very high	27 Å²	27	76.5 Å²	76.5	12%	0.118	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-36.2	-179.2	-81.7	-107.7	0	0	0	112.3	L287 P290 T332 L333 G340 L341 V342 F360	L287-F336 HydrophobicContact CD1-CD1 3.81Å; L287-F336 HydrophobicContact CD1-CE1 3.63Å; P290-F336 HydrophobicContact CG-CE1 4.4Å; P290-F336 HydrophobicContact CG-CE2 3.85Å; P290-F336 HydrophobicContact CG-CZ 3.72Å; T332-F336 HydrophobicContact CG2-CD2 3.99Å; T332-F336 HydrophobicContact CG2-CE2 3.86Å; T332-F336 VanDerWaalsContact O-CD2 3.3Å; T332-F336 WeakPolarHBondContact O-CD2 3.42Å; T332-F336 PolarHBondContact O-N 3.24Å; L333-F336 PolarHBondContact O-N 3.11Å; F336-G340 PolarHBondContact O-N 3.33Å; F336-L341 HydrophobicContact CB-CB 4.35Å; F336-L341 HydrophobicContact CD1-CB 3.88Å; F336-L341 HydrophobicContact CD1-CD1 3.75Å; F336-L341 HydrophobicContact CD1-CG 4.49Å; F336-L341 HydrophobicContact CE1-CD1 4.06Å; F336-L341 HydrophobicContact CG-CD1 4.44Å; F336-L341 WeakPolarHBondContact O-CB 3.37Å; F336-L341 PolarHBondContact O-N 3.01Å; F336-V342 HydrophobicContact CB-CG1 4.35Å; F336-V342 HydrophobicContact CB-CG2 3.73Å; F336-V342 PolarHBondContact O-N 2.7Å; F336-F360 HydrophobicContact CB-CE1 4.05Å; F336-F360 HydrophobicContact CB-CZ 4.48Å; F336-F360 AromaticContact CD1-CD1 3.91Å; F336-F360 HydrophobicContact CD1-CD1 3.91Å; F336-F360 AromaticContact CD1-CE1 3.65Å; F336-F360 HydrophobicContact CD1-CE1 3.65Å; F336-F360 HydrophobicContact CD2-CE1 4.2Å; F336-F360 HydrophobicContact CE1-CD1 4.08Å; F336-F360 HydrophobicContact CE1-CE1 4.12Å; F336-F360 HydrophobicContact CG-CD1 4.43Å; F336-F360 AromaticContact CG-CE1 3.71Å; F336-F360 HydrophobicContact CG-CE1 3.71Å
337	E	97.5	Very high	96.9	Very high	78 Å²	78	77.6 Å²	77.6	36%	0.364	37%	0.369	S	S	.	.	H	α-helix	trans	-63.3	-48.6	173.8	-177.1	-178.5	-160.9	0	0	111.4	L333 F335 F339 G340 V342 V344	L333-E337 WeakPolarHBondContact O-CB 3.4Å; L333-E337 PolarHBondContact O-N 3.22Å; F335-E337 VanDerWaalsContact C-N 3.3Å; F335-E337 PolarHBondContact O-N 2.96Å; E337-F339 VanDerWaalsContact C-N 3.27Å; E337-F339 PolarHBondContact O-N 3.03Å; E337-G340 WeakPolarHBondContact O-CA 3.41Å; E337-G340 PolarHBondContact O-N 3.22Å; E337-V342 HydrophobicContact CB-CG2 4.44Å; E337-V344 HydrophobicContact CB-CG2 3.92Å; E337-V344 HydrophobicContact CG-CB 4.28Å; E337-V344 HydrophobicContact CG-CG2 3.93Å
338	K	97.5	Very high	96.7	Very high	178 Å²	178	76.9 Å²	76.9	77%	0.774	37%	0.368	S	S	*	.	H	α-helix	trans	-57.3	-39.6	179.6	-179.9	-178.7	178	-178.7	0	112.4	S334 F335 G340	S334-K338 VanDerWaalsContact O-CB 3.24Å; S334-K338 WeakPolarHBondContact O-CB 3.28Å; S334-K338 PolarHBondContact O-N 3.19Å; F335-K338 PolarHBondContact O-N 3.45Å; K338-G340 PolarHBondContact O-N 2.84Å
339	F	97.3	Very high	96.4	Very high	125 Å²	125	75 Å²	75	55%	0.548	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	5.3	177	-74.4	-78.4	0	0	0	113.5	F335 E337 L341	F335-F339 HydrophobicContact CD1-CD2 4.17Å; F335-F339 AromaticContact CD2-CD2 3.98Å; F335-F339 HydrophobicContact CD2-CD2 3.98Å; F335-F339 AromaticContact CD2-CE2 3.64Å; F335-F339 HydrophobicContact CD2-CE2 3.64Å; F335-F339 AromaticContact CE1-CD2 3.94Å; F335-F339 HydrophobicContact CE1-CD2 3.94Å; F335-F339 HydrophobicContact CE1-CE2 4.24Å; F335-F339 AromaticContact CE2-CD2 3.77Å; F335-F339 HydrophobicContact CE2-CD2 3.77Å; F335-F339 AromaticContact CE2-CE2 3.24Å; F335-F339 HydrophobicContact CE2-CE2 3.24Å; F335-F339 HydrophobicContact CE2-CZ 4.15Å; F335-F339 HydrophobicContact CG-CD2 4.18Å; F335-F339 HydrophobicContact CG-CE2 4.31Å; F335-F339 AromaticContact CZ-CD2 3.73Å; F335-F339 HydrophobicContact CZ-CD2 3.73Å; F335-F339 AromaticContact CZ-CE2 3.57Å; F335-F339 HydrophobicContact CZ-CE2 3.57Å; F335-F339 HydrophobicContact CZ-CZ 4.41Å; F335-F339 VanDerWaalsContact O-CD2 3.28Å; F335-F339 WeakPolarHBondContact O-CD2 3.18Å; F335-F339 PolarHBondContact O-N 3.41Å; F335-F339 VanDerWaalsContact O-N 3.14Å; E337-F339 VanDerWaalsContact C-N 3.27Å; E337-F339 PolarHBondContact O-N 3.03Å; F339-L341 HydrophobicContact CB-CD1 4.39Å; F339-L341 HydrophobicContact CB-CG 4.15Å; F339-L341 PolarHBondContact O-N 3.14Å
340	G	96.7	Very high	96	Very high	22 Å²	22	78.2 Å²	78.2	23%	0.227	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	17.1	177.7	0	0	0	0	0	114.2	F336 E337 K338 K368	F336-G340 PolarHBondContact O-N 3.33Å; E337-G340 WeakPolarHBondContact O-CA 3.41Å; E337-G340 PolarHBondContact O-N 3.22Å; K338-G340 PolarHBondContact O-N 2.84Å; G340-K368 WeakPolarHBondContact O-CE 3.31Å; G340-K368 PolarHBondContact O-NZ 2.78Å
341	L	97.7	Very high	95.6	Very high	57 Å²	57	85.1 Å²	85.1	30%	0.298	42%	0.42	S	S	.	.	S	Bend	trans	-79.6	-23	-179.9	-61.1	179.3	0	0	0	112.6	L287 F336 F339 L365	L287-L341 HydrophobicContact CD1-CB 4.31Å; F336-L341 HydrophobicContact CB-CB 4.35Å; F336-L341 HydrophobicContact CD1-CB 3.88Å; F336-L341 HydrophobicContact CD1-CD1 3.75Å; F336-L341 HydrophobicContact CD1-CG 4.49Å; F336-L341 HydrophobicContact CE1-CD1 4.06Å; F336-L341 HydrophobicContact CG-CD1 4.44Å; F336-L341 WeakPolarHBondContact O-CB 3.37Å; F336-L341 PolarHBondContact O-N 3.01Å; F339-L341 HydrophobicContact CB-CD1 4.39Å; F339-L341 HydrophobicContact CB-CG 4.15Å; F339-L341 PolarHBondContact O-N 3.14Å; L341-L365 HydrophobicContact CD2-CD2 4.15Å; L341-L365 WeakPolarHBondContact O-CD1 3.44Å
342	V	97.7	Very high	95.3	Very high	3 Å²	3	82 Å²	82	2%	0.018	41%	0.408	C	S	.	.	S	Bend	trans	-138.3	150.3	175.1	-60.8	0	0	0	0	110.9	L333 F336 E337 V344 S358 F360 K368	L333-V342 HydrophobicContact CD1-CG2 4.17Å; F336-V342 HydrophobicContact CB-CG1 4.35Å; F336-V342 HydrophobicContact CB-CG2 3.73Å; F336-V342 PolarHBondContact O-N 2.7Å; E337-V342 HydrophobicContact CB-CG2 4.44Å; V342-V344 HydrophobicContact CG2-CG2 4.11Å; V342-S358 VanDerWaalsContact CA-OG 3.28Å; V342-S358 WeakPolarHBondContact CA-OG 3.46Å; V342-S358 WeakPolarHBondContact CB-OG 3.36Å; V342-F360 HydrophobicContact CB-CE2 4.44Å; V342-F360 HydrophobicContact CB-CZ 4.43Å; V342-F360 HydrophobicContact CG1-CD1 3.99Å; V342-F360 HydrophobicContact CG1-CD2 3.9Å; V342-F360 HydrophobicContact CG1-CE1 3.84Å; V342-F360 HydrophobicContact CG1-CE2 3.74Å; V342-F360 HydrophobicContact CG1-CG 4.02Å; V342-F360 HydrophobicContact CG1-CZ 3.71Å; V342-F360 HydrophobicContact CG2-CZ 4.18Å; V342-K368 VanDerWaalsContact O-CE 3.25Å; V342-K368 WeakPolarHBondContact O-CE 2.97Å
343	A	97.3	Very high	95.1	Very high	20 Å²	20	84 Å²	84	17%	0.165	42%	0.42	C	S	.	.			trans	-90.2	137	168.9	0	0	0	0	0	108.1	Y315 C357 S358 K368	Y315-A343 HydrophobicContact CE2-CB 4.12Å; A343-C357 CarbonylContact O-C 3.59Å; A343-C357 WeakPolarHBondContact O-CA 3.1Å; A343-S358 PolarHBondContact N-OG 2.83Å; A343-S358 PolarHBondContact O-N 3.26Å; A343-K368 HydrophobicContact CB-CD 4.1Å; A343-K368 HydrophobicContact CB-CG 4.42Å
344	V	97.5	Very high	95	Very high	24 Å²	24	84.5 Å²	84.5	15%	0.145	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.6	175.2	-174.8	0	0	0	0	108.9	L333 E337 V342 E356 C357	L333-V344 HydrophobicContact CD1-CG2 3.78Å; L333-V344 HydrophobicContact CD2-CG1 4.34Å; L333-V344 HydrophobicContact CD2-CG2 4.45Å; L333-V344 HydrophobicContact CG-CG2 4.06Å; E337-V344 HydrophobicContact CB-CG2 3.92Å; E337-V344 HydrophobicContact CG-CB 4.28Å; E337-V344 HydrophobicContact CG-CG2 3.93Å; V342-V344 HydrophobicContact CG2-CG2 4.11Å; V344-E356 CarbonylContact C-O 3.45Å; V344-E356 VanDerWaalsContact CA-O 3.28Å; V344-E356 WeakPolarHBondContact CA-O 3.07Å; V344-C357 HydrophobicContact CG2-CB 4.16Å
345	R	96.1	Very high	95	Very high	152 Å²	152	82.3 Å²	82.3	57%	0.574	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.6	173.2	-62.5	-178.7	-180	-163.1	-2	108.7	L355 E356	R345-L355 WeakPolarHBondContact O-CA 3.37Å; R345-E356 HydrophobicContact CB-CB 4.29Å; R345-E356 PolarHBondContact N-O 2.79Å; R345-E356 PolarHBondContact O-N 2.87Å
346	K	95.5	Very high	94.9	Very high	157 Å²	157	79.1 Å²	79.1	68%	0.683	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.5	176.8	-52.5	-168.7	178.7	171.4	0	108.4	L355	K346-L355 HydrophobicContact CB-CD2 4.23Å; K346-L355 HydrophobicContact CD-CD2 4.06Å; K346-L355 HydrophobicContact CG-CD2 3.6Å
347	K	93.5	Very high	94.9	Very high	109 Å²	109	77.8 Å²	77.8	47%	0.474	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.1	174.6	-170.6	-176.3	176.8	-160.3	0	108.5	E349 V354	K347-E349 HydrophobicContact CD-CG 4.16Å; K347-E349 WeakPolarHBondContact CE-OE1 3.49Å; K347-E349 HydrophobicContact CG-CG 4.29Å; K347-E349 IonicContact NZ-OE1 2.71Å; K347-E349 PolarHBondContact NZ-OE1 2.68Å; K347-V354 PolarHBondContact N-O 2.96Å; K347-V354 PolarHBondContact O-N 3.48Å
348	I	92	Very high	94.9	Very high	133 Å²	133	74.1 Å²	74.1	68%	0.682	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	120.6	174.2	-58.6	173.3	0	0	0	107	G350	I348-G350 WeakPolarHBondContact CG2-O 3.41Å
349	E	89.8	Confident	94.9	Very high	97 Å²	97	65.8 Å²	65.8	45%	0.453	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	100.1	174	-65.6	-167.2	165.5	0	0	108.5	K347 H351 E352 V354	K347-E349 HydrophobicContact CD-CG 4.16Å; K347-E349 WeakPolarHBondContact CE-OE1 3.49Å; K347-E349 HydrophobicContact CG-CG 4.29Å; K347-E349 IonicContact NZ-OE1 2.71Å; K347-E349 PolarHBondContact NZ-OE1 2.68Å; E349-H351 PolarHBondContact O-N 2.93Å; E349-E352 PolarHBondContact N-O 3.42Å; E349-E352 PolarHBondContact O-N 2.84Å; E349-E352 VanDerWaalsContact O-N 3.07Å; E349-V354 HydrophobicContact CB-CG2 4.25Å; E349-V354 HydrophobicContact CG-CG2 4.09Å
350	G	88.6	Confident	94.9	Very high	69 Å²	69	59.9 Å²	59.9	71%	0.711	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	-118.9	-173	0	0	0	0	0	111.7	I348	I348-G350 WeakPolarHBondContact CG2-O 3.41Å
351	H	87.5	Confident	94.9	Very high	203 Å²	203	59.1 Å²	59.1	94%	0.94	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-1.7	177.2	-63.9	-64.8	0	0	0	113.8	E349	E349-H351 PolarHBondContact O-N 2.93Å
352	E	90.2	Very high	95	Very high	69 Å²	69	57.3 Å²	57.3	32%	0.322	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146	-175.4	-65.4	-174.9	171.7	0	0	111.8	R321 E349	R321-E352 VanDerWaalsContact CD-OE2 3.26Å; R321-E352 WeakPolarHBondContact CD-OE2 3.48Å; R321-E352 IonicContact CZ-OE1 3.57Å; R321-E352 IonicContact CZ-OE2 2.81Å; R321-E352 IonicContact NE-OE2 3.05Å; R321-E352 PolarHBondContact NE-OE2 3.26Å; R321-E352 VanDerWaalsContact NH1-CD 3.25Å; R321-E352 IonicContact NH1-OE1 2.81Å; R321-E352 PolarHBondContact NH1-OE1 3.27Å; R321-E352 IonicContact NH1-OE2 2.91Å; R321-E352 PolarHBondContact NH1-OE2 3.48Å; R321-E352 IonicContact NH2-OE2 3.31Å; R321-E352 PolarHBondContact NH2-OE2 2.85Å; E349-E352 PolarHBondContact N-O 3.42Å; E349-E352 PolarHBondContact O-N 2.84Å; E349-E352 VanDerWaalsContact O-N 3.07Å
353	T	94	Very high	95	Very high	61 Å²	61	57.3 Å²	57.3	37%	0.374	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117.4	171.3	-57.9	0	0	0	0	109.1	A322 L355	A322-T353 HydrophobicContact CB-CG2 4.23Å; A322-T353 WeakPolarHBondContact CB-O 3.29Å; A322-T353 PolarHBondContact N-O 3.28Å; T353-L355 HydrophobicContact CG2-CD2 4.17Å
354	V	95.7	Very high	95	Very high	18 Å²	18	56.4 Å²	56.4	11%	0.109	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.9	172.7	-178.9	0	0	0	0	108.9	K347 E349	K347-V354 PolarHBondContact N-O 2.96Å; K347-V354 PolarHBondContact O-N 3.48Å; E349-V354 HydrophobicContact CB-CG2 4.25Å; E349-V354 HydrophobicContact CG-CG2 4.09Å
355	L	96.6	Very high	95.1	Very high	14 Å²	14	56.2 Å²	56.2	7%	0.073	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134.7	176.7	-59.9	178.9	0	0	0	109.3	Q319 F320 A322 L325 L333 R345 K346 T353	Q319-L355 WeakPolarHBondContact CA-O 3.37Å; F320-L355 HydrophobicContact CD2-CB 4.18Å; F320-L355 HydrophobicContact CE2-CB 3.78Å; F320-L355 HydrophobicContact CE2-CD1 3.9Å; F320-L355 HydrophobicContact CE2-CG 4.42Å; F320-L355 HydrophobicContact CZ-CB 4.28Å; F320-L355 PolarHBondContact N-O 3.37Å; F320-L355 PolarHBondContact O-N 2.78Å; A322-L355 HydrophobicContact CB-CD1 3.97Å; A322-L355 HydrophobicContact CB-CG 4.07Å; L325-L355 HydrophobicContact CD1-CD1 3.93Å; L333-L355 HydrophobicContact CD2-CD1 4.23Å; R345-L355 WeakPolarHBondContact O-CA 3.37Å; K346-L355 HydrophobicContact CB-CD2 4.23Å; K346-L355 HydrophobicContact CD-CD2 4.06Å; K346-L355 HydrophobicContact CG-CD2 3.6Å; T353-L355 HydrophobicContact CG2-CD2 4.17Å
356	E	95.9	Very high	95.2	Very high	45 Å²	45	49.4 Å²	49.4	21%	0.21	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128	164.7	-41.6	-169.5	135.8	0	0	108.3	V317 A318 Q319 V344 R345	V317-E356 HydrophobicContact CB-CB 4.46Å; A318-E356 WeakPolarHBondContact O-CA 3.47Å; Q319-E356 HydrophobicContact CG-CB 4.42Å; Q319-E356 HydrophobicContact CG-CG 4.02Å; Q319-E356 PolarHBondContact NE2-OE1 2.95Å; V344-E356 CarbonylContact C-O 3.45Å; V344-E356 VanDerWaalsContact CA-O 3.28Å; V344-E356 WeakPolarHBondContact CA-O 3.07Å; R345-E356 HydrophobicContact CB-CB 4.29Å; R345-E356 PolarHBondContact N-O 2.79Å; R345-E356 PolarHBondContact O-N 2.87Å
357	C	97.5	Very high	95.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.4	170.1	69.3	0	0	0	0	111.8	V317 A318 L333 A343 V344 N359	V317-C357 CarbonylContact C-O 3.54Å; V317-C357 WeakPolarHBondContact CA-O 3.48Å; V317-C357 WeakPolarHBondContact CB-O 3.44Å; A318-C357 PolarHBondContact N-O 2.85Å; A318-C357 PolarHBondContact O-N 2.91Å; L333-C357 HydrophobicContact CD1-CB 3.91Å; A343-C357 CarbonylContact O-C 3.59Å; A343-C357 WeakPolarHBondContact O-CA 3.1Å; V344-C357 HydrophobicContact CG2-CB 4.16Å; C357-N359 PolarHBondContact O-N 3.14Å
358	S	97.7	Very high	95.5	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	140.2	171.3	61.2	0	0	0	0	110.3	S316 V342 A343 F360	S316-S358 CarbonylContact O-C 3.58Å; S316-S358 WeakPolarHBondContact O-CA 3.35Å; V342-S358 VanDerWaalsContact CA-OG 3.28Å; V342-S358 WeakPolarHBondContact CA-OG 3.46Å; V342-S358 WeakPolarHBondContact CB-OG 3.36Å; A343-S358 PolarHBondContact N-OG 2.83Å; A343-S358 PolarHBondContact O-N 3.26Å; S358-F360 WeakPolarHBondContact O-CD2 3.4Å
359	N	97.8	Very high	95.8	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.016	21%	0.209	C	C	.	.			trans	-59.8	145.8	177.8	-82.4	-51.9	0	0	0	112	Q291 P299 R302 S316 C357 T361 N364	Q291-N359 PolarHBondContact NE2-OD1 2.97Å; P299-N359 WeakPolarHBondContact CD-OD1 3.34Å; P299-N359 WeakPolarHBondContact CG-OD1 3.16Å; R302-N359 HydrophobicContact CB-CB 4.2Å; R302-N359 HydrophobicContact CG-CB 4.36Å; S316-N359 PolarHBondContact O-N 3.26Å; S316-N359 PolarHBondContact OG-ND2 3.45Å; C357-N359 PolarHBondContact O-N 3.14Å; N359-T361 VanDerWaalsContact C-N 3.31Å; N359-T361 PolarHBondContact O-N 2.94Å; N359-N364 WeakPolarHBondContact CB-ND2 3.47Å; N359-N364 WeakPolarHBondContact O-CB 3.5Å
360	F	97.8	Very high	96.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	-87.5	69.5	-169.7	-74.4	-123.5	0	0	0	110.1	L287 S288 P290 Q291 I296 L333 F336 V342 S358	L287-F360 HydrophobicContact CD1-CD1 4.33Å; L287-F360 HydrophobicContact CG-CB 4.45Å; L287-F360 WeakPolarHBondContact O-CB 3.41Å; L287-F360 WeakPolarHBondContact O-CD1 3.11Å; S288-F360 VanDerWaalsContact CA-O 3.23Å; S288-F360 WeakPolarHBondContact CA-O 3.13Å; S288-F360 PolarHBondContact N-O 2.95Å; S288-F360 PolarHBondContact OG-O 3.01Å; P290-F360 HydrophobicContact CB-CD1 4.2Å; P290-F360 HydrophobicContact CB-CE1 4.07Å; P290-F360 HydrophobicContact CG-CD1 4Å; P290-F360 HydrophobicContact CG-CE1 4.01Å; Q291-F360 HydrophobicContact CG-CB 4.03Å; Q291-F360 HydrophobicContact CG-CD2 3.79Å; Q291-F360 HydrophobicContact CG-CE2 4.49Å; Q291-F360 HydrophobicContact CG-CG 4.02Å; I296-F360 HydrophobicContact CG1-CZ 4.25Å; I296-F360 HydrophobicContact CG2-CE2 4.26Å; L333-F360 HydrophobicContact CD1-CE2 4.38Å; L333-F360 HydrophobicContact CD1-CZ 3.97Å; F336-F360 HydrophobicContact CB-CE1 4.05Å; F336-F360 HydrophobicContact CB-CZ 4.48Å; F336-F360 AromaticContact CD1-CD1 3.91Å; F336-F360 HydrophobicContact CD1-CD1 3.91Å; F336-F360 AromaticContact CD1-CE1 3.65Å; F336-F360 HydrophobicContact CD1-CE1 3.65Å; F336-F360 HydrophobicContact CD2-CE1 4.2Å; F336-F360 HydrophobicContact CE1-CD1 4.08Å; F336-F360 HydrophobicContact CE1-CE1 4.12Å; F336-F360 HydrophobicContact CG-CD1 4.43Å; F336-F360 AromaticContact CG-CE1 3.71Å; F336-F360 HydrophobicContact CG-CE1 3.71Å; V342-F360 HydrophobicContact CB-CE2 4.44Å; V342-F360 HydrophobicContact CB-CZ 4.43Å; V342-F360 HydrophobicContact CG1-CD1 3.99Å; V342-F360 HydrophobicContact CG1-CD2 3.9Å; V342-F360 HydrophobicContact CG1-CE1 3.84Å; V342-F360 HydrophobicContact CG1-CE2 3.74Å; V342-F360 HydrophobicContact CG1-CG 4.02Å; V342-F360 HydrophobicContact CG1-CZ 3.71Å; V342-F360 HydrophobicContact CG2-CZ 4.18Å; S358-F360 WeakPolarHBondContact O-CD2 3.4Å
361	T	97.7	Very high	96.6	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.037	19%	0.192	C	C	.	.	S	Bend	trans	-138.2	155.5	174.5	69.6	0	0	0	0	110.5	N284 L287 R302 N359 I363 N364 L365	N284-T361 WeakPolarHBondContact OD1-CA 3.16Å; N284-T361 WeakPolarHBondContact OD1-CB 3.4Å; L287-T361 VanDerWaalsContact CD2-C 3.48Å; R302-T361 HydrophobicContact CB-CG2 4.26Å; N359-T361 VanDerWaalsContact C-N 3.31Å; N359-T361 PolarHBondContact O-N 2.94Å; T361-I363 PolarHBondContact O-N 3.45Å; T361-N364 PolarHBondContact O-N 3.4Å; T361-N364 VanDerWaalsContact O-N 3.16Å; T361-N364 PolarHBondContact OG1-N 3.39Å; T361-N364 PolarHBondContact OG1-ND2 2.86Å; T361-L365 PolarHBondContact O-N 3.18Å
362	L	98.1	Very high	97.1	Very high	19 Å²	19	31.7 Å²	31.7	10%	0.099	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-30.6	176.8	-81.9	-173.4	0	0	0	112.4	Y184 P280 L283 N284 L287 L365 A366 L385	Y184-L362 HydrophobicContact CD2-CB 4.15Å; Y184-L362 HydrophobicContact CE1-CD1 4.3Å; Y184-L362 HydrophobicContact CE2-CB 3.42Å; Y184-L362 VanDerWaalsContact CE2-CB 3.42Å; Y184-L362 HydrophobicContact CE2-CD1 4.22Å; Y184-L362 HydrophobicContact CE2-CG 4.42Å; P280-L362 HydrophobicContact CB-CD1 4.31Å; P280-L362 WeakPolarHBondContact O-CD1 3.36Å; L283-L362 HydrophobicContact CB-CD1 4.22Å; N284-L362 HydrophobicContact CB-CB 4.21Å; N284-L362 HydrophobicContact CB-CD1 3.86Å; N284-L362 HydrophobicContact CB-CG 3.8Å; N284-L362 PolarHBondContact OD1-N 2.97Å; L287-L362 HydrophobicContact CD2-CD2 4.2Å; L362-L365 HydrophobicContact CD2-CD2 4.02Å; L362-L365 PolarHBondContact O-N 2.85Å; L362-A366 WeakPolarHBondContact O-CB 3.45Å; L362-A366 PolarHBondContact O-N 2.63Å; L362-L385 HydrophobicContact CD1-CD2 4.29Å
363	I	98.3	Very high	97.5	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-49.3	175.3	-51.9	-177.6	0	0	0	110.2	Y184 A185 L190 P304 T361 A366 L367 L378 L382	Y184-I363 HydrophobicContact CD2-CG1 4.05Å; Y184-I363 HydrophobicContact CE2-CG1 3.85Å; A185-I363 VanDerWaalsContact O-CD1 3.28Å; A185-I363 WeakPolarHBondContact O-CD1 2.99Å; L190-I363 HydrophobicContact CD2-CD1 3.76Å; L190-I363 HydrophobicContact CD2-CG1 4.16Å; P304-I363 HydrophobicContact CG-CG2 3.43Å; P304-I363 VanDerWaalsContact CG-CG2 3.43Å; T361-I363 PolarHBondContact O-N 3.45Å; I363-A366 PolarHBondContact O-N 2.82Å; I363-L367 WeakPolarHBondContact O-CG 3.42Å; I363-L367 PolarHBondContact O-N 2.9Å; I363-L367 VanDerWaalsContact O-N 3.14Å; I363-L378 HydrophobicContact CG2-CD2 3.76Å; I363-L382 HydrophobicContact CB-CD1 4.31Å; I363-L382 HydrophobicContact CG1-CD1 3.86Å; I363-L382 HydrophobicContact CG2-CD1 4.23Å
364	N	98.2	Very high	97.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-71	-35	179.3	-72.3	-65	0	0	0	112	R302 Y315 S316 N359 T361 L367 K368	R302-N364 PolarHBondContact O-ND2 2.6Å; Y315-N364 VanDerWaalsContact CA-OD1 3.23Å; Y315-N364 WeakPolarHBondContact CA-OD1 3.31Å; S316-N364 PolarHBondContact N-OD1 3.21Å; S316-N364 PolarHBondContact OG-OD1 3.33Å; N359-N364 WeakPolarHBondContact CB-ND2 3.47Å; N359-N364 WeakPolarHBondContact O-CB 3.5Å; T361-N364 PolarHBondContact O-N 3.4Å; T361-N364 VanDerWaalsContact O-N 3.16Å; T361-N364 PolarHBondContact OG1-N 3.39Å; T361-N364 PolarHBondContact OG1-ND2 2.86Å; N364-L367 PolarHBondContact O-N 2.78Å; N364-K368 WeakPolarHBondContact O-CB 3.12Å; N364-K368 PolarHBondContact O-N 3.17Å
365	L	98.4	Very high	97.8	Very high	21 Å²	21	28.4 Å²	28.4	11%	0.11	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-44	172.8	177.6	57	0	0	0	111.5	L287 L341 T361 L362 L367 K368 L369	L287-L365 HydrophobicContact CD2-CB 4.17Å; L287-L365 HydrophobicContact CD2-CD2 4.05Å; L341-L365 HydrophobicContact CD2-CD2 4.15Å; L341-L365 WeakPolarHBondContact O-CD1 3.44Å; T361-L365 PolarHBondContact O-N 3.18Å; L362-L365 HydrophobicContact CD2-CD2 4.02Å; L362-L365 PolarHBondContact O-N 2.85Å; L365-L367 VanDerWaalsContact C-N 3.34Å; L365-L367 PolarHBondContact O-N 3.27Å; L365-K368 WeakPolarHBondContact O-CB 3.27Å; L365-K368 PolarHBondContact O-N 2.88Å; L365-K368 VanDerWaalsContact O-N 3.15Å; L365-L369 HydrophobicContact CD1-CD1 3.8Å; L365-L369 HydrophobicContact CD1-CD2 4.35Å; L365-L369 HydrophobicContact CD1-CG 3.81Å; L365-L369 HydrophobicContact CG-CD1 3.9Å; L365-L369 HydrophobicContact CG-CG 4.32Å; L365-L369 WeakPolarHBondContact O-CG 3.16Å; L365-L369 PolarHBondContact O-N 3.29Å
366	A	98.4	Very high	97.8	Very high	9 Å²	9	32.2 Å²	32.2	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-60	-44.9	176.1	0	0	0	0	0	111.4	L362 I363 K368 L369 F370 L378 L381 L382	L362-A366 WeakPolarHBondContact O-CB 3.45Å; L362-A366 PolarHBondContact O-N 2.63Å; I363-A366 PolarHBondContact O-N 2.82Å; A366-K368 VanDerWaalsContact C-N 3.3Å; A366-K368 PolarHBondContact O-N 2.91Å; A366-L369 PolarHBondContact O-N 2.92Å; A366-F370 HydrophobicContact CB-CD2 4.42Å; A366-F370 WeakPolarHBondContact O-CB 3.38Å; A366-F370 VanDerWaalsContact O-CD2 3.32Å; A366-F370 WeakPolarHBondContact O-CD2 3.3Å; A366-F370 PolarHBondContact O-N 2.84Å; A366-L378 HydrophobicContact CB-CD1 4.06Å; A366-L381 HydrophobicContact CB-CD2 4.14Å; A366-L382 HydrophobicContact CB-CD2 3.8Å
367	L	98.5	Very high	97.9	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-32	175.6	-70.3	171.7	0	0	0	113.2	P304 L313 T314 I363 N364 L365 G371 M373 L378	P304-L367 HydrophobicContact CB-CD1 3.67Å; P304-L367 HydrophobicContact CG-CD1 3.91Å; L313-L367 HydrophobicContact CB-CD1 4.11Å; L313-L367 HydrophobicContact CB-CD2 4.25Å; L313-L367 WeakPolarHBondContact O-CD2 3.35Å; T314-L367 VanDerWaalsContact C-CD1 3.48Å; T314-L367 WeakPolarHBondContact O-CD1 3.17Å; I363-L367 WeakPolarHBondContact O-CG 3.42Å; I363-L367 PolarHBondContact O-N 2.9Å; I363-L367 VanDerWaalsContact O-N 3.14Å; N364-L367 PolarHBondContact O-N 2.78Å; L365-L367 VanDerWaalsContact C-N 3.34Å; L365-L367 PolarHBondContact O-N 3.27Å; L367-G371 CarbonylContact O-C 3.54Å; L367-G371 WeakPolarHBondContact O-CA 3.06Å; L367-G371 PolarHBondContact O-N 2.86Å; L367-M373 HydrophobicContact CD2-CE 4.39Å; L367-M373 HydrophobicContact CD2-CG 3.8Å; L367-M373 HydrophobicContact CD2-SD 4.49Å; L367-L378 HydrophobicContact CD1-CD2 3.81Å; L367-L378 HydrophobicContact CD2-CD1 3.98Å; L367-L378 HydrophobicContact CD2-CD2 3.92Å; L367-L378 HydrophobicContact CD2-CG 4.48Å; L367-L378 HydrophobicContact CG-CD1 4.02Å; L367-L378 HydrophobicContact CG-CD2 3.91Å
368	K	97.7	Very high	98	Very high	60 Å²	60	33.3 Å²	33.3	26%	0.261	18%	0.176	S	C	.	.	H	α-helix	trans	-67.9	-43.6	172.6	178.2	-172.4	175.2	-69.1	0	111.8	Y315 G340 V342 A343 N364 L365 A366	Y315-K368 HydrophobicContact CD1-CB 4.05Å; Y315-K368 HydrophobicContact CE1-CB 4.43Å; G340-K368 WeakPolarHBondContact O-CE 3.31Å; G340-K368 PolarHBondContact O-NZ 2.78Å; V342-K368 VanDerWaalsContact O-CE 3.25Å; V342-K368 WeakPolarHBondContact O-CE 2.97Å; A343-K368 HydrophobicContact CB-CD 4.1Å; A343-K368 HydrophobicContact CB-CG 4.42Å; N364-K368 WeakPolarHBondContact O-CB 3.12Å; N364-K368 PolarHBondContact O-N 3.17Å; L365-K368 WeakPolarHBondContact O-CB 3.27Å; L365-K368 PolarHBondContact O-N 2.88Å; L365-K368 VanDerWaalsContact O-N 3.15Å; A366-K368 VanDerWaalsContact C-N 3.3Å; A366-K368 PolarHBondContact O-N 2.91Å
369	L	97.8	Very high	98	Very high	106 Å²	106	33.3 Å²	33.3	56%	0.555	18%	0.176	S	C	*	.	H	α-helix	trans	-77.8	-41.8	-174.5	-68.7	175.8	0	0	0	112.9	L365 A366	L365-L369 HydrophobicContact CD1-CD1 3.8Å; L365-L369 HydrophobicContact CD1-CD2 4.35Å; L365-L369 HydrophobicContact CD1-CG 3.81Å; L365-L369 HydrophobicContact CG-CD1 3.9Å; L365-L369 HydrophobicContact CG-CG 4.32Å; L365-L369 WeakPolarHBondContact O-CG 3.16Å; L365-L369 PolarHBondContact O-N 3.29Å; A366-L369 PolarHBondContact O-N 2.92Å
370	F	98	Very high	98	Very high	139 Å²	139	36.8 Å²	36.8	61%	0.61	19%	0.194	S	C	*	.	H	α-helix	trans	-103.4	-3.4	-174	-61.2	-73.5	0	0	0	113.3	A366 M373 L381	A366-F370 HydrophobicContact CB-CD2 4.42Å; A366-F370 WeakPolarHBondContact O-CB 3.38Å; A366-F370 VanDerWaalsContact O-CD2 3.32Å; A366-F370 WeakPolarHBondContact O-CD2 3.3Å; A366-F370 PolarHBondContact O-N 2.84Å; F370-M373 HydrophobicContact CB-CE 3.45Å; F370-M373 VanDerWaalsContact CB-CE 3.45Å; F370-M373 HydrophobicContact CG-CE 4.49Å; F370-L381 HydrophobicContact CD2-CD2 3.59Å; F370-L381 HydrophobicContact CE2-CD1 4.35Å; F370-L381 HydrophobicContact CE2-CD2 4.01Å; F370-L381 HydrophobicContact CG-CD2 4.15Å
371	G	97.6	Very high	98.1	Very high	21 Å²	21	39.3 Å²	39.3	22%	0.216	21%	0.208	C	C	.	.			trans	78.9	-178.5	178.6	0	0	0	0	0	114.3	L367 M373	L367-G371 CarbonylContact O-C 3.54Å; L367-G371 WeakPolarHBondContact O-CA 3.06Å; L367-G371 PolarHBondContact O-N 2.86Å; G371-M373 WeakPolarHBondContact O-CE 3.37Å; G371-M373 PolarHBondContact O-N 2.88Å
372	P	98	Very high	98.1	Very high	68 Å²	68	39.2 Å²	39.2	44%	0.442	21%	0.207	S	C	.	.	S	Bend	trans	-64.9	129.3	-178.2	-22.2	33.7	0	0	0	112.6	R312 L313	R312-P372 HydrophobicContact CB-CB 4.21Å; R312-P372 PolarHBondContact NH1-O 2.78Å; R312-P372 VanDerWaalsContact NH1-O 3.14Å; L313-P372 WeakPolarHBondContact O-CA 3.12Å
373	M	98	Very high	98.2	Very high	26 Å²	26	39.4 Å²	39.4	13%	0.128	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-143.8	155.9	-177.4	68	-175.6	73.1	0	0	112	L313 L367 F370 G371 C377 L378 L381	L313-M373 PolarHBondContact N-O 3.36Å; L313-M373 PolarHBondContact O-N 3.46Å; L313-M373 VanDerWaalsContact O-N 3.13Å; L367-M373 HydrophobicContact CD2-CE 4.39Å; L367-M373 HydrophobicContact CD2-CG 3.8Å; L367-M373 HydrophobicContact CD2-SD 4.49Å; F370-M373 HydrophobicContact CB-CE 3.45Å; F370-M373 VanDerWaalsContact CB-CE 3.45Å; F370-M373 HydrophobicContact CG-CE 4.49Å; G371-M373 WeakPolarHBondContact O-CE 3.37Å; G371-M373 PolarHBondContact O-N 2.88Å; M373-C377 HydrophobicContact CB-CB 4.4Å; M373-C377 HydrophobicContact SD-CB 4.42Å; M373-L378 HydrophobicContact CG-CB 3.92Å; M373-L378 HydrophobicContact CG-CD1 4.46Å; M373-L378 VanDerWaalsContact SD-CA 3.56Å; M373-L378 HydrophobicContact SD-CB 3.8Å; M373-L378 HydrophobicContact SD-CD1 3.81Å; M373-L378 HydrophobicContact SD-CG 4.41Å; M373-L381 HydrophobicContact CE-CD2 3.98Å; M373-L381 HydrophobicContact SD-CD2 4.11Å
374	H	97.5	Very high	98.2	Very high	48 Å²	48	42.1 Å²	42.1	22%	0.222	23%	0.227	C	C	.	.			trans	-64.4	146.9	176.5	176.7	-91.2	0	0	0	111.2	Y243 D311 K376 C377 L378	Y243-H374 AromaticContact CD1-CE1 3.84Å; Y243-H374 AromaticContact CE1-CE1 3.18Å; Y243-H374 WeakPolarHBondContact CE1-CE1 3.11Å; Y243-H374 AromaticContact CE1-NE2 3.5Å; Y243-H374 AromaticContact CE2-CE1 3.89Å; Y243-H374 AromaticContact CZ-CE1 3.22Å; Y243-H374 AromaticContact CZ-NE2 3.19Å; Y243-H374 PolarHBondContact OH-CE1 3.24Å; Y243-H374 PolarHBondContact OH-NE2 3.45Å; D311-H374 PolarHBondContact O-CD2 2.94Å; D311-H374 IonicContact OD2-CD2 3.62Å; D311-H374 PolarHBondContact OD2-CD2 3.16Å; D311-H374 IonicContact OD2-NE2 3.82Å; H374-K376 VanDerWaalsContact C-N 3.3Å; H374-K376 WeakPolarHBondContact ND1-CB 3.29Å; H374-K376 PolarHBondContact ND1-N 2.81Å; H374-K376 PolarHBondContact O-N 3.27Å; H374-C377 WeakPolarHBondContact O-CA 3.45Å; H374-C377 WeakPolarHBondContact O-CB 3.45Å; H374-C377 PolarHBondContact O-N 2.85Å; H374-L378 PolarHBondContact O-N 2.55Å; H374-L378 VanDerWaalsContact O-N 3.11Å
375	E	97.6	Very high	98.2	Very high	5 Å²	5	45.3 Å²	45.3	2%	0.023	24%	0.244	C	C	.	.	H	α-helix	trans	-54.1	-43.3	-172.5	-176.4	179.9	-163.7	0	0	112.9	K46 I187 N188 Y243 L313 C377 L378 A379	K46-E375 IonicContact NZ-OE2 3.33Å; I187-E375 WeakPolarHBondContact CA-OE1 3.49Å; I187-E375 HydrophobicContact CB-CG 3.99Å; I187-E375 HydrophobicContact CG2-CG 4.33Å; N188-E375 WeakPolarHBondContact CB-OE1 3.37Å; N188-E375 PolarHBondContact N-OE1 3.45Å; N188-E375 VanDerWaalsContact ND2-CD 3.25Å; N188-E375 PolarHBondContact ND2-OE1 2.95Å; N188-E375 PolarHBondContact ND2-OE2 2.79Å; Y243-E375 HydrophobicContact CD2-CB 3.83Å; Y243-E375 HydrophobicContact CD2-CG 3.93Å; Y243-E375 WeakPolarHBondContact CD2-OE2 3.32Å; Y243-E375 HydrophobicContact CE2-CB 3.76Å; Y243-E375 HydrophobicContact CE2-CG 4.28Å; Y243-E375 WeakPolarHBondContact CE2-OE2 3.14Å; L313-E375 HydrophobicContact CD1-CB 3.77Å; L313-E375 HydrophobicContact CD1-CG 3.9Å; L313-E375 HydrophobicContact CG-CB 4.32Å; E375-C377 VanDerWaalsContact C-N 3.29Å; E375-C377 PolarHBondContact O-N 3.43Å; E375-L378 PolarHBondContact O-N 3.47Å; E375-A379 PolarHBondContact O-N 2.82Å
376	K	97.2	Very high	98.2	Very high	95 Å²	95	44.3 Å²	44.3	41%	0.413	24%	0.238	S	C	.	.	H	α-helix	trans	-57.7	-40.2	175.9	-174.8	-178.7	174.4	-177.7	0	112.8	Y243 H374 L380	Y243-K376 HydrophobicContact CD1-CB 3.86Å; Y243-K376 HydrophobicContact CD1-CD 4.37Å; Y243-K376 HydrophobicContact CD1-CG 4.45Å; Y243-K376 HydrophobicContact CE1-CB 4.5Å; Y243-K376 HydrophobicContact CG-CB 3.93Å; H374-K376 VanDerWaalsContact C-N 3.3Å; H374-K376 WeakPolarHBondContact ND1-CB 3.29Å; H374-K376 PolarHBondContact ND1-N 2.81Å; H374-K376 PolarHBondContact O-N 3.27Å; K376-L380 HydrophobicContact CG-CD1 4.33Å; K376-L380 WeakPolarHBondContact O-CB 3.03Å; K376-L380 WeakPolarHBondContact O-CG 3.35Å; K376-L380 PolarHBondContact O-N 2.8Å
377	C	98.2	Very high	98.2	Very high	67 Å²	67	46.8 Å²	46.8	45%	0.453	25%	0.252	S	S	.	.	H	α-helix	trans	-69.4	-40.5	179.3	-64.1	0	0	0	0	110.6	M373 H374 E375 L380 L381	M373-C377 HydrophobicContact CB-CB 4.4Å; M373-C377 HydrophobicContact SD-CB 4.42Å; H374-C377 WeakPolarHBondContact O-CA 3.45Å; H374-C377 WeakPolarHBondContact O-CB 3.45Å; H374-C377 PolarHBondContact O-N 2.85Å; E375-C377 VanDerWaalsContact C-N 3.29Å; E375-C377 PolarHBondContact O-N 3.43Å; C377-L380 PolarHBondContact O-N 3.43Å; C377-L381 WeakPolarHBondContact O-CB 3.35Å; C377-L381 PolarHBondContact O-N 3.33Å
378	L	98.5	Very high	98.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-45.1	175.4	-174.5	61.2	0	0	0	111.7	I187 P304 L313 I363 A366 L367 M373 H374 E375 L380 L381 L382	I187-L378 HydrophobicContact CD1-CB 4.02Å; I187-L378 HydrophobicContact CD1-CD2 3.85Å; I187-L378 HydrophobicContact CD1-CG 3.64Å; I187-L378 HydrophobicContact CG2-CD2 4.26Å; P304-L378 HydrophobicContact CG-CD2 4.3Å; L313-L378 HydrophobicContact CD1-CD2 3.84Å; I363-L378 HydrophobicContact CG2-CD2 3.76Å; A366-L378 HydrophobicContact CB-CD1 4.06Å; L367-L378 HydrophobicContact CD1-CD2 3.81Å; L367-L378 HydrophobicContact CD2-CD1 3.98Å; L367-L378 HydrophobicContact CD2-CD2 3.92Å; L367-L378 HydrophobicContact CD2-CG 4.48Å; L367-L378 HydrophobicContact CG-CD1 4.02Å; L367-L378 HydrophobicContact CG-CD2 3.91Å; M373-L378 HydrophobicContact CG-CB 3.92Å; M373-L378 HydrophobicContact CG-CD1 4.46Å; M373-L378 VanDerWaalsContact SD-CA 3.56Å; M373-L378 HydrophobicContact SD-CB 3.8Å; M373-L378 HydrophobicContact SD-CD1 3.81Å; M373-L378 HydrophobicContact SD-CG 4.41Å; H374-L378 PolarHBondContact O-N 2.55Å; H374-L378 VanDerWaalsContact O-N 3.11Å; E375-L378 PolarHBondContact O-N 3.47Å; L378-L380 PolarHBondContact O-N 3.01Å; L378-L381 HydrophobicContact CD1-CD2 4.49Å; L378-L381 WeakPolarHBondContact O-CB 3.49Å; L378-L381 PolarHBondContact O-N 3.15Å; L378-L382 HydrophobicContact CD1-CD1 4.19Å; L378-L382 HydrophobicContact CD1-CG 4.24Å; L378-L382 HydrophobicContact CG-CD1 4.1Å; L378-L382 WeakPolarHBondContact O-CG 3.34Å; L378-L382 PolarHBondContact O-N 3.06Å
379	A	98.5	Very high	98.3	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-46.9	176.2	0	0	0	0	0	111.7	I187 E375 L381 L382 I383	I187-A379 HydrophobicContact CD1-CB 3.94Å; I187-A379 HydrophobicContact CG1-CB 4.36Å; E375-A379 PolarHBondContact O-N 2.82Å; A379-L381 VanDerWaalsContact C-N 3.35Å; A379-L381 PolarHBondContact O-N 2.84Å; A379-L382 PolarHBondContact O-N 2.81Å; A379-I383 WeakPolarHBondContact O-CB 3.19Å; A379-I383 WeakPolarHBondContact O-CD1 3.44Å; A379-I383 VanDerWaalsContact O-CG1 3.23Å; A379-I383 WeakPolarHBondContact O-CG1 3.24Å; A379-I383 PolarHBondContact O-N 2.82Å
380	L	98.6	Very high	98.3	Very high	77 Å²	77	43.9 Å²	43.9	40%	0.403	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-41.7	175.8	-75.6	170.4	0	0	0	112.5	W242 K376 C377 L378 S384	W242-L380 HydrophobicContact CH2-CD2 4.03Å; W242-L380 HydrophobicContact CZ2-CD2 3.81Å; W242-L380 HydrophobicContact CZ2-CG 4.25Å; K376-L380 HydrophobicContact CG-CD1 4.33Å; K376-L380 WeakPolarHBondContact O-CB 3.03Å; K376-L380 WeakPolarHBondContact O-CG 3.35Å; K376-L380 PolarHBondContact O-N 2.8Å; C377-L380 PolarHBondContact O-N 3.43Å; L378-L380 PolarHBondContact O-N 3.01Å; L380-S384 VanDerWaalsContact O-CB 3.27Å; L380-S384 WeakPolarHBondContact O-CB 3.42Å; L380-S384 PolarHBondContact O-N 3.42Å; L380-S384 PolarHBondContact O-OG 2.85Å
381	L	98.7	Very high	98.4	Very high	53 Å²	53	42.6 Å²	42.6	28%	0.277	24%	0.243	S	C	.	.	H	α-helix	trans	-61.2	-48.9	177.7	175.2	65.4	0	0	0	111.5	A366 F370 M373 C377 L378 A379 S384 L385	A366-L381 HydrophobicContact CB-CD2 4.14Å; F370-L381 HydrophobicContact CD2-CD2 3.59Å; F370-L381 HydrophobicContact CE2-CD1 4.35Å; F370-L381 HydrophobicContact CE2-CD2 4.01Å; F370-L381 HydrophobicContact CG-CD2 4.15Å; M373-L381 HydrophobicContact CE-CD2 3.98Å; M373-L381 HydrophobicContact SD-CD2 4.11Å; C377-L381 WeakPolarHBondContact O-CB 3.35Å; C377-L381 PolarHBondContact O-N 3.33Å; L378-L381 HydrophobicContact CD1-CD2 4.49Å; L378-L381 WeakPolarHBondContact O-CB 3.49Å; L378-L381 PolarHBondContact O-N 3.15Å; A379-L381 VanDerWaalsContact C-N 3.35Å; A379-L381 PolarHBondContact O-N 2.84Å; L381-S384 WeakPolarHBondContact O-CB 3.21Å; L381-S384 PolarHBondContact O-N 2.82Å; L381-L385 PolarHBondContact O-N 3.33Å
382	L	98.7	Very high	98.4	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-71.1	-34	-177.8	-61.7	175.7	0	0	0	112.4	Y184 I187 L190 I363 A366 L378 A379 L385 Q386	Y184-L382 HydrophobicContact CE2-CD1 4.5Å; Y184-L382 WeakPolarHBondContact OH-CD2 3.28Å; I187-L382 HydrophobicContact CD1-CD1 3.9Å; L190-L382 HydrophobicContact CD1-CB 3.67Å; L190-L382 HydrophobicContact CD1-CD1 4.22Å; L190-L382 HydrophobicContact CD2-CD1 3.75Å; I363-L382 HydrophobicContact CB-CD1 4.31Å; I363-L382 HydrophobicContact CG1-CD1 3.86Å; I363-L382 HydrophobicContact CG2-CD1 4.23Å; A366-L382 HydrophobicContact CB-CD2 3.8Å; L378-L382 HydrophobicContact CD1-CD1 4.19Å; L378-L382 HydrophobicContact CD1-CG 4.24Å; L378-L382 HydrophobicContact CG-CD1 4.1Å; L378-L382 WeakPolarHBondContact O-CG 3.34Å; L378-L382 PolarHBondContact O-N 3.06Å; A379-L382 PolarHBondContact O-N 2.81Å; L382-L385 WeakPolarHBondContact O-CB 3.36Å; L382-L385 PolarHBondContact O-N 3.3Å; L382-Q386 PolarHBondContact O-N 2.69Å; L382-Q386 VanDerWaalsContact O-N 3.11Å
383	I	98.8	Very high	98.4	Very high	22 Å²	22	42.9 Å²	42.9	11%	0.113	23%	0.232	C	C	.	.	H	α-helix	trans	-68.2	-38.4	171.1	-67.5	165.7	0	0	0	110.4	L190 V197 W242 A379 L385 Q386 V387	L190-I383 HydrophobicContact CD1-CG1 4.36Å; V197-I383 HydrophobicContact CG2-CG2 3.97Å; W242-I383 HydrophobicContact CH2-CD1 3.61Å; W242-I383 HydrophobicContact CZ3-CD1 3.51Å; A379-I383 WeakPolarHBondContact O-CB 3.19Å; A379-I383 WeakPolarHBondContact O-CD1 3.44Å; A379-I383 VanDerWaalsContact O-CG1 3.23Å; A379-I383 WeakPolarHBondContact O-CG1 3.24Å; A379-I383 PolarHBondContact O-N 2.82Å; I383-L385 VanDerWaalsContact C-N 3.33Å; I383-L385 PolarHBondContact O-N 3.14Å; I383-Q386 WeakPolarHBondContact O-CA 3.49Å; I383-Q386 WeakPolarHBondContact O-CB 3.46Å; I383-Q386 PolarHBondContact O-N 3.04Å; I383-Q386 VanDerWaalsContact O-N 3.11Å; I383-V387 WeakPolarHBondContact O-CG2 3.32Å; I383-V387 PolarHBondContact O-N 3.48Å
384	S	98.7	Very high	98.3	Very high	62 Å²	62	43.1 Å²	43.1	43%	0.434	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-39.1	174.5	-58.9	0	0	0	0	111.5	L380 L381 Q386 V387 V388	L380-S384 VanDerWaalsContact O-CB 3.27Å; L380-S384 WeakPolarHBondContact O-CB 3.42Å; L380-S384 PolarHBondContact O-N 3.42Å; L380-S384 PolarHBondContact O-OG 2.85Å; L381-S384 WeakPolarHBondContact O-CB 3.21Å; L381-S384 PolarHBondContact O-N 2.82Å; S384-Q386 VanDerWaalsContact C-N 3.27Å; S384-Q386 PolarHBondContact O-N 2.83Å; S384-V387 PolarHBondContact O-N 3.24Å; S384-V387 VanDerWaalsContact O-N 3.16Å; S384-V388 WeakPolarHBondContact O-CG2 3.29Å; S384-V388 PolarHBondContact O-N 3.01Å
385	L	98.7	Very high	98.2	Very high	66 Å²	66	45.3 Å²	45.3	35%	0.346	24%	0.241	S	C	.	.	H	α-helix	trans	-57.8	-41	171.2	175.1	64.8	0	0	0	111.3	P280 L362 L381 L382 I383 S389	P280-L385 HydrophobicContact CG-CG 4.49Å; L362-L385 HydrophobicContact CD1-CD2 4.29Å; L381-L385 PolarHBondContact O-N 3.33Å; L382-L385 WeakPolarHBondContact O-CB 3.36Å; L382-L385 PolarHBondContact O-N 3.3Å; I383-L385 VanDerWaalsContact C-N 3.33Å; I383-L385 PolarHBondContact O-N 3.14Å; L385-S389 VanDerWaalsContact O-CB 3.28Å; L385-S389 WeakPolarHBondContact O-CB 3.33Å; L385-S389 PolarHBondContact O-N 3.11Å; L385-S389 PolarHBondContact O-OG 3.38Å
386	Q	98.8	Very high	98	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.4	-43.4	174.4	-175.8	63.2	61.2	0	0	112.2	Q194 V197 I198 F277 P280 L382 I383 S384 S389 S390	Q194-Q386 HydrophobicContact CB-CG 4.41Å; V197-Q386 HydrophobicContact CB-CB 4.44Å; V197-Q386 HydrophobicContact CB-CG 3.67Å; V197-Q386 HydrophobicContact CG1-CB 4.31Å; V197-Q386 HydrophobicContact CG1-CG 3.62Å; V197-Q386 HydrophobicContact CG2-CG 4.44Å; I198-Q386 HydrophobicContact CG1-CG 4.45Å; F277-Q386 PolarHBondContact O-NE2 3.06Å; P280-Q386 HydrophobicContact CG-CB 4.49Å; L382-Q386 PolarHBondContact O-N 2.69Å; L382-Q386 VanDerWaalsContact O-N 3.11Å; I383-Q386 WeakPolarHBondContact O-CA 3.49Å; I383-Q386 WeakPolarHBondContact O-CB 3.46Å; I383-Q386 PolarHBondContact O-N 3.04Å; I383-Q386 VanDerWaalsContact O-N 3.11Å; S384-Q386 VanDerWaalsContact C-N 3.27Å; S384-Q386 PolarHBondContact O-N 2.83Å; Q386-S389 PolarHBondContact O-N 3.35Å; Q386-S390 WeakPolarHBondContact O-CB 3.49Å; Q386-S390 PolarHBondContact O-N 3.09Å; Q386-S390 PolarHBondContact O-OG 2.66Å
387	V	98.8	Very high	97.8	Very high	61 Å²	61	44.7 Å²	44.7	37%	0.37	24%	0.239	S	C	.	.	H	α-helix	trans	-61.2	-49.6	176.5	173.8	0	0	0	0	111.2	V197 I383 S384 S389 S390 L391	V197-V387 HydrophobicContact CB-CG2 4.48Å; V197-V387 HydrophobicContact CG1-CB 4.41Å; V197-V387 HydrophobicContact CG1-CG2 3.77Å; V197-V387 HydrophobicContact CG2-CG2 3.77Å; I383-V387 WeakPolarHBondContact O-CG2 3.32Å; I383-V387 PolarHBondContact O-N 3.48Å; S384-V387 PolarHBondContact O-N 3.24Å; S384-V387 VanDerWaalsContact O-N 3.16Å; V387-S389 VanDerWaalsContact C-N 3.31Å; V387-S389 PolarHBondContact O-N 3.31Å; V387-S390 PolarHBondContact O-N 3.3Å; V387-L391 HydrophobicContact CG1-CD1 4.25Å; V387-L391 WeakPolarHBondContact O-CG 3.14Å; V387-L391 PolarHBondContact O-N 2.57Å
388	V	98.8	Very high	97.5	Very high	93 Å²	93	42.7 Å²	42.7	56%	0.564	22%	0.223	S	C	*	.	H	α-helix	trans	-61	-42.1	178.8	172.7	0	0	0	0	110.9	S384 S390 L391 F392	S384-V388 WeakPolarHBondContact O-CG2 3.29Å; S384-V388 PolarHBondContact O-N 3.01Å; V388-S390 PolarHBondContact O-N 2.83Å; V388-L391 PolarHBondContact O-N 3.16Å; V388-F392 WeakPolarHBondContact O-CB 3.24Å; V388-F392 PolarHBondContact O-N 3.39Å
389	S	98.7	Very high	97.1	Very high	9 Å²	9	50.2 Å²	50.2	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-64.8	-39	177.2	-57.5	0	0	0	0	112.1	P280 L385 Q386 V387 F392 A393	P280-S389 WeakPolarHBondContact CG-OG 3.4Å; L385-S389 VanDerWaalsContact O-CB 3.28Å; L385-S389 WeakPolarHBondContact O-CB 3.33Å; L385-S389 PolarHBondContact O-N 3.11Å; L385-S389 PolarHBondContact O-OG 3.38Å; Q386-S389 PolarHBondContact O-N 3.35Å; V387-S389 VanDerWaalsContact C-N 3.31Å; V387-S389 PolarHBondContact O-N 3.31Å; S389-F392 PolarHBondContact O-N 2.93Å; S389-A393 WeakPolarHBondContact O-CB 3.37Å; S389-A393 PolarHBondContact O-N 3Å
390	S	98.6	Very high	96.6	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.028	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-41.5	174	-74.9	0	0	0	0	112.8	S201 Q386 V387 V388 F392 A393 F394	S201-S390 WeakPolarHBondContact OG-CB 3.47Å; S201-S390 PolarHBondContact OG-OG 3.27Å; Q386-S390 WeakPolarHBondContact O-CB 3.49Å; Q386-S390 PolarHBondContact O-N 3.09Å; Q386-S390 PolarHBondContact O-OG 2.66Å; V387-S390 PolarHBondContact O-N 3.3Å; V388-S390 PolarHBondContact O-N 2.83Å; S390-F392 VanDerWaalsContact C-N 3.33Å; S390-A393 WeakPolarHBondContact O-CB 3.41Å; S390-A393 PolarHBondContact O-N 3.38Å; S390-F394 WeakPolarHBondContact O-CD2 3.37Å; S390-F394 PolarHBondContact O-N 2.91Å
391	L	98.5	Very high	96	Very high	112 Å²	112	49.3 Å²	49.3	59%	0.586	25%	0.249	S	C	*	.	H	α-helix	trans	-63.1	-41.7	174.1	-68.8	174.4	0	0	0	111.2	V387 V388 A393 F394 F395	V387-L391 HydrophobicContact CG1-CD1 4.25Å; V387-L391 WeakPolarHBondContact O-CG 3.14Å; V387-L391 PolarHBondContact O-N 2.57Å; V388-L391 PolarHBondContact O-N 3.16Å; L391-A393 VanDerWaalsContact C-N 3.33Å; L391-A393 PolarHBondContact O-N 2.81Å; L391-F394 WeakPolarHBondContact O-CB 3.48Å; L391-F394 PolarHBondContact O-N 3.31Å; L391-F395 PolarHBondContact O-N 3.05Å
392	F	98.1	Very high	95.4	Very high	95 Å²	95	53.5 Å²	53.5	42%	0.417	27%	0.265	S	S	.	.	H	α-helix	trans	-65.3	-36	174.4	-176.9	-119.2	0	0	0	112.2	M279 V388 S389 S390 F394 F395 L396	M279-F392 HydrophobicContact CE-CD1 3.73Å; M279-F392 HydrophobicContact CE-CE1 4.02Å; M279-F392 HydrophobicContact SD-CD1 3.92Å; M279-F392 HydrophobicContact SD-CE1 4.32Å; V388-F392 WeakPolarHBondContact O-CB 3.24Å; V388-F392 PolarHBondContact O-N 3.39Å; S389-F392 PolarHBondContact O-N 2.93Å; S390-F392 VanDerWaalsContact C-N 3.33Å; F392-F394 PolarHBondContact O-N 2.97Å; F392-F395 HydrophobicContact CD2-CD1 4.13Å; F392-F395 HydrophobicContact CE2-CD1 4.07Å; F392-F395 WeakPolarHBondContact O-CB 3.41Å; F392-F395 PolarHBondContact O-N 3.28Å; F392-L396 HydrophobicContact CD1-CD1 3.85Å; F392-L396 HydrophobicContact CD1-CG 4.4Å; F392-L396 HydrophobicContact CE1-CD1 3.51Å; F392-L396 HydrophobicContact CE1-CD2 4.47Å; F392-L396 HydrophobicContact CE1-CG 4.04Å; F392-L396 HydrophobicContact CE2-CG 4.26Å; F392-L396 HydrophobicContact CZ-CD1 3.93Å; F392-L396 HydrophobicContact CZ-CD2 4.06Å; F392-L396 HydrophobicContact CZ-CG 3.95Å; F392-L396 WeakPolarHBondContact O-CG 3.26Å; F392-L396 PolarHBondContact O-N 3.07Å
393	A	97.7	Very high	94.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-42.4	172.6	0	0	0	0	0	112.2	L276 F277 S389 S390 L391 L396 R397	L276-A393 HydrophobicContact CB-CB 3.52Å; F277-A393 HydrophobicContact CD1-CB 3.64Å; F277-A393 HydrophobicContact CE1-CB 3.83Å; S389-A393 WeakPolarHBondContact O-CB 3.37Å; S389-A393 PolarHBondContact O-N 3Å; S390-A393 WeakPolarHBondContact O-CB 3.41Å; S390-A393 PolarHBondContact O-N 3.38Å; L391-A393 VanDerWaalsContact C-N 3.33Å; L391-A393 PolarHBondContact O-N 2.81Å; A393-L396 PolarHBondContact O-N 2.71Å; A393-R397 VanDerWaalsContact O-CB 3.31Å; A393-R397 WeakPolarHBondContact O-CB 3.5Å; A393-R397 PolarHBondContact O-N 3.28Å
394	F	97.1	Very high	94.1	Very high	32 Å²	32	63.2 Å²	63.2	14%	0.14	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-43.6	172.5	-79.1	-63	0	0	0	112.4	S201 A204 F205 I208 F277 S390 L391 F392 R397 F398	S201-F394 VanDerWaalsContact O-CZ 3.28Å; S201-F394 WeakPolarHBondContact O-CZ 3.44Å; A204-F394 HydrophobicContact CB-CZ 3.89Å; F205-F394 HydrophobicContact CB-CE1 3.8Å; F205-F394 HydrophobicContact CB-CZ 4.18Å; F205-F394 HydrophobicContact CD2-CE1 4.41Å; I208-F394 HydrophobicContact CD1-CE1 4.26Å; F277-F394 HydrophobicContact CE1-CD1 4.45Å; F277-F394 HydrophobicContact CE1-CD2 4.18Å; F277-F394 HydrophobicContact CE1-CE1 4.27Å; F277-F394 AromaticContact CE1-CE2 3.94Å; F277-F394 HydrophobicContact CE1-CE2 3.94Å; F277-F394 HydrophobicContact CE1-CG 4.43Å; F277-F394 HydrophobicContact CE1-CZ 4Å; F277-F394 HydrophobicContact CZ-CD1 4.38Å; F277-F394 AromaticContact CZ-CE1 3.88Å; F277-F394 HydrophobicContact CZ-CE1 3.88Å; F277-F394 HydrophobicContact CZ-CE2 4.21Å; F277-F394 AromaticContact CZ-CZ 3.79Å; F277-F394 HydrophobicContact CZ-CZ 3.79Å; S390-F394 WeakPolarHBondContact O-CD2 3.37Å; S390-F394 PolarHBondContact O-N 2.91Å; L391-F394 WeakPolarHBondContact O-CB 3.48Å; L391-F394 PolarHBondContact O-N 3.31Å; F392-F394 PolarHBondContact O-N 2.97Å; F394-R397 PolarHBondContact O-N 2.81Å; F394-F398 HydrophobicContact CB-CD2 4.48Å; F394-F398 AromaticContact CD1-CD2 3.94Å; F394-F398 HydrophobicContact CD1-CD2 3.94Å; F394-F398 AromaticContact CD1-CE2 3.5Å; F394-F398 HydrophobicContact CD1-CE2 3.5Å; F394-F398 VanDerWaalsContact CD1-CE2 3.5Å; F394-F398 AromaticContact CE1-CE2 3.97Å; F394-F398 HydrophobicContact CE1-CE2 3.97Å; F394-F398 PolarHBondContact O-N 3.09Å
395	F	95.5	Very high	93.4	Very high	94 Å²	94	63 Å²	63	41%	0.412	30%	0.298	S	S	.	.	H	α-helix	trans	-59	-47.6	175.4	177.7	-108.2	0	0	0	111.6	L391 F392 R397 Y399 L400	L391-F395 PolarHBondContact O-N 3.05Å; F392-F395 HydrophobicContact CD2-CD1 4.13Å; F392-F395 HydrophobicContact CE2-CD1 4.07Å; F392-F395 WeakPolarHBondContact O-CB 3.41Å; F392-F395 PolarHBondContact O-N 3.28Å; F395-R397 VanDerWaalsContact C-N 3.35Å; F395-R397 PolarHBondContact O-N 3.22Å; F395-Y399 AromaticContact CD2-CD2 3.9Å; F395-Y399 HydrophobicContact CD2-CD2 3.9Å; F395-Y399 HydrophobicContact CD2-CG 4.08Å; F395-Y399 HydrophobicContact CE2-CG 4.24Å; F395-Y399 WeakPolarHBondContact O-CA 3.43Å; F395-Y399 WeakPolarHBondContact O-CB 3.35Å; F395-Y399 PolarHBondContact O-N 2.92Å; F395-L400 HydrophobicContact CD1-CD1 3.82Å; F395-L400 HydrophobicContact CD1-CG 4.04Å; F395-L400 HydrophobicContact CE1-CD1 3.39Å; F395-L400 HydrophobicContact CE1-CD2 4Å; F395-L400 HydrophobicContact CE1-CG 3.55Å; F395-L400 HydrophobicContact CZ-CD1 4.25Å; F395-L400 HydrophobicContact CZ-CD2 4.03Å; F395-L400 HydrophobicContact CZ-CG 3.97Å; F395-L400 PolarHBondContact O-N 3.35Å; F395-L400 VanDerWaalsContact O-N 3.14Å
396	L	93.7	Very high	92.2	Very high	39 Å²	39	65.3 Å²	65.3	20%	0.204	31%	0.311	C	S	.	.	I	π-helix	trans	-57.5	-47.4	175.1	-76.5	169.3	0	0	0	111.7	L276 M279 F392 A393 L400 A401	L276-L396 HydrophobicContact CD1-CB 4.12Å; L276-L396 HydrophobicContact CD2-CD1 4.08Å; M279-L396 HydrophobicContact CE-CD1 4Å; F392-L396 HydrophobicContact CD1-CD1 3.85Å; F392-L396 HydrophobicContact CD1-CG 4.4Å; F392-L396 HydrophobicContact CE1-CD1 3.51Å; F392-L396 HydrophobicContact CE1-CD2 4.47Å; F392-L396 HydrophobicContact CE1-CG 4.04Å; F392-L396 HydrophobicContact CE2-CG 4.26Å; F392-L396 HydrophobicContact CZ-CD1 3.93Å; F392-L396 HydrophobicContact CZ-CD2 4.06Å; F392-L396 HydrophobicContact CZ-CG 3.95Å; F392-L396 WeakPolarHBondContact O-CG 3.26Å; F392-L396 PolarHBondContact O-N 3.07Å; A393-L396 PolarHBondContact O-N 2.71Å; L396-L400 HydrophobicContact CD2-CB 4.24Å; L396-L400 HydrophobicContact CD2-CD1 3.56Å; L396-L400 HydrophobicContact CD2-CG 4.46Å; L396-L400 HydrophobicContact CG-CD1 4.47Å; L396-L400 CarbonylContact O-C 3.58Å; L396-L400 PolarHBondContact O-N 3.11Å; L396-A401 PolarHBondContact O-N 3.26Å
397	R	91.9	Very high	90.5	Very high	47 Å²	47	70.3 Å²	70.3	18%	0.177	34%	0.341	C	S	.	.	I	π-helix	trans	-69.9	-40.3	-173.7	179.8	56.2	177.8	86.2	-2.1	113.9	F205 T273 A393 F394 F395 A401 E409	F205-R397 HydrophobicContact CE2-CG 4.1Å; T273-R397 HydrophobicContact CG2-CG 4.19Å; T273-R397 PolarHBondContact OG1-NE 2.92Å; A393-R397 VanDerWaalsContact O-CB 3.31Å; A393-R397 WeakPolarHBondContact O-CB 3.5Å; A393-R397 PolarHBondContact O-N 3.28Å; F394-R397 PolarHBondContact O-N 2.81Å; F395-R397 VanDerWaalsContact C-N 3.35Å; F395-R397 PolarHBondContact O-N 3.22Å; R397-A401 VanDerWaalsContact O-CB 3.28Å; R397-A401 WeakPolarHBondContact O-CB 3.33Å; R397-E409 PolarHBondContact NH1-O 3.15Å; R397-E409 PolarHBondContact NH2-O 3.32Å
398	F	91.7	Very high	88.4	Confident	25 Å²	25	68.8 Å²	68.8	11%	0.11	33%	0.332	C	S	.	.	I	π-helix	trans	-101.7	-24.6	-171.1	-65.9	-46.1	0	0	0	114.1	F205 I208 F394	F205-F398 HydrophobicContact CD2-CE1 4.48Å; F205-F398 HydrophobicContact CD2-CE2 4.45Å; F205-F398 AromaticContact CD2-CZ 3.78Å; F205-F398 HydrophobicContact CD2-CZ 3.78Å; F205-F398 HydrophobicContact CE2-CE1 4.25Å; F205-F398 HydrophobicContact CE2-CZ 4.01Å; I208-F398 HydrophobicContact CB-CE2 4.41Å; I208-F398 HydrophobicContact CB-CZ 4.13Å; I208-F398 HydrophobicContact CD1-CE2 3.88Å; I208-F398 HydrophobicContact CD1-CZ 4.43Å; I208-F398 HydrophobicContact CG2-CE1 4.14Å; I208-F398 HydrophobicContact CG2-CE2 3.84Å; I208-F398 HydrophobicContact CG2-CZ 3.48Å; I208-F398 VanDerWaalsContact CG2-CZ 3.48Å; F394-F398 HydrophobicContact CB-CD2 4.48Å; F394-F398 AromaticContact CD1-CD2 3.94Å; F394-F398 HydrophobicContact CD1-CD2 3.94Å; F394-F398 AromaticContact CD1-CE2 3.5Å; F394-F398 HydrophobicContact CD1-CE2 3.5Å; F394-F398 VanDerWaalsContact CD1-CE2 3.5Å; F394-F398 AromaticContact CE1-CE2 3.97Å; F394-F398 HydrophobicContact CE1-CE2 3.97Å; F394-F398 PolarHBondContact O-N 3.09Å
399	Y	90	Very high	86.2	Confident	158 Å²	158	69.2 Å²	69.2	62%	0.62	33%	0.328	S	S	*	.	I	π-helix	trans	-112.9	-47.4	-178	-61.8	-89.4	0	0	0	112.3	F395	F395-Y399 AromaticContact CD2-CD2 3.9Å; F395-Y399 HydrophobicContact CD2-CD2 3.9Å; F395-Y399 HydrophobicContact CD2-CG 4.08Å; F395-Y399 HydrophobicContact CE2-CG 4.24Å; F395-Y399 WeakPolarHBondContact O-CA 3.43Å; F395-Y399 WeakPolarHBondContact O-CB 3.35Å; F395-Y399 PolarHBondContact O-N 2.92Å
400	L	89	Confident	85.6	Confident	46 Å²	46	72.2 Å²	72.2	24%	0.241	34%	0.341	C	S	.	.	I	π-helix	trans	-82.7	-23.7	-176.1	-63.5	-178.8	0	0	0	114.4	F395 L396 K402 F403 F404	F395-L400 HydrophobicContact CD1-CD1 3.82Å; F395-L400 HydrophobicContact CD1-CG 4.04Å; F395-L400 HydrophobicContact CE1-CD1 3.39Å; F395-L400 HydrophobicContact CE1-CD2 4Å; F395-L400 HydrophobicContact CE1-CG 3.55Å; F395-L400 HydrophobicContact CZ-CD1 4.25Å; F395-L400 HydrophobicContact CZ-CD2 4.03Å; F395-L400 HydrophobicContact CZ-CG 3.97Å; F395-L400 PolarHBondContact O-N 3.35Å; F395-L400 VanDerWaalsContact O-N 3.14Å; L396-L400 HydrophobicContact CD2-CB 4.24Å; L396-L400 HydrophobicContact CD2-CD1 3.56Å; L396-L400 HydrophobicContact CD2-CG 4.46Å; L396-L400 HydrophobicContact CG-CD1 4.47Å; L396-L400 CarbonylContact O-C 3.58Å; L396-L400 PolarHBondContact O-N 3.11Å; L400-K402 PolarHBondContact O-N 2.82Å; L400-F403 HydrophobicContact CD2-CD2 3.96Å; L400-F403 HydrophobicContact CD2-CE2 3.98Å; L400-F403 WeakPolarHBondContact O-CB 3.44Å; L400-F403 PolarHBondContact O-N 2.96Å; L400-F404 WeakPolarHBondContact O-CD2 3.43Å
401	A	86.6	Confident	84.9	Confident	13 Å²	13	75.8 Å²	75.8	11%	0.107	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-54.8	-29.9	-179.8	0	0	0	0	0	112.9	L396 R397 F403 F404 F405 V408	L396-A401 PolarHBondContact O-N 3.26Å; R397-A401 VanDerWaalsContact O-CB 3.28Å; R397-A401 WeakPolarHBondContact O-CB 3.33Å; A401-F403 PolarHBondContact O-N 3.27Å; A401-F404 CarbonylContact O-C 3.45Å; A401-F404 PolarHBondContact O-N 2.91Å; A401-F405 PolarHBondContact O-N 3.37Å; A401-V408 VanDerWaalsContact C-CG2 3.47Å; A401-V408 HydrophobicContact CB-CB 4.45Å; A401-V408 HydrophobicContact CB-CG1 3.75Å; A401-V408 HydrophobicContact CB-CG2 3.75Å
402	K	84.8	Confident	84.1	Confident	141 Å²	141	73.8 Å²	73.8	61%	0.613	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-67.3	-22.8	179.8	-63.1	-178.9	-178.9	-176.6	0	113.2	L400 F404 V408	L400-K402 PolarHBondContact O-N 2.82Å; K402-F404 VanDerWaalsContact C-N 3.31Å; K402-V408 HydrophobicContact CB-CG2 4.17Å; K402-V408 HydrophobicContact CG-CB 4.08Å; K402-V408 HydrophobicContact CG-CG2 3.57Å
403	F	85.6	Confident	83.3	Confident	137 Å²	137	72.5 Å²	72.5	60%	0.601	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-80.5	-15.2	174.6	-64.5	-84	0	0	0	112.9	Q151 L400 A401	Q151-F403 PolarHBondContact NE2-O 3.07Å; L400-F403 HydrophobicContact CD2-CD2 3.96Å; L400-F403 HydrophobicContact CD2-CE2 3.98Å; L400-F403 WeakPolarHBondContact O-CB 3.44Å; L400-F403 PolarHBondContact O-N 2.96Å; A401-F403 PolarHBondContact O-N 3.27Å
404	F	85.2	Confident	82.4	Confident	93 Å²	93	77.1 Å²	77.1	41%	0.408	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-26.6	-179.4	-60.5	-76.3	0	0	0	112.2	P149 I150 L400 A401 K402	P149-F404 CarbonylContact C-O 3.48Å; P149-F404 WeakPolarHBondContact CA-O 3.4Å; I150-F404 WeakPolarHBondContact CG1-O 3.43Å; I150-F404 PolarHBondContact N-O 3.37Å; L400-F404 WeakPolarHBondContact O-CD2 3.43Å; A401-F404 CarbonylContact O-C 3.45Å; A401-F404 PolarHBondContact O-N 2.91Å; K402-F404 VanDerWaalsContact C-N 3.31Å
405	F	84.5	Confident	81.4	Confident	57 Å²	57	80.1 Å²	80.1	25%	0.25	38%	0.377	C	S	.	.			trans	-133.3	133.9	-175	-55.6	-75.6	0	0	0	110.9	A147 P149 A401 V407 V408	A147-F405 HydrophobicContact CB-CD1 3.99Å; A147-F405 HydrophobicContact CB-CE1 4.29Å; A147-F405 WeakPolarHBondContact O-CE1 3.42Å; P149-F405 HydrophobicContact CB-CE1 4.44Å; P149-F405 HydrophobicContact CG-CE1 3.95Å; P149-F405 HydrophobicContact CG-CZ 4.1Å; A401-F405 PolarHBondContact O-N 3.37Å; F405-V407 PolarHBondContact O-N 3.03Å; F405-V408 HydrophobicContact CB-CG2 4.46Å
406	N	72.8	Confident	80.4	Confident	115 Å²	115	79.1 Å²	79.1	62%	0.615	37%	0.374	S	S	*	.	S	Bend	trans	-66	-28.2	175.9	-66.6	-27.1	0	0	0	112.2	I150 Q153	I150-N406 WeakPolarHBondContact CD1-OD1 3.33Å; I150-N406 WeakPolarHBondContact CG1-OD1 3.48Å; Q153-N406 PolarHBondContact NE2-ND2 3.06Å; Q153-N406 PolarHBondContact OE1-ND2 3.16Å
407	V	62	Low	79.4	Confident	105 Å²	105	82.2 Å²	82.2	64%	0.636	39%	0.387	S	S	*	.			trans	-114.6	110.9	177.4	-177.2	0	0	0	0	107.6	F405 E409	F405-V407 PolarHBondContact O-N 3.03Å; V407-E409 HydrophobicContact CG1-CG 3.97Å
408	V	55.4	Low	78.3	Confident	30 Å²	30	85.1 Å²	85.1	18%	0.182	41%	0.405	C	S	.	.			trans	-113.4	84.3	168.3	-174	0	0	0	0	106.8	A401 K402 F405	A401-V408 VanDerWaalsContact C-CG2 3.47Å; A401-V408 HydrophobicContact CB-CB 4.45Å; A401-V408 HydrophobicContact CB-CG1 3.75Å; A401-V408 HydrophobicContact CB-CG2 3.75Å; K402-V408 HydrophobicContact CB-CG2 4.17Å; K402-V408 HydrophobicContact CG-CB 4.08Å; K402-V408 HydrophobicContact CG-CG2 3.57Å; F405-V408 HydrophobicContact CB-CG2 4.46Å
409	E	52.6	Low	77.1	Confident	101 Å²	101	90.5 Å²	90.5	47%	0.472	43%	0.431	S	S	.	.			trans	-58.4	0	162.7	-73.4	175.6	178	0	0	108.8	R212 L213 Q216 R397 V407	R212-E409 PolarHBondContact NH2-OXT 3.36Å; L213-E409 HydrophobicContact CD1-CB 3.93Å; L213-E409 HydrophobicContact CD2-CB 4.32Å; Q216-E409 PolarHBondContact NE2-OE2 3.02Å; R397-E409 PolarHBondContact NH1-O 3.15Å; R397-E409 PolarHBondContact NH2-O 3.32Å; V407-E409 HydrophobicContact CG1-CG 3.97Å

Retrieved 409 of 409 residues in 474.5 ms (Link to these results)

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