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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 (A0A3B3UF55), UniProt , Accession A0A087XW86, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 406 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	52.9	Low	83.4	Confident	185 Å²	185	76.2 Å²	76.2	91%	0.911	44%	0.442	S	S	*	.				0	129.5	0	-78.5	167.5	163.6	0	0	108
2	S	61.4	Low	84.6	Confident	75 Å²	75	69.8 Å²	69.8	52%	0.524	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-56.7	157.4	165.4	41.2	0	0	0	0	109.6	R216	S2-R216 PolarHBondContact O-NH1 3.37Å; S2-R216 PolarHBondContact OG-NH2 3.46Å
3	P	72.4	Confident	85.6	Confident	116 Å²	116	68.8 Å²	68.8	75%	0.753	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-66.5	152.8	174.1	26.6	-32.9	0	0	0	111
4	V	78.4	Confident	86.6	Confident	52 Å²	52	73.5 Å²	73.5	32%	0.315	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-54.1	135.8	168.9	174.4	0	0	0	0	108.3	V6 L9 L211	V4-V6 HydrophobicContact CB-CG2 4.29Å; V4-V6 HydrophobicContact CG1-CG2 4.23Å; V4-V6 PolarHBondContact O-N 3.48Å; V4-L9 HydrophobicContact CG1-CD1 4.12Å; V4-L211 HydrophobicContact CG1-CD1 4.45Å
5	P	83.9	Confident	87.4	Confident	41 Å²	41	70.8 Å²	70.8	27%	0.266	40%	0.4	S	S	.	.			trans	-74.5	72.7	176.8	30	-33	0	0	0	110.3	L7 P8 L9 V220	P5-L7 VanDerWaalsContact C-N 3.29Å; P5-L7 PolarHBondContact O-N 3.36Å; P5-P8 HydrophobicContact CB-CB 4.49Å; P5-P8 HydrophobicContact CB-CG 3.98Å; P5-P8 WeakPolarHBondContact O-CD 3.21Å; P5-L9 PolarHBondContact O-N 3.49Å; P5-V220 HydrophobicContact CG-CB 4.46Å; P5-V220 HydrophobicContact CG-CG1 3.61Å; P5-V220 HydrophobicContact CG-CG2 4.04Å
6	V	90.3	Very high	88.1	Confident	94 Å²	94	66.4 Å²	66.4	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-60.1	-41.7	-177.5	178.1	0	0	0	0	110.7	V4 L9 V10	V4-V6 HydrophobicContact CB-CG2 4.29Å; V4-V6 HydrophobicContact CG1-CG2 4.23Å; V4-V6 PolarHBondContact O-N 3.48Å; V6-L9 PolarHBondContact O-N 3.41Å; V6-V10 HydrophobicContact CG1-CG2 4.02Å; V6-V10 VanDerWaalsContact O-CG2 3.3Å; V6-V10 WeakPolarHBondContact O-CG2 3.37Å; V6-V10 PolarHBondContact O-N 3.27Å
7	L	92.7	Very high	88.7	Confident	110 Å²	110	64.8 Å²	64.8	58%	0.576	37%	0.372	S	S	*	.	H	α-helix	trans	-62.1	-51.3	-177.1	176.5	67.2	0	0	0	112.5	P5 L9 V10 I11	P5-L7 VanDerWaalsContact C-N 3.29Å; P5-L7 PolarHBondContact O-N 3.36Å; L7-L9 VanDerWaalsContact C-N 3.32Å; L7-L9 PolarHBondContact O-N 3.02Å; L7-V10 PolarHBondContact O-N 2.86Å; L7-I11 HydrophobicContact CD1-CD1 3.85Å; L7-I11 HydrophobicContact CD1-CG1 4.2Å; L7-I11 HydrophobicContact CG-CD1 3.89Å; L7-I11 WeakPolarHBondContact O-CG1 3.36Å; L7-I11 PolarHBondContact O-N 3.22Å
8	P	94.5	Very high	89.2	Confident	14 Å²	14	65.6 Å²	65.6	9%	0.091	37%	0.374	C	S	.	.	H	α-helix	trans	-54.7	-42.6	171.8	-31.3	36.8	0	0	0	114.3	P5 I11 S12 F71 V74 Y224	P5-P8 HydrophobicContact CB-CB 4.49Å; P5-P8 HydrophobicContact CB-CG 3.98Å; P5-P8 WeakPolarHBondContact O-CD 3.21Å; P8-I11 PolarHBondContact O-N 2.94Å; P8-S12 WeakPolarHBondContact O-CB 3.46Å; P8-S12 PolarHBondContact O-N 3.23Å; P8-F71 HydrophobicContact CB-CZ 4.15Å; P8-F71 VanDerWaalsContact O-CE2 3.22Å; P8-F71 WeakPolarHBondContact O-CE2 3.43Å; P8-F71 WeakPolarHBondContact O-CZ 3.12Å; P8-V74 HydrophobicContact CB-CG1 4.1Å; P8-V74 HydrophobicContact CG-CG1 4.36Å; P8-Y224 HydrophobicContact CB-CE1 3.84Å; P8-Y224 WeakPolarHBondContact CB-OH 3.47Å
9	L	96.2	Very high	89.7	Confident	21 Å²	21	62.4 Å²	62.4	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-66.1	-39.4	178.9	-68.3	174.4	0	0	0	112.5	V4 P5 V6 L7 S12 C13 L223 Y224 I227	V4-L9 HydrophobicContact CG1-CD1 4.12Å; P5-L9 PolarHBondContact O-N 3.49Å; V6-L9 PolarHBondContact O-N 3.41Å; L7-L9 VanDerWaalsContact C-N 3.32Å; L7-L9 PolarHBondContact O-N 3.02Å; L9-S12 PolarHBondContact O-N 2.88Å; L9-C13 PolarHBondContact O-N 3.28Å; L9-C13 PolarHBondContact O-SG 2.91Å; L9-L223 HydrophobicContact CD1-CD1 4.42Å; L9-L223 HydrophobicContact CD2-CB 3.77Å; L9-L223 HydrophobicContact CD2-CD1 4.15Å; L9-Y224 HydrophobicContact CD2-CD1 3.97Å; L9-Y224 HydrophobicContact CD2-CE1 3.81Å; L9-Y224 HydrophobicContact CG-CE1 4.35Å; L9-I227 HydrophobicContact CD2-CD1 4.42Å
10	V	97	Very high	90.2	Very high	87 Å²	87	60.1 Å²	60.1	53%	0.527	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-45	175.4	169.2	0	0	0	0	111	V6 L7 S12 C13 F14	V6-V10 HydrophobicContact CG1-CG2 4.02Å; V6-V10 VanDerWaalsContact O-CG2 3.3Å; V6-V10 WeakPolarHBondContact O-CG2 3.37Å; V6-V10 PolarHBondContact O-N 3.27Å; L7-V10 PolarHBondContact O-N 2.86Å; V10-S12 VanDerWaalsContact C-N 3.34Å; V10-S12 PolarHBondContact O-N 2.86Å; V10-C13 PolarHBondContact O-N 3.35Å; V10-F14 PolarHBondContact O-N 3.34Å
11	I	97.6	Very high	90.6	Very high	43 Å²	43	62 Å²	62	22%	0.221	35%	0.352	C	S	.	.	H	α-helix	trans	-62.3	-43.8	176.5	-67.8	167.2	0	0	0	110.3	L7 P8 C13 F14 M15 F71 V74 L77	L7-I11 HydrophobicContact CD1-CD1 3.85Å; L7-I11 HydrophobicContact CD1-CG1 4.2Å; L7-I11 HydrophobicContact CG-CD1 3.89Å; L7-I11 WeakPolarHBondContact O-CG1 3.36Å; L7-I11 PolarHBondContact O-N 3.22Å; P8-I11 PolarHBondContact O-N 2.94Å; I11-C13 PolarHBondContact O-N 2.85Å; I11-F14 PolarHBondContact O-N 3Å; I11-M15 HydrophobicContact CG2-CG 4.21Å; I11-M15 HydrophobicContact CG2-SD 3.7Å; I11-M15 WeakPolarHBondContact O-CB 3.27Å; I11-M15 WeakPolarHBondContact O-CG 3.49Å; I11-M15 PolarHBondContact O-N 3.49Å; I11-F71 HydrophobicContact CB-CE2 4.47Å; I11-F71 HydrophobicContact CG2-CD2 4.26Å; I11-F71 HydrophobicContact CG2-CE2 4.3Å; I11-V74 HydrophobicContact CB-CG1 4Å; I11-V74 HydrophobicContact CD1-CG1 3.59Å; I11-V74 HydrophobicContact CG1-CG1 4.39Å; I11-V74 HydrophobicContact CG2-CG1 3.94Å; I11-V74 HydrophobicContact CG2-CG2 3.98Å; I11-L77 HydrophobicContact CD1-CD1 4.34Å
12	S	97.7	Very high	92.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.7	-46.2	175	-176.2	0	0	0	0	111.6	P8 L9 V10 F14 M15 S16	P8-S12 WeakPolarHBondContact O-CB 3.46Å; P8-S12 PolarHBondContact O-N 3.23Å; L9-S12 PolarHBondContact O-N 2.88Å; V10-S12 VanDerWaalsContact C-N 3.34Å; V10-S12 PolarHBondContact O-N 2.86Å; S12-F14 PolarHBondContact O-N 2.81Å; S12-M15 PolarHBondContact O-N 3.09Å; S12-S16 WeakPolarHBondContact O-CB 3.28Å; S12-S16 PolarHBondContact O-N 3.27Å; S12-S16 PolarHBondContact O-OG 3.26Å
13	C	98.3	Very high	94.6	Very high	56 Å²	56	51.3 Å²	51.3	38%	0.378	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-45.3	176	-68.9	0	0	0	0	112.2	L9 V10 I11 S16 A17	L9-C13 PolarHBondContact O-N 3.28Å; L9-C13 PolarHBondContact O-SG 2.91Å; V10-C13 PolarHBondContact O-N 3.35Å; I11-C13 PolarHBondContact O-N 2.85Å; C13-S16 PolarHBondContact O-N 3.3Å; C13-A17 PolarHBondContact O-N 2.84Å
14	F	98.5	Very high	95.8	Very high	135 Å²	135	48.6 Å²	48.6	59%	0.592	28%	0.276	S	S	*	.	H	α-helix	trans	-62.8	-50	179.2	176.9	-104.4	0	0	0	111.7	V10 I11 S12 S16 A17 L18	V10-F14 PolarHBondContact O-N 3.34Å; I11-F14 PolarHBondContact O-N 3Å; S12-F14 PolarHBondContact O-N 2.81Å; F14-S16 VanDerWaalsContact C-N 3.27Å; F14-S16 PolarHBondContact O-N 3.03Å; F14-A17 PolarHBondContact O-N 2.87Å; F14-L18 HydrophobicContact CD1-CD1 4.07Å; F14-L18 HydrophobicContact CE1-CD1 3.52Å; F14-L18 HydrophobicContact CE1-CG 4.23Å; F14-L18 HydrophobicContact CZ-CD1 3.86Å; F14-L18 HydrophobicContact CZ-CD2 4.37Å; F14-L18 HydrophobicContact CZ-CG 4.23Å; F14-L18 PolarHBondContact O-N 3.13Å
15	M	98.6	Very high	96.8	Very high	33 Å²	33	53.8 Å²	53.8	16%	0.163	30%	0.295	C	S	.	.	H	α-helix	trans	-62	-35.7	176.7	-67	176.7	68.4	0	0	112.1	I11 S12 L18 G19 I67 C70 F71	I11-M15 HydrophobicContact CG2-CG 4.21Å; I11-M15 HydrophobicContact CG2-SD 3.7Å; I11-M15 WeakPolarHBondContact O-CB 3.27Å; I11-M15 WeakPolarHBondContact O-CG 3.49Å; I11-M15 PolarHBondContact O-N 3.49Å; S12-M15 PolarHBondContact O-N 3.09Å; M15-L18 PolarHBondContact O-N 3.07Å; M15-G19 PolarHBondContact O-N 2.88Å; M15-I67 HydrophobicContact CB-CG2 4.03Å; M15-I67 HydrophobicContact CE-CG2 4.4Å; M15-I67 VanDerWaalsContact CE-O 3.25Å; M15-I67 WeakPolarHBondContact CE-O 3.45Å; M15-C70 HydrophobicContact CE-CB 3.38Å; M15-F71 HydrophobicContact CE-CB 4.2Å; M15-F71 HydrophobicContact SD-CB 4.27Å; M15-F71 HydrophobicContact SD-CD2 4.06Å
16	S	98.8	Very high	97.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.2	-39.2	176.1	-59.7	0	0	0	0	112.2	S12 C13 F14 G19 C20 P228 F231	S12-S16 WeakPolarHBondContact O-CB 3.28Å; S12-S16 PolarHBondContact O-N 3.27Å; S12-S16 PolarHBondContact O-OG 3.26Å; C13-S16 PolarHBondContact O-N 3.3Å; F14-S16 VanDerWaalsContact C-N 3.27Å; F14-S16 PolarHBondContact O-N 3.03Å; S16-G19 CarbonylContact O-C 3.59Å; S16-G19 WeakPolarHBondContact O-CA 3.32Å; S16-G19 PolarHBondContact O-N 3.45Å; S16-C20 PolarHBondContact O-N 2.9Å; S16-P228 VanDerWaalsContact OG-CA 3.23Å; S16-P228 WeakPolarHBondContact OG-CA 3.35Å; S16-P228 WeakPolarHBondContact OG-CD 3.29Å; S16-P228 WeakPolarHBondContact OG-CG 3.48Å; S16-F231 WeakPolarHBondContact O-CB 3.48Å
17	A	98.6	Very high	97.9	Very high	39 Å²	39	50.4 Å²	50.4	32%	0.322	27%	0.271	S	S	.	.	H	α-helix	trans	-64.3	-42.8	173.3	0	0	0	0	0	111.9	C13 F14 G19 C20 M21	C13-A17 PolarHBondContact O-N 2.84Å; F14-A17 PolarHBondContact O-N 2.87Å; A17-G19 VanDerWaalsContact C-N 3.3Å; A17-G19 PolarHBondContact O-N 2.72Å; A17-C20 WeakPolarHBondContact O-CB 3.4Å; A17-C20 PolarHBondContact O-N 3.29Å; A17-M21 PolarHBondContact O-N 3.05Å; A17-M21 VanDerWaalsContact O-N 3.14Å
18	L	98.6	Very high	98.1	Very high	79 Å²	79	48.4 Å²	48.4	41%	0.414	26%	0.264	S	S	.	.	H	α-helix	trans	-59.2	-43.2	171	-67.5	178.8	0	0	0	111.5	F14 M15 M21 A22	F14-L18 HydrophobicContact CD1-CD1 4.07Å; F14-L18 HydrophobicContact CE1-CD1 3.52Å; F14-L18 HydrophobicContact CE1-CG 4.23Å; F14-L18 HydrophobicContact CZ-CD1 3.86Å; F14-L18 HydrophobicContact CZ-CD2 4.37Å; F14-L18 HydrophobicContact CZ-CG 4.23Å; F14-L18 PolarHBondContact O-N 3.13Å; M15-L18 PolarHBondContact O-N 3.07Å; L18-M21 HydrophobicContact CD2-CE 3.48Å; L18-M21 VanDerWaalsContact CD2-CE 3.48Å; L18-M21 HydrophobicContact CG-CE 4.49Å; L18-M21 PolarHBondContact O-N 3.31Å; L18-A22 PolarHBondContact O-N 2.79Å
19	G	98.7	Very high	98.3	Very high	5 Å²	5	50.9 Å²	50.9	5%	0.052	29%	0.286	C	S	.	.	H	α-helix	trans	-56.4	-47.1	173.6	0	0	0	0	0	113.4	M15 S16 A17 M21 A22 T23	M15-G19 PolarHBondContact O-N 2.88Å; S16-G19 CarbonylContact O-C 3.59Å; S16-G19 WeakPolarHBondContact O-CA 3.32Å; S16-G19 PolarHBondContact O-N 3.45Å; A17-G19 VanDerWaalsContact C-N 3.3Å; A17-G19 PolarHBondContact O-N 2.72Å; G19-M21 VanDerWaalsContact C-N 3.34Å; G19-M21 PolarHBondContact O-N 3.19Å; G19-A22 WeakPolarHBondContact O-CB 3.18Å; G19-A22 PolarHBondContact O-N 2.92Å; G19-A22 VanDerWaalsContact O-N 3.16Å; G19-T23 PolarHBondContact O-N 2.9Å; G19-T23 PolarHBondContact O-OG1 2.73Å; G19-T23 VanDerWaalsContact O-OG1 3.11Å
20	C	98.8	Very high	98.4	Very high	16 Å²	16	54.1 Å²	54.1	11%	0.108	30%	0.299	C	S	.	.	H	α-helix	trans	-55.9	-48.7	175.4	-168.3	0	0	0	0	111.3	S16 A17 A22 T23 L24 F231 A235	S16-C20 PolarHBondContact O-N 2.9Å; A17-C20 WeakPolarHBondContact O-CB 3.4Å; A17-C20 PolarHBondContact O-N 3.29Å; C20-A22 VanDerWaalsContact C-N 3.34Å; C20-A22 PolarHBondContact O-N 3.1Å; C20-T23 PolarHBondContact O-N 3.14Å; C20-L24 WeakPolarHBondContact O-CB 3.37Å; C20-L24 WeakPolarHBondContact O-CG 3.3Å; C20-L24 PolarHBondContact O-N 3.18Å; C20-F231 HydrophobicContact CB-CB 4.09Å; C20-F231 HydrophobicContact CB-CD1 3.95Å; C20-F231 PolarHBondContact SG-O 2.93Å; C20-A235 WeakPolarHBondContact O-CB 3.49Å
21	M	98.7	Very high	98.3	Very high	102 Å²	102	54.5 Å²	54.5	50%	0.502	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-38.9	177.1	-66.2	-170.8	-64.6	0	0	112.5	A17 L18 G19 K25	A17-M21 PolarHBondContact O-N 3.05Å; A17-M21 VanDerWaalsContact O-N 3.14Å; L18-M21 HydrophobicContact CD2-CE 3.48Å; L18-M21 VanDerWaalsContact CD2-CE 3.48Å; L18-M21 HydrophobicContact CG-CE 4.49Å; L18-M21 PolarHBondContact O-N 3.31Å; G19-M21 VanDerWaalsContact C-N 3.34Å; G19-M21 PolarHBondContact O-N 3.19Å; M21-K25 WeakPolarHBondContact O-CG 3.27Å; M21-K25 PolarHBondContact O-N 2.93Å
22	A	98.7	Very high	98.3	Very high	35 Å²	35	58.1 Å²	58.1	29%	0.289	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-51	175.3	0	0	0	0	0	110.6	L18 G19 C20 L24 K25 L26 V63	L18-A22 PolarHBondContact O-N 2.79Å; G19-A22 WeakPolarHBondContact O-CB 3.18Å; G19-A22 PolarHBondContact O-N 2.92Å; G19-A22 VanDerWaalsContact O-N 3.16Å; C20-A22 VanDerWaalsContact C-N 3.34Å; C20-A22 PolarHBondContact O-N 3.1Å; A22-L24 VanDerWaalsContact C-N 3.33Å; A22-L24 PolarHBondContact O-N 3.07Å; A22-K25 PolarHBondContact O-N 3.43Å; A22-K25 VanDerWaalsContact O-N 3.1Å; A22-L26 HydrophobicContact CB-CD1 4.43Å; A22-L26 WeakPolarHBondContact O-CB 3.37Å; A22-L26 WeakPolarHBondContact O-CG 3.24Å; A22-L26 PolarHBondContact O-N 2.85Å; A22-V63 HydrophobicContact CB-CG1 4.38Å
23	T	98.8	Very high	98.3	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.8	-42.5	177.8	-57.3	0	0	0	0	112	G19 C20 K25 L26 I27 V63 A235	G19-T23 PolarHBondContact O-N 2.9Å; G19-T23 PolarHBondContact O-OG1 2.73Å; G19-T23 VanDerWaalsContact O-OG1 3.11Å; C20-T23 PolarHBondContact O-N 3.14Å; T23-K25 VanDerWaalsContact C-N 3.26Å; T23-K25 PolarHBondContact O-N 2.9Å; T23-L26 PolarHBondContact O-N 2.66Å; T23-I27 HydrophobicContact CG2-CD1 3.6Å; T23-I27 HydrophobicContact CG2-CG1 4.15Å; T23-I27 WeakPolarHBondContact O-CG1 3.25Å; T23-I27 PolarHBondContact O-N 2.78Å; T23-I27 VanDerWaalsContact O-N 3.13Å; T23-V63 WeakPolarHBondContact OG1-CG1 3.27Å; T23-A235 HydrophobicContact CG2-CB 3.57Å
24	L	98.7	Very high	98.3	Very high	58 Å²	58	61.9 Å²	61.9	30%	0.304	33%	0.325	S	S	.	.	H	α-helix	trans	-58.1	-36.8	176.2	-79	173	0	0	0	112.8	C20 A22 P28 A235 Y238 H239	C20-L24 WeakPolarHBondContact O-CB 3.37Å; C20-L24 WeakPolarHBondContact O-CG 3.3Å; C20-L24 PolarHBondContact O-N 3.18Å; A22-L24 VanDerWaalsContact C-N 3.33Å; A22-L24 PolarHBondContact O-N 3.07Å; L24-P28 WeakPolarHBondContact O-CD 3.32Å; L24-P28 WeakPolarHBondContact O-CG 3.3Å; L24-A235 HydrophobicContact CD2-CB 3.98Å; L24-A235 HydrophobicContact CG-CB 3.71Å; L24-Y238 HydrophobicContact CD2-CD1 3.55Å; L24-Y238 HydrophobicContact CD2-CE1 4.3Å; L24-Y238 HydrophobicContact CD2-CG 3.77Å; L24-H239 PolarHBondContact O-NE2 3.21Å
25	K	98.6	Very high	98.3	Very high	162 Å²	162	57.5 Å²	57.5	70%	0.704	31%	0.307	S	S	*	.	H	α-helix	trans	-84.4	-38.2	179.5	-70.6	-178.6	179.9	-178.7	0	113.2	M21 A22 T23 P28 A29	M21-K25 WeakPolarHBondContact O-CG 3.27Å; M21-K25 PolarHBondContact O-N 2.93Å; A22-K25 PolarHBondContact O-N 3.43Å; A22-K25 VanDerWaalsContact O-N 3.1Å; T23-K25 VanDerWaalsContact C-N 3.26Å; T23-K25 PolarHBondContact O-N 2.9Å; K25-P28 WeakPolarHBondContact O-CD 3.47Å; K25-P28 WeakPolarHBondContact O-CG 3.44Å; K25-A29 WeakPolarHBondContact O-CB 3.29Å; K25-A29 PolarHBondContact O-N 3.29Å
26	L	98.7	Very high	98.2	Very high	64 Å²	64	60.4 Å²	60.4	34%	0.335	33%	0.331	S	S	.	.	H	α-helix	trans	-74	-37.7	-174.1	-68	175.6	0	0	0	112.4	A22 T23 A29 F30 I59 V63	A22-L26 HydrophobicContact CB-CD1 4.43Å; A22-L26 WeakPolarHBondContact O-CB 3.37Å; A22-L26 WeakPolarHBondContact O-CG 3.24Å; A22-L26 PolarHBondContact O-N 2.85Å; T23-L26 PolarHBondContact O-N 2.66Å; L26-A29 PolarHBondContact O-N 3.01Å; L26-A29 VanDerWaalsContact O-N 3.15Å; L26-F30 HydrophobicContact CB-CD2 4.29Å; L26-F30 HydrophobicContact CB-CE2 4.49Å; L26-F30 HydrophobicContact CD2-CE2 4.03Å; L26-F30 WeakPolarHBondContact O-CD2 3.33Å; L26-F30 PolarHBondContact O-N 3.3Å; L26-I59 HydrophobicContact CB-CG2 3.78Å; L26-V63 HydrophobicContact CD1-CG2 3.83Å
27	I	98.6	Very high	98.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-52.2	-56.4	177.8	-73.8	172.7	0	0	0	112.2	T23 A29 F30 K31 Q56 I59 L236 H239 V246	T23-I27 HydrophobicContact CG2-CD1 3.6Å; T23-I27 HydrophobicContact CG2-CG1 4.15Å; T23-I27 WeakPolarHBondContact O-CG1 3.25Å; T23-I27 PolarHBondContact O-N 2.78Å; T23-I27 VanDerWaalsContact O-N 3.13Å; I27-A29 VanDerWaalsContact C-N 3.34Å; I27-A29 PolarHBondContact O-N 3.45Å; I27-F30 PolarHBondContact O-N 3.18Å; I27-K31 PolarHBondContact O-N 2.79Å; I27-Q56 HydrophobicContact CG2-CG 4.49Å; I27-I59 HydrophobicContact CG1-CB 4.28Å; I27-I59 HydrophobicContact CG1-CD1 4.28Å; I27-I59 HydrophobicContact CG1-CG2 4.08Å; I27-L236 HydrophobicContact CD1-CB 4.31Å; I27-L236 HydrophobicContact CD1-CD1 3.78Å; I27-H239 HydrophobicContact CG2-CB 4.11Å; I27-V246 HydrophobicContact CG2-CG1 3.63Å; I27-V246 HydrophobicContact CG2-CG2 4.27Å
28	P	98	Very high	98.1	Very high	68 Å²	68	71.5 Å²	71.5	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-68.4	-32.6	177.8	25.3	-33.5	0	0	0	112.7	L24 K25 F30 K31	L24-P28 WeakPolarHBondContact O-CD 3.32Å; L24-P28 WeakPolarHBondContact O-CG 3.3Å; K25-P28 WeakPolarHBondContact O-CD 3.47Å; K25-P28 WeakPolarHBondContact O-CG 3.44Å; P28-F30 VanDerWaalsContact C-N 3.29Å; P28-F30 PolarHBondContact O-N 3.22Å; P28-K31 VanDerWaalsContact O-CB 3.25Å; P28-K31 WeakPolarHBondContact O-CB 3.22Å; P28-K31 PolarHBondContact O-N 3.31Å
29	A	98.3	Very high	98.1	Very high	65 Å²	65	69 Å²	69	54%	0.537	37%	0.365	S	S	.	.	H	α-helix	trans	-64.3	-32.4	179.6	0	0	0	0	0	113.1	K25 L26 I27	K25-A29 WeakPolarHBondContact O-CB 3.29Å; K25-A29 PolarHBondContact O-N 3.29Å; L26-A29 PolarHBondContact O-N 3.01Å; L26-A29 VanDerWaalsContact O-N 3.15Å; I27-A29 VanDerWaalsContact C-N 3.34Å; I27-A29 PolarHBondContact O-N 3.45Å
30	F	97.9	Very high	98	Very high	89 Å²	89	72.5 Å²	72.5	39%	0.39	38%	0.377	S	S	.	.	H	α-helix	trans	-90.9	-4.2	177.6	-79.7	-76.5	0	0	0	114.1	L26 I27 P28 D32 H33 F34 I59	L26-F30 HydrophobicContact CB-CD2 4.29Å; L26-F30 HydrophobicContact CB-CE2 4.49Å; L26-F30 HydrophobicContact CD2-CE2 4.03Å; L26-F30 WeakPolarHBondContact O-CD2 3.33Å; L26-F30 PolarHBondContact O-N 3.3Å; I27-F30 PolarHBondContact O-N 3.18Å; P28-F30 VanDerWaalsContact C-N 3.29Å; P28-F30 PolarHBondContact O-N 3.22Å; F30-D32 VanDerWaalsContact C-N 3.33Å; F30-D32 PolarHBondContact O-N 2.87Å; F30-D32 VanDerWaalsContact O-N 3.17Å; F30-H33 HydrophobicContact CD1-CB 4.41Å; F30-H33 WeakPolarHBondContact O-CB 3.49Å; F30-H33 PolarHBondContact O-N 3.39Å; F30-F34 HydrophobicContact CB-CD2 4.16Å; F30-F34 HydrophobicContact CB-CE2 3.99Å; F30-F34 WeakPolarHBondContact O-CD2 3.32Å; F30-F34 PolarHBondContact O-N 3.46Å; F30-I59 HydrophobicContact CB-CD1 3.76Å; F30-I59 HydrophobicContact CD2-CD1 4.22Å; F30-I59 HydrophobicContact CG-CD1 4.3Å
31	K	96.4	Very high	97.9	Very high	96 Å²	96	72.4 Å²	72.4	42%	0.417	38%	0.379	S	S	.	.	H	α-helix	trans	-44.9	-54	-176.6	176.9	177.7	178	-177	0	113	I27 P28 H33 F34 I35 P53	I27-K31 PolarHBondContact O-N 2.79Å; P28-K31 VanDerWaalsContact O-CB 3.25Å; P28-K31 WeakPolarHBondContact O-CB 3.22Å; P28-K31 PolarHBondContact O-N 3.31Å; K31-H33 VanDerWaalsContact C-N 3.26Å; K31-H33 PolarHBondContact O-N 3.24Å; K31-F34 PolarHBondContact O-N 3.17Å; K31-I35 HydrophobicContact CG-CG1 4.44Å; K31-I35 WeakPolarHBondContact O-CG1 3.34Å; K31-I35 PolarHBondContact O-N 3.22Å; K31-P53 HydrophobicContact CG-CG 4.18Å
32	D	96.7	Very high	97.7	Very high	119 Å²	119	72.3 Å²	72.3	64%	0.636	38%	0.378	S	S	*	.	H	α-helix	trans	-65.6	-29.8	-175.1	-64.4	-28.7	0	0	0	112.7	F30 I35 S36	F30-D32 VanDerWaalsContact C-N 3.33Å; F30-D32 PolarHBondContact O-N 2.87Å; F30-D32 VanDerWaalsContact O-N 3.17Å; D32-I35 PolarHBondContact O-N 2.91Å; D32-S36 VanDerWaalsContact O-CB 3.26Å; D32-S36 WeakPolarHBondContact O-CB 3.28Å; D32-S36 PolarHBondContact O-N 3.09Å; D32-S36 PolarHBondContact O-OG 3.43Å
33	H	98	Very high	97.5	Very high	115 Å²	115	71 Å²	71	53%	0.532	37%	0.366	S	S	.	.	H	α-helix	trans	-65	-46.4	175.6	-64.1	68.9	0	0	0	110.3	F30 K31 S36 A37	F30-H33 HydrophobicContact CD1-CB 4.41Å; F30-H33 WeakPolarHBondContact O-CB 3.49Å; F30-H33 PolarHBondContact O-N 3.39Å; K31-H33 VanDerWaalsContact C-N 3.26Å; K31-H33 PolarHBondContact O-N 3.24Å; H33-S36 PolarHBondContact O-N 3.28Å; H33-S36 PolarHBondContact O-OG 3.45Å; H33-A37 WeakPolarHBondContact O-CB 3.42Å; H33-A37 PolarHBondContact O-N 3.19Å
34	F	98.3	Very high	97.3	Very high	20 Å²	20	75.2 Å²	75.2	9%	0.088	39%	0.388	C	S	.	.	H	α-helix	trans	-63.7	-43.4	176.9	-78.8	-101.5	0	0	0	112	F30 K31 S36 A37 R38 L39 P53 E54 Q56 V58 I59 F111	F30-F34 HydrophobicContact CB-CD2 4.16Å; F30-F34 HydrophobicContact CB-CE2 3.99Å; F30-F34 WeakPolarHBondContact O-CD2 3.32Å; F30-F34 PolarHBondContact O-N 3.46Å; K31-F34 PolarHBondContact O-N 3.17Å; F34-S36 VanDerWaalsContact C-N 3.34Å; F34-S36 PolarHBondContact O-N 2.85Å; F34-A37 PolarHBondContact O-N 3.36Å; F34-R38 PolarHBondContact O-N 2.91Å; F34-L39 HydrophobicContact CB-CB 4.34Å; F34-L39 HydrophobicContact CD1-CB 3.83Å; F34-L39 HydrophobicContact CD1-CD1 3.98Å; F34-L39 HydrophobicContact CE1-CD1 4.26Å; F34-L39 PolarHBondContact O-N 3.3Å; F34-P53 HydrophobicContact CB-CB 3.92Å; F34-E54 WeakPolarHBondContact CD1-O 3.28Å; F34-Q56 VanDerWaalsContact CE1-NE2 3.27Å; F34-V58 HydrophobicContact CE1-CG1 3.94Å; F34-V58 HydrophobicContact CZ-CG1 3.49Å; F34-V58 VanDerWaalsContact CZ-CG1 3.49Å; F34-I59 HydrophobicContact CE2-CD1 3.89Å; F34-I59 HydrophobicContact CE2-CG1 4.25Å; F34-I59 HydrophobicContact CZ-CD1 4.3Å; F34-I59 HydrophobicContact CZ-CG1 4.23Å; F34-F111 HydrophobicContact CE1-CE2 4.37Å
35	I	97.8	Very high	97.1	Very high	42 Å²	42	72.8 Å²	72.8	22%	0.215	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-45	175.3	-60.4	-52.8	0	0	0	110.7	K31 D32 A37 R38 Y40 K51 P53	K31-I35 HydrophobicContact CG-CG1 4.44Å; K31-I35 WeakPolarHBondContact O-CG1 3.34Å; K31-I35 PolarHBondContact O-N 3.22Å; D32-I35 PolarHBondContact O-N 2.91Å; I35-A37 VanDerWaalsContact C-N 3.33Å; I35-A37 PolarHBondContact O-N 2.91Å; I35-R38 PolarHBondContact O-N 2.97Å; I35-R38 VanDerWaalsContact O-N 3.09Å; I35-Y40 HydrophobicContact CD1-CD1 4.39Å; I35-Y40 HydrophobicContact CD1-CG 4.27Å; I35-K51 HydrophobicContact CD1-CB 4.13Å; I35-P53 HydrophobicContact CD1-CB 4.12Å
36	S	97.6	Very high	96.8	Very high	94 Å²	94	67 Å²	67	66%	0.657	35%	0.35	S	S	*	.	H	α-helix	trans	-64.8	-35.4	179.1	76.1	0	0	0	0	112.9	D32 H33 F34 R38	D32-S36 VanDerWaalsContact O-CB 3.26Å; D32-S36 WeakPolarHBondContact O-CB 3.28Å; D32-S36 PolarHBondContact O-N 3.09Å; D32-S36 PolarHBondContact O-OG 3.43Å; H33-S36 PolarHBondContact O-N 3.28Å; H33-S36 PolarHBondContact O-OG 3.45Å; F34-S36 VanDerWaalsContact C-N 3.34Å; F34-S36 PolarHBondContact O-N 2.85Å; S36-R38 PolarHBondContact O-N 2.85Å
37	A	97.4	Very high	96.4	Very high	62 Å²	62	69.1 Å²	69.1	51%	0.512	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	1.2	175.2	0	0	0	0	0	113.5	H33 F34 I35 L39	H33-A37 WeakPolarHBondContact O-CB 3.42Å; H33-A37 PolarHBondContact O-N 3.19Å; F34-A37 PolarHBondContact O-N 3.36Å; I35-A37 VanDerWaalsContact C-N 3.33Å; I35-A37 PolarHBondContact O-N 2.91Å; A37-L39 HydrophobicContact CB-CD1 4.36Å; A37-L39 HydrophobicContact CB-CG 4.33Å; A37-L39 PolarHBondContact O-N 3.22Å
38	R	97.4	Very high	96	Very high	210 Å²	210	73 Å²	73	79%	0.792	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	23.5	-175	-51.9	-178.1	177.6	-170.8	-0.7	114.3	F34 I35 S36 Y40	F34-R38 PolarHBondContact O-N 2.91Å; I35-R38 PolarHBondContact O-N 2.97Å; I35-R38 VanDerWaalsContact O-N 3.09Å; S36-R38 PolarHBondContact O-N 2.85Å; R38-Y40 VanDerWaalsContact C-N 3.31Å; R38-Y40 HydrophobicContact CB-CE1 4.24Å; R38-Y40 PolarHBondContact O-N 3.45Å
39	L	97.7	Very high	95.6	Very high	27 Å²	27	75 Å²	75	14%	0.141	39%	0.389	C	S	.	.			trans	-89.3	73.4	171.2	-65.4	175.2	0	0	0	109	F34 A37 E54 F111 V115	F34-L39 HydrophobicContact CB-CB 4.34Å; F34-L39 HydrophobicContact CD1-CB 3.83Å; F34-L39 HydrophobicContact CD1-CD1 3.98Å; F34-L39 HydrophobicContact CE1-CD1 4.26Å; F34-L39 PolarHBondContact O-N 3.3Å; A37-L39 HydrophobicContact CB-CD1 4.36Å; A37-L39 HydrophobicContact CB-CG 4.33Å; A37-L39 PolarHBondContact O-N 3.22Å; L39-E54 PolarHBondContact O-N 2.81Å; L39-F111 HydrophobicContact CD1-CE2 3.89Å; L39-F111 HydrophobicContact CD1-CZ 3.85Å; L39-V115 HydrophobicContact CD1-CG2 4.34Å; L39-V115 HydrophobicContact CD2-CG2 3.91Å
40	Y	97.4	Very high	95.4	Very high	79 Å²	79	77 Å²	77	31%	0.31	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	152.4	178.1	67	-102	0	0	0	111.4	I35 R38 K51 V52	I35-Y40 HydrophobicContact CD1-CD1 4.39Å; I35-Y40 HydrophobicContact CD1-CG 4.27Å; R38-Y40 VanDerWaalsContact C-N 3.31Å; R38-Y40 HydrophobicContact CB-CE1 4.24Å; R38-Y40 PolarHBondContact O-N 3.45Å; Y40-K51 HydrophobicContact CD1-CD 4.05Å; Y40-K51 HydrophobicContact CD2-CB 3.72Å; Y40-K51 HydrophobicContact CD2-CD 3.8Å; Y40-K51 HydrophobicContact CD2-CG 3.6Å; Y40-K51 HydrophobicContact CE1-CD 3.75Å; Y40-K51 HydrophobicContact CE2-CB 4.26Å; Y40-K51 HydrophobicContact CE2-CD 3.53Å; Y40-K51 HydrophobicContact CE2-CG 3.6Å; Y40-K51 HydrophobicContact CG-CB 3.95Å; Y40-K51 HydrophobicContact CG-CD 4.08Å; Y40-K51 HydrophobicContact CG-CG 4.17Å; Y40-K51 VanDerWaalsContact CZ-CE 3.43Å; Y40-K51 VanDerWaalsContact OH-CE 3.32Å; Y40-K51 WeakPolarHBondContact OH-CE 3.43Å; Y40-K51 PolarHBondContact OH-NZ 2.8Å; Y40-V52 CarbonylContact C-O 3.59Å; Y40-V52 WeakPolarHBondContact CA-O 3.45Å; Y40-V52 VanDerWaalsContact CB-O 3.28Å; Y40-V52 WeakPolarHBondContact CB-O 3.44Å
41	G	95.5	Very high	95.4	Very high	14 Å²	14	78 Å²	78	14%	0.144	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	168.7	171.6	0	0	0	0	0	111.7	V52	G41-V52 PolarHBondContact N-O 3.44Å; G41-V52 PolarHBondContact O-N 2.8Å
42	M	95.5	Very high	95.5	Very high	99 Å²	99	74.3 Å²	74.3	49%	0.488	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	140.3	162.7	-66.7	179.8	-68.2	0	0	108	L44 K49	M42-L44 PolarHBondContact O-N 3.44Å; M42-K49 HydrophobicContact SD-CB 4.01Å; M42-K49 HydrophobicContact SD-CD 4.14Å; M42-K49 HydrophobicContact SD-CG 4.46Å
43	D	95.3	Very high	95.6	Very high	9 Å²	9	68.7 Å²	68.7	5%	0.048	35%	0.35	C	S	.	.			trans	-68.6	106.5	173	-165.8	-32.2	0	0	0	109.9	N45 K46 N189 F247	D43-N45 PolarHBondContact O-N 2.9Å; D43-N45 PolarHBondContact OD1-N 2.97Å; D43-K46 HydrophobicContact CB-CB 4.13Å; D43-K46 HydrophobicContact CB-CD 4.15Å; D43-K46 HydrophobicContact CB-CG 4.23Å; D43-K46 PolarHBondContact O-N 3.33Å; D43-K46 VanDerWaalsContact OD2-CD 3.23Å; D43-K46 WeakPolarHBondContact OD2-CD 3.37Å; D43-K46 WeakPolarHBondContact OD2-CE 3.21Å; D43-K46 IonicContact OD2-NZ 3.34Å; D43-K46 PolarHBondContact OD2-NZ 3.47Å; D43-N189 PolarHBondContact OD2-ND2 3.25Å; D43-N189 PolarHBondContact OD2-OD1 3.32Å; D43-F247 HydrophobicContact CB-CZ 3.93Å
44	L	93.2	Very high	95.5	Very high	87 Å²	87	65.9 Å²	65.9	46%	0.455	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.8	-176.3	-61.3	-179.9	0	0	0	112.4	M42 L302	M42-L44 PolarHBondContact O-N 3.44Å; L44-L302 HydrophobicContact CB-CD1 3.6Å; L44-L302 HydrophobicContact CD1-CD1 3.98Å; L44-L302 HydrophobicContact CD1-CD2 3.8Å; L44-L302 HydrophobicContact CG-CD1 4.45Å
45	N	94.2	Very high	95.5	Very high	8 Å²	8	65 Å²	65	4%	0.043	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	8.5	-179	-68.1	-24.7	0	0	0	112.8	D43 G187 L302 P303 L305 L312 E374	D43-N45 PolarHBondContact O-N 2.9Å; D43-N45 PolarHBondContact OD1-N 2.97Å; N45-G187 PolarHBondContact ND2-O 2.8Å; N45-L302 WeakPolarHBondContact OD1-CD1 3.43Å; N45-P303 PolarHBondContact OD1-O 3.32Å; N45-L305 WeakPolarHBondContact O-CD2 3.25Å; N45-L312 HydrophobicContact CB-CD2 3.92Å; N45-E374 PolarHBondContact ND2-OE1 3.04Å
46	K	92.1	Very high	95.6	Very high	39 Å²	39	63 Å²	63	17%	0.17	32%	0.323	C	S	.	.	S	Bend	trans	-123.5	152.5	174.8	-66.1	-177.9	-174.3	135.6	0	111.9	D43 K49 N189	D43-K46 HydrophobicContact CB-CB 4.13Å; D43-K46 HydrophobicContact CB-CD 4.15Å; D43-K46 HydrophobicContact CB-CG 4.23Å; D43-K46 PolarHBondContact O-N 3.33Å; D43-K46 VanDerWaalsContact OD2-CD 3.23Å; D43-K46 WeakPolarHBondContact OD2-CD 3.37Å; D43-K46 WeakPolarHBondContact OD2-CE 3.21Å; D43-K46 IonicContact OD2-NZ 3.34Å; D43-K46 PolarHBondContact OD2-NZ 3.47Å; K46-K49 PolarHBondContact O-NZ 2.94Å; K46-N189 WeakPolarHBondContact CE-ND2 3.45Å; K46-N189 PolarHBondContact NZ-ND2 3.23Å
47	T	90.5	Very high	95.6	Very high	109 Å²	109	58.5 Å²	58.5	67%	0.669	29%	0.292	S	S	*	.	S	Bend	trans	-70.2	-36.4	172.7	49.6	0	0	0	0	111.4	L305	T47-L305 HydrophobicContact CG2-CD2 3.9Å
48	N	90.2	Very high	95.7	Very high	83 Å²	83	56.7 Å²	56.7	44%	0.444	27%	0.274	S	S	.	.			trans	-64.7	134.8	173.6	-170.5	-8.7	0	0	0	110.8	D50	N48-D50 VanDerWaalsContact ND2-CG 3.35Å; N48-D50 PolarHBondContact ND2-OD2 3.33Å; N48-D50 PolarHBondContact OD1-N 2.94Å; N48-D50 PolarHBondContact OD1-OD1 3.16Å; N48-D50 PolarHBondContact OD1-OD2 3.43Å
49	K	91.1	Very high	95.8	Very high	110 Å²	110	47.3 Å²	47.3	48%	0.478	24%	0.24	S	C	.	.			trans	-110.2	23.4	-179.8	-58.5	-55.8	177.1	-158.2	0	113.1	M42 K46	M42-K49 HydrophobicContact SD-CB 4.01Å; M42-K49 HydrophobicContact SD-CD 4.14Å; M42-K49 HydrophobicContact SD-CG 4.46Å; K46-K49 PolarHBondContact O-NZ 2.94Å
50	D	94.3	Very high	95.8	Very high	106 Å²	106	46 Å²	46	57%	0.567	23%	0.233	S	C	*	.			trans	-55.4	144.2	170.4	-73.4	-20	0	0	0	111.5	N48 V52	N48-D50 VanDerWaalsContact ND2-CG 3.35Å; N48-D50 PolarHBondContact ND2-OD2 3.33Å; N48-D50 PolarHBondContact OD1-N 2.94Å; N48-D50 PolarHBondContact OD1-OD1 3.16Å; N48-D50 PolarHBondContact OD1-OD2 3.43Å; D50-V52 PolarHBondContact O-N 2.68Å
51	K	97.1	Very high	95.9	Very high	111 Å²	111	42.3 Å²	42.3	48%	0.483	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	121.8	177.8	-61	179.6	179.4	-171.3	0	109.6	I35 Y40	I35-K51 HydrophobicContact CD1-CB 4.13Å; Y40-K51 HydrophobicContact CD1-CD 4.05Å; Y40-K51 HydrophobicContact CD2-CB 3.72Å; Y40-K51 HydrophobicContact CD2-CD 3.8Å; Y40-K51 HydrophobicContact CD2-CG 3.6Å; Y40-K51 HydrophobicContact CE1-CD 3.75Å; Y40-K51 HydrophobicContact CE2-CB 4.26Å; Y40-K51 HydrophobicContact CE2-CD 3.53Å; Y40-K51 HydrophobicContact CE2-CG 3.6Å; Y40-K51 HydrophobicContact CG-CB 3.95Å; Y40-K51 HydrophobicContact CG-CD 4.08Å; Y40-K51 HydrophobicContact CG-CG 4.17Å; Y40-K51 VanDerWaalsContact CZ-CE 3.43Å; Y40-K51 VanDerWaalsContact OH-CE 3.32Å; Y40-K51 WeakPolarHBondContact OH-CE 3.43Å; Y40-K51 PolarHBondContact OH-NZ 2.8Å
52	V	98	Very high	96	Very high	17 Å²	17	44.7 Å²	44.7	10%	0.103	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125	176.4	178.1	0	0	0	0	107.8	Y40 G41 D50 E54 V246 F247	Y40-V52 CarbonylContact C-O 3.59Å; Y40-V52 WeakPolarHBondContact CA-O 3.45Å; Y40-V52 VanDerWaalsContact CB-O 3.28Å; Y40-V52 WeakPolarHBondContact CB-O 3.44Å; G41-V52 PolarHBondContact N-O 3.44Å; G41-V52 PolarHBondContact O-N 2.8Å; D50-V52 PolarHBondContact O-N 2.68Å; V52-E54 PolarHBondContact O-N 3.07Å; V52-V246 VanDerWaalsContact CG1-CA 3.48Å; V52-F247 HydrophobicContact CB-CD2 3.99Å; V52-F247 HydrophobicContact CB-CE2 3.65Å; V52-F247 HydrophobicContact CB-CZ 4.07Å; V52-F247 HydrophobicContact CG1-CD1 4.23Å; V52-F247 HydrophobicContact CG1-CD2 3.8Å; V52-F247 HydrophobicContact CG1-CE1 4.23Å; V52-F247 HydrophobicContact CG1-CE2 3.81Å; V52-F247 HydrophobicContact CG1-CG 4.01Å; V52-F247 HydrophobicContact CG1-CZ 4.01Å; V52-F247 HydrophobicContact CG2-CE2 4.34Å; V52-F247 HydrophobicContact CG2-CZ 4.35Å
53	P	98.2	Very high	96.2	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	132.6	-179.1	29.5	-38	0	0	0	110.5	K31 F34 I35 S245 V246 F247	K31-P53 HydrophobicContact CG-CG 4.18Å; F34-P53 HydrophobicContact CB-CB 3.92Å; I35-P53 HydrophobicContact CD1-CB 4.12Å; P53-S245 WeakPolarHBondContact CD-O 3.3Å; P53-V246 HydrophobicContact CG-CB 4.13Å; P53-V246 HydrophobicContact CG-CG1 3.72Å; P53-F247 PolarHBondContact O-N 3.43Å
54	E	97.8	Very high	96.4	Very high	56 Å²	56	40 Å²	40	26%	0.262	21%	0.208	S	C	.	.			trans	-94.3	172.3	-179.8	-160.7	78.1	-123.3	0	0	109.9	F34 L39 V52 Q56 F247	F34-E54 WeakPolarHBondContact CD1-O 3.28Å; L39-E54 PolarHBondContact O-N 2.81Å; V52-E54 PolarHBondContact O-N 3.07Å; E54-Q56 PolarHBondContact O-N 2.75Å; E54-Q56 VanDerWaalsContact O-N 3.08Å; E54-Q56 PolarHBondContact O-NE2 2.92Å; E54-F247 CarbonylContact C-O 3.36Å; E54-F247 WeakPolarHBondContact OE1-CB 3.49Å; E54-F247 WeakPolarHBondContact OE2-CD2 3.22Å
55	S	98.1	Very high	96.6	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	19%	0.19	C	C	.	.			trans	59	24.4	171.2	-52.6	0	0	0	0	115.1	G57 V58 D114 F247 V248	S55-G57 PolarHBondContact O-N 3.43Å; S55-G57 VanDerWaalsContact O-N 3.1Å; S55-V58 WeakPolarHBondContact O-CB 3.22Å; S55-V58 VanDerWaalsContact O-CG1 3.23Å; S55-V58 WeakPolarHBondContact O-CG1 3.42Å; S55-V58 PolarHBondContact O-N 2.85Å; S55-D114 WeakPolarHBondContact CB-OD2 3.47Å; S55-D114 WeakPolarHBondContact OG-CB 3.25Å; S55-D114 PolarHBondContact OG-OD2 2.69Å; S55-F247 PolarHBondContact N-O 3.02Å; S55-V248 CarbonylContact C-O 3.58Å; S55-V248 WeakPolarHBondContact CA-O 3.43Å
56	Q	98.7	Very high	96.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.4	179.6	-65.4	-51.4	-73.7	0	0	113.3	I27 F34 E54 V58 I59 L236 V246 F247	I27-Q56 HydrophobicContact CG2-CG 4.49Å; F34-Q56 VanDerWaalsContact CE1-NE2 3.27Å; E54-Q56 PolarHBondContact O-N 2.75Å; E54-Q56 VanDerWaalsContact O-N 3.08Å; E54-Q56 PolarHBondContact O-NE2 2.92Å; Q56-V58 PolarHBondContact O-N 3.26Å; Q56-V58 VanDerWaalsContact O-N 3.17Å; Q56-I59 PolarHBondContact O-N 2.87Å; Q56-I59 VanDerWaalsContact O-N 3.09Å; Q56-L236 HydrophobicContact CB-CD1 3.85Å; Q56-V246 HydrophobicContact CB-CB 4.19Å; Q56-V246 HydrophobicContact CB-CG2 4.07Å; Q56-V246 HydrophobicContact CG-CB 3.5Å; Q56-V246 VanDerWaalsContact CG-CB 3.5Å; Q56-V246 HydrophobicContact CG-CG1 3.85Å; Q56-V246 HydrophobicContact CG-CG2 3.93Å; Q56-F247 WeakPolarHBondContact CB-O 3.33Å; Q56-F247 PolarHBondContact N-O 3.1Å
57	G	98.6	Very high	97.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-52.2	-29.1	165.7	0	0	0	0	0	113.8	S55 I59 S60 G61 V248	S55-G57 PolarHBondContact O-N 3.43Å; S55-G57 VanDerWaalsContact O-N 3.1Å; G57-I59 VanDerWaalsContact C-N 3.33Å; G57-I59 PolarHBondContact O-N 3.35Å; G57-S60 WeakPolarHBondContact CA-OG 3.48Å; G57-S60 PolarHBondContact O-N 2.92Å; G57-S60 PolarHBondContact O-OG 3.49Å; G57-G61 PolarHBondContact O-N 3.25Å; G57-V248 PolarHBondContact N-O 2.72Å
58	V	98.8	Very high	97.5	Very high	24 Å²	24	34.3 Å²	34.3	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-38.4	177.7	78.1	0	0	0	0	111.5	F34 S55 Q56 G61 T62 I107 F111 T251	F34-V58 HydrophobicContact CE1-CG1 3.94Å; F34-V58 HydrophobicContact CZ-CG1 3.49Å; F34-V58 VanDerWaalsContact CZ-CG1 3.49Å; S55-V58 WeakPolarHBondContact O-CB 3.22Å; S55-V58 VanDerWaalsContact O-CG1 3.23Å; S55-V58 WeakPolarHBondContact O-CG1 3.42Å; S55-V58 PolarHBondContact O-N 2.85Å; Q56-V58 PolarHBondContact O-N 3.26Å; Q56-V58 VanDerWaalsContact O-N 3.17Å; V58-G61 PolarHBondContact O-N 2.71Å; V58-T62 WeakPolarHBondContact O-CB 3.48Å; V58-T62 PolarHBondContact O-N 3.47Å; V58-T62 PolarHBondContact O-OG1 3.34Å; V58-I107 HydrophobicContact CG2-CG2 4.44Å; V58-F111 HydrophobicContact CB-CD2 3.93Å; V58-F111 HydrophobicContact CB-CE2 4.39Å; V58-F111 HydrophobicContact CG1-CD2 4.23Å; V58-F111 HydrophobicContact CG1-CE2 4.2Å; V58-F111 HydrophobicContact CG2-CB 4.34Å; V58-F111 HydrophobicContact CG2-CD2 3.91Å; V58-F111 HydrophobicContact CG2-CE2 4.43Å; V58-F111 HydrophobicContact CG2-CG 4.09Å; V58-T251 HydrophobicContact CB-CG2 3.91Å; V58-T251 HydrophobicContact CG2-CG2 4.41Å
59	I	98.8	Very high	97.9	Very high	14 Å²	14	35.5 Å²	35.5	7%	0.072	18%	0.176	C	C	.	.	H	α-helix	trans	-68.7	-47.6	179.8	-61	178.3	0	0	0	110.1	L26 I27 F30 F34 Q56 G57 G61 T62 V63	L26-I59 HydrophobicContact CB-CG2 3.78Å; I27-I59 HydrophobicContact CG1-CB 4.28Å; I27-I59 HydrophobicContact CG1-CD1 4.28Å; I27-I59 HydrophobicContact CG1-CG2 4.08Å; F30-I59 HydrophobicContact CB-CD1 3.76Å; F30-I59 HydrophobicContact CD2-CD1 4.22Å; F30-I59 HydrophobicContact CG-CD1 4.3Å; F34-I59 HydrophobicContact CE2-CD1 3.89Å; F34-I59 HydrophobicContact CE2-CG1 4.25Å; F34-I59 HydrophobicContact CZ-CD1 4.3Å; F34-I59 HydrophobicContact CZ-CG1 4.23Å; Q56-I59 PolarHBondContact O-N 2.87Å; Q56-I59 VanDerWaalsContact O-N 3.09Å; G57-I59 VanDerWaalsContact C-N 3.33Å; G57-I59 PolarHBondContact O-N 3.35Å; I59-G61 VanDerWaalsContact C-N 3.3Å; I59-G61 PolarHBondContact O-N 2.91Å; I59-T62 PolarHBondContact O-N 3.44Å; I59-V63 WeakPolarHBondContact O-CG2 3.49Å; I59-V63 PolarHBondContact O-N 2.94Å
60	S	98.8	Very high	98.3	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62	-38.9	175.6	53.2	0	0	0	0	112	G57 V63 F64	G57-S60 WeakPolarHBondContact CA-OG 3.48Å; G57-S60 PolarHBondContact O-N 2.92Å; G57-S60 PolarHBondContact O-OG 3.49Å; S60-V63 PolarHBondContact O-N 3.28Å; S60-F64 VanDerWaalsContact O-CB 3.28Å; S60-F64 WeakPolarHBondContact O-CB 3.4Å; S60-F64 PolarHBondContact O-N 2.92Å
61	G	98.8	Very high	98.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.3	-42.8	177	0	0	0	0	0	112.5	G57 V58 I59 F64 L65	G57-G61 PolarHBondContact O-N 3.25Å; V58-G61 PolarHBondContact O-N 2.71Å; I59-G61 VanDerWaalsContact C-N 3.3Å; I59-G61 PolarHBondContact O-N 2.91Å; G61-F64 WeakPolarHBondContact O-CB 3.42Å; G61-F64 PolarHBondContact O-N 3.09Å; G61-L65 WeakPolarHBondContact O-CG 3.42Å; G61-L65 PolarHBondContact O-N 2.71Å
62	T	98.8	Very high	98.4	Very high	65 Å²	65	25.1 Å²	25.1	40%	0.399	14%	0.135	S	C	.	.	H	α-helix	trans	-63.7	-44.8	175	-61.7	0	0	0	0	111.6	V58 I59 F64 L65 I66	V58-T62 WeakPolarHBondContact O-CB 3.48Å; V58-T62 PolarHBondContact O-N 3.47Å; V58-T62 PolarHBondContact O-OG1 3.34Å; I59-T62 PolarHBondContact O-N 3.44Å; T62-F64 VanDerWaalsContact C-N 3.31Å; T62-F64 PolarHBondContact O-N 3.21Å; T62-L65 PolarHBondContact O-N 2.96Å; T62-I66 HydrophobicContact CG2-CD1 3.99Å; T62-I66 WeakPolarHBondContact O-CG1 3.37Å; T62-I66 PolarHBondContact O-N 3.33Å
63	V	98.9	Very high	98.2	Very high	10 Å²	10	27 Å²	27	6%	0.061	15%	0.148	C	C	.	.	H	α-helix	trans	-61.7	-42.4	176	172.9	0	0	0	0	110.7	A22 T23 L26 I59 S60 L65 I66 I67 T232	A22-V63 HydrophobicContact CB-CG1 4.38Å; T23-V63 WeakPolarHBondContact OG1-CG1 3.27Å; L26-V63 HydrophobicContact CD1-CG2 3.83Å; I59-V63 WeakPolarHBondContact O-CG2 3.49Å; I59-V63 PolarHBondContact O-N 2.94Å; S60-V63 PolarHBondContact O-N 3.28Å; V63-L65 PolarHBondContact O-N 2.73Å; V63-I66 PolarHBondContact O-N 3.27Å; V63-I67 HydrophobicContact CG1-CD1 3.95Å; V63-I67 HydrophobicContact CG1-CG1 4.45Å; V63-I67 WeakPolarHBondContact O-CD1 3.37Å; V63-I67 VanDerWaalsContact O-CG1 3.24Å; V63-I67 WeakPolarHBondContact O-CG1 3.31Å; V63-I67 PolarHBondContact O-N 2.9Å; V63-T232 HydrophobicContact CB-CG2 4.36Å; V63-T232 HydrophobicContact CG1-CG2 3.92Å
64	F	98.9	Very high	98.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.3	-46.9	173.4	169	-90.6	0	0	0	112.6	S60 G61 T62 I67 L68 I103 F225 P228 F229 T232 F255 T259	S60-F64 VanDerWaalsContact O-CB 3.28Å; S60-F64 WeakPolarHBondContact O-CB 3.4Å; S60-F64 PolarHBondContact O-N 2.92Å; G61-F64 WeakPolarHBondContact O-CB 3.42Å; G61-F64 PolarHBondContact O-N 3.09Å; T62-F64 VanDerWaalsContact C-N 3.31Å; T62-F64 PolarHBondContact O-N 3.21Å; F64-I67 PolarHBondContact O-N 2.86Å; F64-L68 HydrophobicContact CD1-CD1 4.2Å; F64-L68 HydrophobicContact CD2-CD1 4.43Å; F64-L68 HydrophobicContact CE1-CD1 3.47Å; F64-L68 VanDerWaalsContact CE1-CD1 3.47Å; F64-L68 HydrophobicContact CE2-CD1 3.75Å; F64-L68 HydrophobicContact CE2-CG 4.44Å; F64-L68 HydrophobicContact CZ-CD1 3.24Å; F64-L68 HydrophobicContact CZ-CG 4.32Å; F64-L68 PolarHBondContact O-N 3.04Å; F64-I103 HydrophobicContact CD1-CG2 4.39Å; F64-I103 HydrophobicContact CE1-CD1 4.26Å; F64-I103 HydrophobicContact CE1-CG2 3.76Å; F64-I103 HydrophobicContact CZ-CD1 4.26Å; F64-F225 WeakPolarHBondContact CE2-O 3.25Å; F64-F225 HydrophobicContact CZ-CD1 4.09Å; F64-P228 HydrophobicContact CD2-CB 3.75Å; F64-P228 HydrophobicContact CE2-CB 3.97Å; F64-F229 HydrophobicContact CD2-CB 4.21Å; F64-F229 HydrophobicContact CE2-CB 3.83Å; F64-T232 HydrophobicContact CB-CG2 4.24Å; F64-F255 HydrophobicContact CB-CE2 4.44Å; F64-F255 HydrophobicContact CB-CZ 3.82Å; F64-F255 AromaticContact CD1-CE2 3.57Å; F64-F255 HydrophobicContact CD1-CE2 3.57Å; F64-F255 AromaticContact CD1-CZ 3.8Å; F64-F255 HydrophobicContact CD1-CZ 3.8Å; F64-F255 HydrophobicContact CD2-CE2 4.33Å; F64-F255 AromaticContact CD2-CZ 3.92Å; F64-F255 HydrophobicContact CD2-CZ 3.92Å; F64-F255 AromaticContact CE1-CE2 3.77Å; F64-F255 HydrophobicContact CE1-CE2 3.77Å; F64-F255 HydrophobicContact CE1-CZ 4.31Å; F64-F255 HydrophobicContact CE2-CE2 4.48Å; F64-F255 HydrophobicContact CE2-CZ 4.4Å; F64-F255 AromaticContact CG-CE2 3.87Å; F64-F255 HydrophobicContact CG-CE2 3.87Å; F64-F255 AromaticContact CG-CZ 3.57Å; F64-F255 HydrophobicContact CG-CZ 3.57Å; F64-F255 HydrophobicContact CZ-CE2 4.19Å; F64-T259 HydrophobicContact CZ-CG2 4.13Å
65	L	98.8	Very high	97.8	Very high	16 Å²	16	26.2 Å²	26.2	8%	0.084	15%	0.148	C	C	.	.	H	α-helix	trans	-63.4	-43.2	177	-69.2	174.5	0	0	0	111.9	G61 T62 V63 I67 L68 F69 L100 C104 I107	G61-L65 WeakPolarHBondContact O-CG 3.42Å; G61-L65 PolarHBondContact O-N 2.71Å; T62-L65 PolarHBondContact O-N 2.96Å; V63-L65 PolarHBondContact O-N 2.73Å; L65-I67 VanDerWaalsContact C-N 3.34Å; L65-I67 PolarHBondContact O-N 3.17Å; L65-L68 PolarHBondContact O-N 3.38Å; L65-F69 HydrophobicContact CB-CE2 4.16Å; L65-F69 HydrophobicContact CB-CZ 4.23Å; L65-F69 HydrophobicContact CD2-CZ 4.43Å; L65-F69 WeakPolarHBondContact O-CB 3.48Å; L65-F69 WeakPolarHBondContact O-CD2 3.34Å; L65-F69 WeakPolarHBondContact O-CG 3.24Å; L65-F69 PolarHBondContact O-N 2.57Å; L65-L100 HydrophobicContact CD2-CD2 3.99Å; L65-C104 HydrophobicContact CD1-CB 4.07Å; L65-C104 HydrophobicContact CD2-CB 3.95Å; L65-I107 HydrophobicContact CD1-CD1 3.83Å; L65-I107 HydrophobicContact CD2-CD1 4.26Å; L65-I107 HydrophobicContact CG-CD1 3.89Å
66	I	98.8	Very high	97.5	Very high	94 Å²	94	26.5 Å²	26.5	48%	0.482	15%	0.149	S	C	.	.	H	α-helix	trans	-60.7	-44.3	177.6	-69.2	167.7	0	0	0	110.9	T62 V63 L68 F69 C70	T62-I66 HydrophobicContact CG2-CD1 3.99Å; T62-I66 WeakPolarHBondContact O-CG1 3.37Å; T62-I66 PolarHBondContact O-N 3.33Å; V63-I66 PolarHBondContact O-N 3.27Å; I66-L68 PolarHBondContact O-N 3.11Å; I66-F69 PolarHBondContact O-N 3.16Å; I66-C70 WeakPolarHBondContact O-CB 3.27Å; I66-C70 PolarHBondContact O-N 2.81Å; I66-C70 PolarHBondContact O-SG 3.29Å
67	I	98.7	Very high	96.9	Very high	11 Å²	11	29.3 Å²	29.3	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-56.7	-52.7	175.6	-67.9	160.3	0	0	0	109.6	M15 V63 F64 L65 F69 C70 F71 P228 T232	M15-I67 HydrophobicContact CB-CG2 4.03Å; M15-I67 HydrophobicContact CE-CG2 4.4Å; M15-I67 VanDerWaalsContact CE-O 3.25Å; M15-I67 WeakPolarHBondContact CE-O 3.45Å; V63-I67 HydrophobicContact CG1-CD1 3.95Å; V63-I67 HydrophobicContact CG1-CG1 4.45Å; V63-I67 WeakPolarHBondContact O-CD1 3.37Å; V63-I67 VanDerWaalsContact O-CG1 3.24Å; V63-I67 WeakPolarHBondContact O-CG1 3.31Å; V63-I67 PolarHBondContact O-N 2.9Å; F64-I67 PolarHBondContact O-N 2.86Å; L65-I67 VanDerWaalsContact C-N 3.34Å; L65-I67 PolarHBondContact O-N 3.17Å; I67-F69 PolarHBondContact O-N 3.27Å; I67-C70 PolarHBondContact O-N 3.03Å; I67-F71 VanDerWaalsContact O-CB 3.27Å; I67-F71 WeakPolarHBondContact O-CB 3.44Å; I67-F71 PolarHBondContact O-N 3.29Å; I67-P228 HydrophobicContact CD1-CB 4.41Å; I67-P228 HydrophobicContact CG2-CB 4Å; I67-P228 HydrophobicContact CG2-CG 3.96Å; I67-T232 HydrophobicContact CD1-CG2 3.88Å
68	L	98.6	Very high	96	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-36.8	-175.9	-73.2	-176.9	0	0	0	112.9	F64 L65 I66 C70 F71 I72 L100 Y224 F225 P228	F64-L68 HydrophobicContact CD1-CD1 4.2Å; F64-L68 HydrophobicContact CD2-CD1 4.43Å; F64-L68 HydrophobicContact CE1-CD1 3.47Å; F64-L68 VanDerWaalsContact CE1-CD1 3.47Å; F64-L68 HydrophobicContact CE2-CD1 3.75Å; F64-L68 HydrophobicContact CE2-CG 4.44Å; F64-L68 HydrophobicContact CZ-CD1 3.24Å; F64-L68 HydrophobicContact CZ-CG 4.32Å; F64-L68 PolarHBondContact O-N 3.04Å; L65-L68 PolarHBondContact O-N 3.38Å; I66-L68 PolarHBondContact O-N 3.11Å; L68-C70 VanDerWaalsContact C-N 3.32Å; L68-C70 PolarHBondContact O-N 2.92Å; L68-F71 HydrophobicContact CD2-CD1 4.38Å; L68-F71 CarbonylContact O-C 3.53Å; L68-F71 WeakPolarHBondContact O-CA 3.35Å; L68-F71 PolarHBondContact O-N 3.04Å; L68-I72 WeakPolarHBondContact O-CG1 3.33Å; L68-I72 PolarHBondContact O-N 2.84Å; L68-L100 HydrophobicContact CB-CD1 4.14Å; L68-L100 HydrophobicContact CB-CD2 3.68Å; L68-L100 HydrophobicContact CB-CG 4.43Å; L68-L100 HydrophobicContact CD1-CD2 3.46Å; L68-L100 VanDerWaalsContact CD1-CD2 3.46Å; L68-L100 HydrophobicContact CD1-CG 4.35Å; L68-L100 HydrophobicContact CG-CD2 4.22Å; L68-Y224 WeakPolarHBondContact CD2-O 3.36Å; L68-F225 HydrophobicContact CD1-CD1 3.58Å; L68-F225 HydrophobicContact CD1-CE1 3.78Å; L68-F225 HydrophobicContact CD1-CG 4.41Å; L68-P228 HydrophobicContact CD2-CG 3.97Å
69	F	98.3	Very high	95.1	Very high	109 Å²	109	33.8 Å²	33.8	48%	0.478	20%	0.195	S	C	.	.	H	α-helix	trans	-60.2	-42.8	173.8	-67.4	-18.2	0	0	0	112	L65 I66 I67 F71 I72 L100	L65-F69 HydrophobicContact CB-CE2 4.16Å; L65-F69 HydrophobicContact CB-CZ 4.23Å; L65-F69 HydrophobicContact CD2-CZ 4.43Å; L65-F69 WeakPolarHBondContact O-CB 3.48Å; L65-F69 WeakPolarHBondContact O-CD2 3.34Å; L65-F69 WeakPolarHBondContact O-CG 3.24Å; L65-F69 PolarHBondContact O-N 2.57Å; I66-F69 PolarHBondContact O-N 3.16Å; I67-F69 PolarHBondContact O-N 3.27Å; F69-F71 VanDerWaalsContact C-N 3.27Å; F69-F71 PolarHBondContact O-N 3.18Å; F69-I72 HydrophobicContact CD1-CD1 4.14Å; F69-L100 HydrophobicContact CD1-CD1 4.12Å; F69-L100 HydrophobicContact CE1-CD1 4.25Å; F69-L100 HydrophobicContact CE1-CD2 4.48Å
70	C	97.9	Very high	94	Very high	79 Å²	79	39.2 Å²	39.2	53%	0.534	22%	0.219	S	C	.	.	H	α-helix	trans	-70.6	-26.3	174.6	-62.8	0	0	0	0	112.2	M15 I66 I67 L68 P73	M15-C70 HydrophobicContact CE-CB 3.38Å; I66-C70 WeakPolarHBondContact O-CB 3.27Å; I66-C70 PolarHBondContact O-N 2.81Å; I66-C70 PolarHBondContact O-SG 3.29Å; I67-C70 PolarHBondContact O-N 3.03Å; L68-C70 VanDerWaalsContact C-N 3.32Å; L68-C70 PolarHBondContact O-N 2.92Å; C70-P73 WeakPolarHBondContact O-CD 3.48Å
71	F	97.8	Very high	92.7	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-81.9	-21.7	-180	-174.4	-104.5	0	0	0	113.3	P8 I11 M15 I67 L68 F69 P73 V74 P75 Y224	P8-F71 HydrophobicContact CB-CZ 4.15Å; P8-F71 VanDerWaalsContact O-CE2 3.22Å; P8-F71 WeakPolarHBondContact O-CE2 3.43Å; P8-F71 WeakPolarHBondContact O-CZ 3.12Å; I11-F71 HydrophobicContact CB-CE2 4.47Å; I11-F71 HydrophobicContact CG2-CD2 4.26Å; I11-F71 HydrophobicContact CG2-CE2 4.3Å; M15-F71 HydrophobicContact CE-CB 4.2Å; M15-F71 HydrophobicContact SD-CB 4.27Å; M15-F71 HydrophobicContact SD-CD2 4.06Å; I67-F71 VanDerWaalsContact O-CB 3.27Å; I67-F71 WeakPolarHBondContact O-CB 3.44Å; I67-F71 PolarHBondContact O-N 3.29Å; L68-F71 HydrophobicContact CD2-CD1 4.38Å; L68-F71 CarbonylContact O-C 3.53Å; L68-F71 WeakPolarHBondContact O-CA 3.35Å; L68-F71 PolarHBondContact O-N 3.04Å; F69-F71 VanDerWaalsContact C-N 3.27Å; F69-F71 PolarHBondContact O-N 3.18Å; F71-P73 VanDerWaalsContact C-CD 3.44Å; F71-P73 VanDerWaalsContact C-N 3.32Å; F71-P73 VanDerWaalsContact O-N 3.14Å; F71-V74 HydrophobicContact CD2-CB 3.78Å; F71-V74 HydrophobicContact CD2-CG1 4.12Å; F71-V74 HydrophobicContact CD2-CG2 3.92Å; F71-V74 HydrophobicContact CE2-CB 3.71Å; F71-V74 HydrophobicContact CE2-CG1 3.62Å; F71-V74 HydrophobicContact CE2-CG2 4.28Å; F71-V74 HydrophobicContact CG-CB 4.41Å; F71-V74 HydrophobicContact CZ-CB 4.3Å; F71-V74 HydrophobicContact CZ-CG1 4.25Å; F71-V74 VanDerWaalsContact O-CB 3.24Å; F71-V74 WeakPolarHBondContact O-CB 3.45Å; F71-V74 WeakPolarHBondContact O-CG2 3.4Å; F71-V74 PolarHBondContact O-N 3.35Å; F71-P75 HydrophobicContact CD1-CG 4.4Å; F71-P75 HydrophobicContact CE1-CG 3.69Å; F71-P75 HydrophobicContact CZ-CG 4.05Å; F71-P75 WeakPolarHBondContact O-CD 3.4Å; F71-Y224 AromaticContact CE1-CD1 3.53Å; F71-Y224 HydrophobicContact CE1-CD1 3.53Å; F71-Y224 HydrophobicContact CE1-CD2 4.08Å; F71-Y224 AromaticContact CE1-CE1 3.98Å; F71-Y224 HydrophobicContact CE1-CE1 3.98Å; F71-Y224 HydrophobicContact CE1-CE2 4.48Å; F71-Y224 AromaticContact CE1-CG 3.59Å; F71-Y224 HydrophobicContact CE1-CG 3.59Å; F71-Y224 AromaticContact CZ-CD1 3.57Å; F71-Y224 HydrophobicContact CZ-CD1 3.57Å; F71-Y224 AromaticContact CZ-CE1 3.71Å; F71-Y224 HydrophobicContact CZ-CE1 3.71Å; F71-Y224 HydrophobicContact CZ-CG 4.14Å
72	I	96.5	Very high	90.9	Very high	28 Å²	28	47 Å²	47	14%	0.144	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-46.5	-177.9	-76.8	161.4	0	0	0	113.6	L68 F69 V74 P75 F76 F93 L96 I97 L100	L68-I72 WeakPolarHBondContact O-CG1 3.33Å; L68-I72 PolarHBondContact O-N 2.84Å; F69-I72 HydrophobicContact CD1-CD1 4.14Å; I72-V74 PolarHBondContact O-N 2.96Å; I72-P75 WeakPolarHBondContact O-CD 3.31Å; I72-F76 WeakPolarHBondContact O-CD2 3.44Å; I72-F76 WeakPolarHBondContact O-CE2 3.23Å; I72-F93 HydrophobicContact CG2-CD2 4.28Å; I72-F93 HydrophobicContact CG2-CE2 3.69Å; I72-L96 HydrophobicContact CB-CD2 4.24Å; I72-L96 HydrophobicContact CG1-CD2 3.82Å; I72-L96 HydrophobicContact CG1-CG 4.48Å; I72-L96 HydrophobicContact CG2-CD2 4.39Å; I72-I97 HydrophobicContact CD1-CD1 3.6Å; I72-I97 HydrophobicContact CG1-CD1 4.19Å; I72-I97 HydrophobicContact CG2-CD1 4.48Å; I72-L100 HydrophobicContact CD1-CD1 3.91Å; I72-L100 HydrophobicContact CG1-CD1 4.07Å
73	P	94.6	Very high	89	Confident	58 Å²	58	52.4 Å²	52.4	38%	0.377	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-18.4	-178.7	-19.2	33.9	0	0	0	113.9	C70 F71 F76 L77 F80	C70-P73 WeakPolarHBondContact O-CD 3.48Å; F71-P73 VanDerWaalsContact C-CD 3.44Å; F71-P73 VanDerWaalsContact C-N 3.32Å; F71-P73 VanDerWaalsContact O-N 3.14Å; P73-F76 CarbonylContact O-C 3.45Å; P73-F76 PolarHBondContact O-N 3.47Å; P73-L77 PolarHBondContact O-N 2.86Å; P73-F80 HydrophobicContact CB-CD2 4.48Å; P73-F80 HydrophobicContact CB-CE2 4.16Å
74	V	94.4	Very high	87.1	Confident	16 Å²	16	60.6 Å²	60.6	10%	0.097	34%	0.338	C	S	.	.	S	Bend	trans	-67.4	-48.9	-167.6	177.9	0	0	0	0	113.2	P8 I11 F71 I72 F76 L77	P8-V74 HydrophobicContact CB-CG1 4.1Å; P8-V74 HydrophobicContact CG-CG1 4.36Å; I11-V74 HydrophobicContact CB-CG1 4Å; I11-V74 HydrophobicContact CD1-CG1 3.59Å; I11-V74 HydrophobicContact CG1-CG1 4.39Å; I11-V74 HydrophobicContact CG2-CG1 3.94Å; I11-V74 HydrophobicContact CG2-CG2 3.98Å; F71-V74 HydrophobicContact CD2-CB 3.78Å; F71-V74 HydrophobicContact CD2-CG1 4.12Å; F71-V74 HydrophobicContact CD2-CG2 3.92Å; F71-V74 HydrophobicContact CE2-CB 3.71Å; F71-V74 HydrophobicContact CE2-CG1 3.62Å; F71-V74 HydrophobicContact CE2-CG2 4.28Å; F71-V74 HydrophobicContact CG-CB 4.41Å; F71-V74 HydrophobicContact CZ-CB 4.3Å; F71-V74 HydrophobicContact CZ-CG1 4.25Å; F71-V74 VanDerWaalsContact O-CB 3.24Å; F71-V74 WeakPolarHBondContact O-CB 3.45Å; F71-V74 WeakPolarHBondContact O-CG2 3.4Å; F71-V74 PolarHBondContact O-N 3.35Å; I72-V74 PolarHBondContact O-N 2.96Å; V74-F76 PolarHBondContact O-N 3.02Å; V74-F76 VanDerWaalsContact O-N 3.11Å; V74-L77 HydrophobicContact CB-CD1 4.48Å; V74-L77 HydrophobicContact CG1-CD1 4.04Å; V74-L77 WeakPolarHBondContact O-CD1 3.46Å; V74-L77 VanDerWaalsContact O-CG 3.31Å; V74-L77 WeakPolarHBondContact O-CG 3.28Å; V74-L77 PolarHBondContact O-N 3.15Å
75	P	92.7	Very high	85.6	Confident	24 Å²	24	62.9 Å²	62.9	16%	0.156	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.5	173.9	-26.2	36.1	0	0	0	113.8	F71 I72 Y224	F71-P75 HydrophobicContact CD1-CG 4.4Å; F71-P75 HydrophobicContact CE1-CG 3.69Å; F71-P75 HydrophobicContact CZ-CG 4.05Å; F71-P75 WeakPolarHBondContact O-CD 3.4Å; I72-P75 WeakPolarHBondContact O-CD 3.31Å; P75-Y224 HydrophobicContact CB-CE2 4.01Å; P75-Y224 HydrophobicContact CG-CD2 4.2Å; P75-Y224 HydrophobicContact CG-CE2 3.65Å
76	F	91.4	Very high	84.3	Confident	6 Å²	6	69.8 Å²	69.8	3%	0.026	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	12.8	-175.3	-49.9	-66.1	0	0	0	113.6	I72 P73 V74 S78 C79 F80 F88 P89 E92 F93 L96	I72-F76 WeakPolarHBondContact O-CD2 3.44Å; I72-F76 WeakPolarHBondContact O-CE2 3.23Å; P73-F76 CarbonylContact O-C 3.45Å; P73-F76 PolarHBondContact O-N 3.47Å; V74-F76 PolarHBondContact O-N 3.02Å; V74-F76 VanDerWaalsContact O-N 3.11Å; F76-S78 PolarHBondContact O-N 3.15Å; F76-S78 VanDerWaalsContact O-N 3.16Å; F76-C79 WeakPolarHBondContact O-CA 3.22Å; F76-C79 WeakPolarHBondContact O-CB 3.39Å; F76-C79 PolarHBondContact O-N 3.03Å; F76-F80 HydrophobicContact CB-CD2 4.22Å; F76-F80 HydrophobicContact CB-CE2 3.88Å; F76-F80 VanDerWaalsContact O-CD2 3.31Å; F76-F80 WeakPolarHBondContact O-CD2 3.32Å; F76-F80 PolarHBondContact O-N 3.23Å; F76-F88 HydrophobicContact CB-CE2 4.06Å; F76-F88 HydrophobicContact CB-CZ 4.49Å; F76-F88 HydrophobicContact CD1-CE2 4.5Å; F76-F88 HydrophobicContact CD1-CZ 4.36Å; F76-F88 HydrophobicContact CD2-CZ 4.3Å; F76-F88 HydrophobicContact CG-CE2 4.16Å; F76-F88 HydrophobicContact CG-CZ 4.11Å; F76-P89 HydrophobicContact CD1-CG 3.46Å; F76-P89 VanDerWaalsContact CD1-CG 3.46Å; F76-P89 HydrophobicContact CE1-CB 4.49Å; F76-P89 HydrophobicContact CE1-CG 3.67Å; F76-E92 HydrophobicContact CE1-CB 3.85Å; F76-E92 HydrophobicContact CZ-CB 4.03Å; F76-F93 HydrophobicContact CD2-CD2 4.44Å; F76-F93 HydrophobicContact CE1-CB 4.47Å; F76-F93 HydrophobicContact CE2-CB 4.21Å; F76-F93 AromaticContact CE2-CD2 3.89Å; F76-F93 HydrophobicContact CE2-CD2 3.89Å; F76-F93 HydrophobicContact CZ-CB 3.88Å; F76-F93 HydrophobicContact CZ-CD2 4.41Å; F76-L96 HydrophobicContact CE2-CD2 4.25Å
77	L	86.1	Confident	83.5	Confident	59 Å²	59	67.6 Å²	67.6	31%	0.309	40%	0.397	S	S	.	.	H	α-helix	trans	-55.5	-34.9	-176.1	-81.5	167.9	0	0	0	113.7	I11 P73 V74 C79 F80 V81	I11-L77 HydrophobicContact CD1-CD1 4.34Å; P73-L77 PolarHBondContact O-N 2.86Å; V74-L77 HydrophobicContact CB-CD1 4.48Å; V74-L77 HydrophobicContact CG1-CD1 4.04Å; V74-L77 WeakPolarHBondContact O-CD1 3.46Å; V74-L77 VanDerWaalsContact O-CG 3.31Å; V74-L77 WeakPolarHBondContact O-CG 3.28Å; V74-L77 PolarHBondContact O-N 3.15Å; L77-C79 PolarHBondContact O-N 2.95Å; L77-F80 PolarHBondContact O-N 2.96Å; L77-V81 HydrophobicContact CD2-CG2 4.15Å; L77-V81 WeakPolarHBondContact O-CB 3.2Å; L77-V81 PolarHBondContact O-N 3.38Å
78	S	79.3	Confident	83	Confident	84 Å²	84	70 Å²	70	59%	0.587	41%	0.407	S	S	*	.	H	α-helix	trans	-58.4	-31.3	175.8	51.7	0	0	0	0	112.5	F76 G82	F76-S78 PolarHBondContact O-N 3.15Å; F76-S78 VanDerWaalsContact O-N 3.16Å; S78-G82 WeakPolarHBondContact O-CA 3.48Å; S78-G82 PolarHBondContact O-N 2.91Å
79	C	80.4	Confident	82.5	Confident	34 Å²	34	71.9 Å²	71.9	23%	0.23	42%	0.419	C	S	.	.	H	α-helix	trans	-83.5	-16.9	175.6	-76.4	0	0	0	0	114.3	F76 L77 C85 F88	F76-C79 WeakPolarHBondContact O-CA 3.22Å; F76-C79 WeakPolarHBondContact O-CB 3.39Å; F76-C79 PolarHBondContact O-N 3.03Å; L77-C79 PolarHBondContact O-N 2.95Å; C79-C85 HydrophobicContact CB-CB 3.74Å; C79-C85 WeakPolarHBondContact CB-SG 3.22Å; C79-C85 WeakPolarHBondContact SG-CB 3.16Å; C79-C85 CovalentContact SG-SG 2.06Å; C79-C85 PolarHBondContact SG-SG 2.73Å; C79-F88 HydrophobicContact CB-CD2 4.37Å
80	F	75.2	Confident	82.2	Confident	129 Å²	129	72.3 Å²	72.3	57%	0.566	42%	0.423	S	S	*	.	H	α-helix	trans	-96.7	-30.1	177	-70.9	-66.8	0	0	0	113.6	P73 F76 L77 F88	P73-F80 HydrophobicContact CB-CD2 4.48Å; P73-F80 HydrophobicContact CB-CE2 4.16Å; F76-F80 HydrophobicContact CB-CD2 4.22Å; F76-F80 HydrophobicContact CB-CE2 3.88Å; F76-F80 VanDerWaalsContact O-CD2 3.31Å; F76-F80 WeakPolarHBondContact O-CD2 3.32Å; F76-F80 PolarHBondContact O-N 3.23Å; L77-F80 PolarHBondContact O-N 2.96Å; F80-F88 HydrophobicContact CE2-CE2 4.39Å; F80-F88 HydrophobicContact CZ-CE2 4.23Å
81	V	72.1	Confident	81.8	Confident	123 Å²	123	73.7 Å²	73.7	75%	0.745	43%	0.425	S	S	*	.	H	α-helix	trans	-117.6	-16.9	-168.7	-176.3	0	0	0	0	112.5	L77	L77-V81 HydrophobicContact CD2-CG2 4.15Å; L77-V81 WeakPolarHBondContact O-CB 3.2Å; L77-V81 PolarHBondContact O-N 3.38Å
82	G	61.4	Low	81.5	Confident	39 Å²	39	78.6 Å²	78.6	40%	0.402	45%	0.448	S	S	.	.	S	Bend	trans	-108.7	151.4	-179.2	0	0	0	0	0	114.1	S78 Q84	S78-G82 WeakPolarHBondContact O-CA 3.48Å; S78-G82 PolarHBondContact O-N 2.91Å; G82-Q84 PolarHBondContact O-N 2.88Å; G82-Q84 VanDerWaalsContact O-N 3.07Å
83	D	59	Low	81.3	Confident	179 Å²	179	80.4 Å²	80.4	96%	0.957	46%	0.455	S	S	*	.	S	Bend	trans	-72.3	10.2	174.4	-67.8	-34.5	0	0	0	113.8
84	Q	58.2	Low	81.3	Confident	182 Å²	182	80.3 Å²	80.3	85%	0.85	45%	0.453	S	S	*	.			trans	-121.9	48.6	-168.9	-66.1	-167.1	-6.8	0	0	113.6	G82	G82-Q84 PolarHBondContact O-N 2.88Å; G82-Q84 VanDerWaalsContact O-N 3.07Å
85	C	67.5	Low	81.3	Confident	48 Å²	48	80.6 Å²	80.6	32%	0.324	45%	0.453	S	S	.	.			trans	-110.1	99.9	165.8	-159	0	0	0	0	109.2	C79 G87	C79-C85 HydrophobicContact CB-CB 3.74Å; C79-C85 WeakPolarHBondContact CB-SG 3.22Å; C79-C85 WeakPolarHBondContact SG-CB 3.16Å; C79-C85 CovalentContact SG-SG 2.06Å; C79-C85 PolarHBondContact SG-SG 2.73Å; C85-G87 PolarHBondContact O-N 3.25Å; C85-G87 VanDerWaalsContact SG-C 3.54Å; C85-G87 PolarHBondContact SG-O 3.42Å
86	T	70.8	Confident	81.5	Confident	162 Å²	162	79.7 Å²	79.7	99%	0.994	45%	0.447	S	S	*	.	S	Bend	trans	-68	-22	172.7	51.1	0	0	0	0	111.8
87	G	82.3	Confident	81.8	Confident	48 Å²	48	82.5 Å²	82.5	50%	0.495	46%	0.461	S	S	.	.	S	Bend	trans	-176.5	147.2	174	0	0	0	0	0	110.7	C85	C85-G87 PolarHBondContact O-N 3.25Å; C85-G87 VanDerWaalsContact SG-C 3.54Å; C85-G87 PolarHBondContact SG-O 3.42Å
88	F	87.8	Confident	82.3	Confident	61 Å²	61	80.1 Å²	80.1	27%	0.268	45%	0.451	S	S	.	.			trans	-71.6	133.5	-178.2	-176.1	-91.9	0	0	0	111	F76 C79 F80 H90 F93	F76-F88 HydrophobicContact CB-CE2 4.06Å; F76-F88 HydrophobicContact CB-CZ 4.49Å; F76-F88 HydrophobicContact CD1-CE2 4.5Å; F76-F88 HydrophobicContact CD1-CZ 4.36Å; F76-F88 HydrophobicContact CD2-CZ 4.3Å; F76-F88 HydrophobicContact CG-CE2 4.16Å; F76-F88 HydrophobicContact CG-CZ 4.11Å; C79-F88 HydrophobicContact CB-CD2 4.37Å; F80-F88 HydrophobicContact CE2-CE2 4.39Å; F80-F88 HydrophobicContact CZ-CE2 4.23Å; F88-H90 VanDerWaalsContact C-N 3.28Å; F88-H90 AromaticContact CD1-CD2 3.97Å; F88-H90 AromaticContact CD1-CE1 3.58Å; F88-H90 AromaticContact CD1-CG 3.85Å; F88-H90 AromaticContact CD1-ND1 3.6Å; F88-H90 AromaticContact CD1-NE2 3.82Å; F88-H90 PolarHBondContact O-CD2 2.93Å; F88-H90 PolarHBondContact O-N 3.36Å; F88-F93 HydrophobicContact CE1-CB 3.62Å; F88-F93 HydrophobicContact CE1-CD1 4.17Å; F88-F93 HydrophobicContact CE1-CD2 4.27Å; F88-F93 AromaticContact CE1-CG 3.77Å; F88-F93 HydrophobicContact CE1-CG 3.77Å; F88-F93 HydrophobicContact CZ-CB 4.08Å; F88-F93 HydrophobicContact CZ-CD2 4.07Å; F88-F93 HydrophobicContact CZ-CG 4.05Å
89	P	89.7	Confident	83.2	Confident	41 Å²	41	76.1 Å²	76.1	27%	0.266	42%	0.423	S	S	.	.			trans	-75.3	78.3	-178.9	32.1	-36.8	0	0	0	111.2	F76 D91 F93	F76-P89 HydrophobicContact CD1-CG 3.46Å; F76-P89 VanDerWaalsContact CD1-CG 3.46Å; F76-P89 HydrophobicContact CE1-CB 4.49Å; F76-P89 HydrophobicContact CE1-CG 3.67Å; P89-D91 VanDerWaalsContact C-N 3.26Å; P89-D91 PolarHBondContact O-N 3.47Å; P89-F93 PolarHBondContact O-N 2.87Å
90	H	90.7	Very high	84	Confident	117 Å²	117	74.7 Å²	74.7	54%	0.542	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-30.8	-177.1	-74.4	-75.6	0	0	0	113.2	F88 F93 V94	F88-H90 VanDerWaalsContact C-N 3.28Å; F88-H90 AromaticContact CD1-CD2 3.97Å; F88-H90 AromaticContact CD1-CE1 3.58Å; F88-H90 AromaticContact CD1-CG 3.85Å; F88-H90 AromaticContact CD1-ND1 3.6Å; F88-H90 AromaticContact CD1-NE2 3.82Å; F88-H90 PolarHBondContact O-CD2 2.93Å; F88-H90 PolarHBondContact O-N 3.36Å; H90-F93 PolarHBondContact O-N 3.45Å; H90-V94 WeakPolarHBondContact O-CB 3.37Å; H90-V94 WeakPolarHBondContact O-CG2 3.34Å; H90-V94 PolarHBondContact O-N 2.86Å
91	D	90.1	Very high	85.1	Confident	108 Å²	108	72.9 Å²	72.9	58%	0.578	41%	0.409	S	S	*	.	H	α-helix	trans	-64.7	-48.4	-178	-62	-37.9	0	0	0	111.9	P89 F93 V94 Q95 N141	P89-D91 VanDerWaalsContact C-N 3.26Å; P89-D91 PolarHBondContact O-N 3.47Å; D91-F93 VanDerWaalsContact C-N 3.33Å; D91-F93 PolarHBondContact O-N 2.87Å; D91-V94 PolarHBondContact O-N 3.2Å; D91-Q95 WeakPolarHBondContact O-CG 3.37Å; D91-Q95 PolarHBondContact O-N 2.89Å; D91-N141 WeakPolarHBondContact CA-ND2 3.1Å; D91-N141 PolarHBondContact O-ND2 3.49Å
92	E	90.7	Very high	86.3	Confident	105 Å²	105	67 Å²	67	49%	0.491	37%	0.374	S	S	.	.	H	α-helix	trans	-63.9	-39.8	176	-69.4	176.7	-146.3	0	0	111.6	F76 Q95 L96	F76-E92 HydrophobicContact CE1-CB 3.85Å; F76-E92 HydrophobicContact CZ-CB 4.03Å; E92-Q95 PolarHBondContact O-N 3.43Å; E92-L96 PolarHBondContact O-N 3.01Å
93	F	93.7	Very high	88.1	Confident	65 Å²	65	65.1 Å²	65.1	29%	0.285	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-45.2	177.4	179.1	-105.6	0	0	0	111.9	I72 F76 F88 P89 H90 D91 Q95 L96 I97	I72-F93 HydrophobicContact CG2-CD2 4.28Å; I72-F93 HydrophobicContact CG2-CE2 3.69Å; F76-F93 HydrophobicContact CD2-CD2 4.44Å; F76-F93 HydrophobicContact CE1-CB 4.47Å; F76-F93 HydrophobicContact CE2-CB 4.21Å; F76-F93 AromaticContact CE2-CD2 3.89Å; F76-F93 HydrophobicContact CE2-CD2 3.89Å; F76-F93 HydrophobicContact CZ-CB 3.88Å; F76-F93 HydrophobicContact CZ-CD2 4.41Å; F88-F93 HydrophobicContact CE1-CB 3.62Å; F88-F93 HydrophobicContact CE1-CD1 4.17Å; F88-F93 HydrophobicContact CE1-CD2 4.27Å; F88-F93 AromaticContact CE1-CG 3.77Å; F88-F93 HydrophobicContact CE1-CG 3.77Å; F88-F93 HydrophobicContact CZ-CB 4.08Å; F88-F93 HydrophobicContact CZ-CD2 4.07Å; F88-F93 HydrophobicContact CZ-CG 4.05Å; P89-F93 PolarHBondContact O-N 2.87Å; H90-F93 PolarHBondContact O-N 3.45Å; D91-F93 VanDerWaalsContact C-N 3.33Å; D91-F93 PolarHBondContact O-N 2.87Å; F93-Q95 VanDerWaalsContact C-N 3.32Å; F93-Q95 PolarHBondContact O-N 3.27Å; F93-L96 PolarHBondContact O-N 2.82Å; F93-I97 HydrophobicContact CD1-CG1 4.28Å; F93-I97 HydrophobicContact CD2-CG1 4.2Å; F93-I97 HydrophobicContact CE1-CG1 3.9Å; F93-I97 HydrophobicContact CE2-CD1 3.96Å; F93-I97 HydrophobicContact CE2-CG1 3.81Å; F93-I97 HydrophobicContact CG-CG1 4.43Å; F93-I97 HydrophobicContact CZ-CD1 3.98Å; F93-I97 HydrophobicContact CZ-CG1 3.65Å; F93-I97 WeakPolarHBondContact O-CG1 3.42Å; F93-I97 PolarHBondContact O-N 2.88Å
94	V	94.6	Very high	90	Very high	57 Å²	57	58.9 Å²	58.9	35%	0.345	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-40.5	176.5	166.1	0	0	0	0	110.8	H90 D91 G98 V137	H90-V94 WeakPolarHBondContact O-CB 3.37Å; H90-V94 WeakPolarHBondContact O-CG2 3.34Å; H90-V94 PolarHBondContact O-N 2.86Å; D91-V94 PolarHBondContact O-N 3.2Å; V94-G98 PolarHBondContact O-N 2.98Å; V94-V137 HydrophobicContact CG1-CG2 4Å
95	Q	94.3	Very high	91.8	Very high	22 Å²	22	52.3 Å²	52.3	10%	0.103	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-48	173.7	-71.3	173.4	31.5	0	0	111.9	D91 E92 F93 A99 V137 F142 F221	D91-Q95 WeakPolarHBondContact O-CG 3.37Å; D91-Q95 PolarHBondContact O-N 2.89Å; E92-Q95 PolarHBondContact O-N 3.43Å; F93-Q95 VanDerWaalsContact C-N 3.32Å; F93-Q95 PolarHBondContact O-N 3.27Å; Q95-A99 WeakPolarHBondContact O-CB 3.44Å; Q95-A99 PolarHBondContact O-N 3.31Å; Q95-V137 HydrophobicContact CB-CG1 4.18Å; Q95-V137 HydrophobicContact CG-CG1 3.66Å; Q95-F142 VanDerWaalsContact CD-CZ 3.48Å; Q95-F142 HydrophobicContact CG-CE2 4.32Å; Q95-F142 HydrophobicContact CG-CZ 4.44Å; Q95-F221 HydrophobicContact CB-CE2 3.95Å
96	L	96	Very high	93.3	Very high	5 Å²	5	50 Å²	50	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-47.2	-179.9	-172.3	71.4	0	0	0	112	I72 F76 E92 F93 L100 F225	I72-L96 HydrophobicContact CB-CD2 4.24Å; I72-L96 HydrophobicContact CG1-CD2 3.82Å; I72-L96 HydrophobicContact CG1-CG 4.48Å; I72-L96 HydrophobicContact CG2-CD2 4.39Å; F76-L96 HydrophobicContact CE2-CD2 4.25Å; E92-L96 PolarHBondContact O-N 3.01Å; F93-L96 PolarHBondContact O-N 2.82Å; L96-L100 WeakPolarHBondContact O-CB 3.23Å; L96-L100 WeakPolarHBondContact O-CG 3.41Å; L96-L100 PolarHBondContact O-N 3.23Å; L96-F225 HydrophobicContact CD1-CE2 3.64Å; L96-F225 HydrophobicContact CD1-CZ 3.61Å
97	I	97.2	Very high	94.6	Very high	64 Å²	64	42.7 Å²	42.7	33%	0.328	24%	0.237	S	C	.	.	H	α-helix	trans	-69.4	-43	-179.3	-62.6	-60.2	0	0	0	111.5	I72 F93 L100 L101	I72-I97 HydrophobicContact CD1-CD1 3.6Å; I72-I97 HydrophobicContact CG1-CD1 4.19Å; I72-I97 HydrophobicContact CG2-CD1 4.48Å; F93-I97 HydrophobicContact CD1-CG1 4.28Å; F93-I97 HydrophobicContact CD2-CG1 4.2Å; F93-I97 HydrophobicContact CE1-CG1 3.9Å; F93-I97 HydrophobicContact CE2-CD1 3.96Å; F93-I97 HydrophobicContact CE2-CG1 3.81Å; F93-I97 HydrophobicContact CG-CG1 4.43Å; F93-I97 HydrophobicContact CZ-CD1 3.98Å; F93-I97 HydrophobicContact CZ-CG1 3.65Å; F93-I97 WeakPolarHBondContact O-CG1 3.42Å; F93-I97 PolarHBondContact O-N 2.88Å; I97-L100 PolarHBondContact O-N 3.38Å; I97-L101 WeakPolarHBondContact O-CB 3.44Å; I97-L101 PolarHBondContact O-N 3.47Å
98	G	97.1	Very high	95.3	Very high	9 Å²	9	47 Å²	47	9%	0.093	24%	0.242	C	C	.	.	H	α-helix	trans	-66.3	-38.7	179.3	0	0	0	0	0	112.7	V94 L101 A102	V94-G98 PolarHBondContact O-N 2.98Å; G98-L101 PolarHBondContact O-N 2.93Å; G98-A102 PolarHBondContact O-N 3.01Å
99	A	97.8	Very high	95.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-48.7	170.6	0	0	0	0	0	112.1	Q95 L101 A102 I103 F221 F225 V262 L266	Q95-A99 WeakPolarHBondContact O-CB 3.44Å; Q95-A99 PolarHBondContact O-N 3.31Å; A99-L101 VanDerWaalsContact C-N 3.34Å; A99-L101 PolarHBondContact O-N 2.96Å; A99-A102 PolarHBondContact O-N 3.29Å; A99-I103 WeakPolarHBondContact O-CG1 3.28Å; A99-I103 PolarHBondContact O-N 2.82Å; A99-F221 HydrophobicContact CB-CZ 3.96Å; A99-F225 HydrophobicContact CB-CE1 3.82Å; A99-F225 HydrophobicContact CB-CE2 4.19Å; A99-F225 HydrophobicContact CB-CZ 3.42Å; A99-F225 VanDerWaalsContact CB-CZ 3.42Å; A99-V262 HydrophobicContact CB-CG1 3.41Å; A99-V262 VanDerWaalsContact CB-CG1 3.41Å; A99-L266 HydrophobicContact CB-CD1 4.03Å
100	L	97.9	Very high	96.1	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-40.2	176.3	-85.7	173.6	0	0	0	112.9	L65 L68 F69 I72 L96 I97 I103 C104 F225	L65-L100 HydrophobicContact CD2-CD2 3.99Å; L68-L100 HydrophobicContact CB-CD1 4.14Å; L68-L100 HydrophobicContact CB-CD2 3.68Å; L68-L100 HydrophobicContact CB-CG 4.43Å; L68-L100 HydrophobicContact CD1-CD2 3.46Å; L68-L100 VanDerWaalsContact CD1-CD2 3.46Å; L68-L100 HydrophobicContact CD1-CG 4.35Å; L68-L100 HydrophobicContact CG-CD2 4.22Å; F69-L100 HydrophobicContact CD1-CD1 4.12Å; F69-L100 HydrophobicContact CE1-CD1 4.25Å; F69-L100 HydrophobicContact CE1-CD2 4.48Å; I72-L100 HydrophobicContact CD1-CD1 3.91Å; I72-L100 HydrophobicContact CG1-CD1 4.07Å; L96-L100 WeakPolarHBondContact O-CB 3.23Å; L96-L100 WeakPolarHBondContact O-CG 3.41Å; L96-L100 PolarHBondContact O-N 3.23Å; I97-L100 PolarHBondContact O-N 3.38Å; L100-I103 PolarHBondContact O-N 3.49Å; L100-C104 WeakPolarHBondContact O-CB 3.26Å; L100-C104 PolarHBondContact O-N 2.95Å; L100-F225 HydrophobicContact CD2-CE1 4.2Å; L100-F225 HydrophobicContact CG-CE1 4.04Å; L100-F225 HydrophobicContact CG-CZ 4.43Å
101	L	98.1	Very high	96.4	Very high	90 Å²	90	40.9 Å²	40.9	47%	0.471	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-47	176.5	-179.9	59.3	0	0	0	110.8	I97 G98 A99 I103 C104 C105 P133	I97-L101 WeakPolarHBondContact O-CB 3.44Å; I97-L101 PolarHBondContact O-N 3.47Å; G98-L101 PolarHBondContact O-N 2.93Å; A99-L101 VanDerWaalsContact C-N 3.34Å; A99-L101 PolarHBondContact O-N 2.96Å; L101-I103 PolarHBondContact O-N 3.14Å; L101-C104 PolarHBondContact O-N 2.91Å; L101-C105 WeakPolarHBondContact O-CB 3.34Å; L101-C105 PolarHBondContact O-N 2.91Å; L101-C105 PolarHBondContact O-SG 3.01Å; L101-P133 HydrophobicContact CB-CB 4.41Å; L101-P133 HydrophobicContact CD2-CB 3.96Å; L101-P133 HydrophobicContact CD2-CG 3.83Å; L101-P133 HydrophobicContact CG-CB 4.22Å; L101-P133 HydrophobicContact CG-CG 3.94Å
102	A	97.9	Very high	96.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-45.5	176.9	0	0	0	0	0	112.1	G98 A99 M106 A130 L134 M258 V262	G98-A102 PolarHBondContact O-N 3.01Å; A99-A102 PolarHBondContact O-N 3.29Å; A102-M106 WeakPolarHBondContact O-CB 3.37Å; A102-M106 PolarHBondContact O-N 3.05Å; A102-A130 WeakPolarHBondContact CA-O 3.47Å; A102-A130 WeakPolarHBondContact CB-O 3.21Å; A102-L134 HydrophobicContact CB-CB 4.42Å; A102-M258 HydrophobicContact CB-CG 4.47Å; A102-M258 HydrophobicContact CB-SD 4.18Å; A102-V262 HydrophobicContact CB-CG2 4.23Å
103	I	98.6	Very high	97	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.9	-44.5	178.9	-64.4	164.1	0	0	0	111.4	F64 A99 L100 L101 M106 I107 F225 F255 M258 T259 V262	F64-I103 HydrophobicContact CD1-CG2 4.39Å; F64-I103 HydrophobicContact CE1-CD1 4.26Å; F64-I103 HydrophobicContact CE1-CG2 3.76Å; F64-I103 HydrophobicContact CZ-CD1 4.26Å; A99-I103 WeakPolarHBondContact O-CG1 3.28Å; A99-I103 PolarHBondContact O-N 2.82Å; L100-I103 PolarHBondContact O-N 3.49Å; L101-I103 PolarHBondContact O-N 3.14Å; I103-M106 WeakPolarHBondContact O-CB 3.28Å; I103-M106 PolarHBondContact O-N 3.17Å; I103-M106 VanDerWaalsContact O-N 3.08Å; I103-I107 HydrophobicContact CG2-CD1 3.91Å; I103-I107 HydrophobicContact CG2-CG1 4.44Å; I103-I107 WeakPolarHBondContact O-CG1 3.44Å; I103-I107 PolarHBondContact O-N 2.91Å; I103-F225 HydrophobicContact CD1-CD1 3.67Å; I103-F225 HydrophobicContact CD1-CE1 3.86Å; I103-F255 HydrophobicContact CG2-CD2 3.75Å; I103-F255 HydrophobicContact CG2-CE2 3.84Å; I103-M258 HydrophobicContact CG1-CG 4.14Å; I103-T259 HydrophobicContact CD1-CG2 4.06Å; I103-V262 HydrophobicContact CD1-CB 4.42Å; I103-V262 HydrophobicContact CD1-CG1 4.27Å; I103-V262 HydrophobicContact CD1-CG2 4.39Å; I103-V262 HydrophobicContact CG1-CG2 4.07Å
104	C	98.4	Very high	97.1	Very high	47 Å²	47	29.7 Å²	29.7	32%	0.318	16%	0.161	S	C	.	.	H	α-helix	trans	-61.2	-46.3	177.7	-176.8	0	0	0	0	111.4	L65 L100 L101 M106 I107 F108	L65-C104 HydrophobicContact CD1-CB 4.07Å; L65-C104 HydrophobicContact CD2-CB 3.95Å; L100-C104 WeakPolarHBondContact O-CB 3.26Å; L100-C104 PolarHBondContact O-N 2.95Å; L101-C104 PolarHBondContact O-N 2.91Å; C104-M106 PolarHBondContact O-N 2.62Å; C104-I107 PolarHBondContact O-N 3.44Å; C104-F108 PolarHBondContact O-N 3.43Å
105	C	97.8	Very high	97.2	Very high	44 Å²	44	30.2 Å²	30.2	30%	0.297	16%	0.164	S	C	.	.	H	α-helix	trans	-57.3	-39.7	172.9	-74.8	0	0	0	0	111.1	L101 F108 L109 A130	L101-C105 WeakPolarHBondContact O-CB 3.34Å; L101-C105 PolarHBondContact O-N 2.91Å; L101-C105 PolarHBondContact O-SG 3.01Å; C105-F108 PolarHBondContact O-N 3.35Å; C105-L109 WeakPolarHBondContact O-CB 3.48Å; C105-L109 WeakPolarHBondContact O-CG 3.37Å; C105-L109 PolarHBondContact O-N 3.12Å; C105-A130 HydrophobicContact CB-CB 4.06Å
106	M	97.3	Very high	97.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-70.8	-40.3	-179.6	-167.4	49.2	53.5	0	0	113.8	A102 I103 C104 F108 L109 G110 P127 A130 T179 Y254 M258	A102-M106 WeakPolarHBondContact O-CB 3.37Å; A102-M106 PolarHBondContact O-N 3.05Å; I103-M106 WeakPolarHBondContact O-CB 3.28Å; I103-M106 PolarHBondContact O-N 3.17Å; I103-M106 VanDerWaalsContact O-N 3.08Å; C104-M106 PolarHBondContact O-N 2.62Å; M106-F108 VanDerWaalsContact C-N 3.3Å; M106-F108 PolarHBondContact O-N 3.4Å; M106-L109 PolarHBondContact O-N 3.44Å; M106-G110 PolarHBondContact O-N 2.97Å; M106-P127 HydrophobicContact CE-CB 3.84Å; M106-P127 HydrophobicContact CE-CG 4.14Å; M106-P127 HydrophobicContact SD-CG 4.45Å; M106-A130 HydrophobicContact CE-CB 3.27Å; M106-T179 HydrophobicContact CG-CG2 4.43Å; M106-T179 HydrophobicContact SD-CG2 4.35Å; M106-Y254 HydrophobicContact CG-CG 4.48Å; M106-Y254 WeakPolarHBondContact CG-O 3.35Å; M106-Y254 VanDerWaalsContact SD-CB 3.56Å; M106-Y254 HydrophobicContact SD-CD2 3.46Å; M106-Y254 WeakPolarHBondContact SD-CD2 3.26Å; M106-Y254 HydrophobicContact SD-CE2 4.47Å; M106-Y254 HydrophobicContact SD-CG 3.73Å; M106-M258 HydrophobicContact CB-CB 3.72Å; M106-M258 HydrophobicContact CB-CE 4.42Å; M106-M258 HydrophobicContact CB-CG 3.86Å; M106-M258 HydrophobicContact CE-CE 3.5Å; M106-M258 HydrophobicContact CG-CB 3.61Å; M106-M258 HydrophobicContact CG-CG 4.26Å
107	I	98.4	Very high	97	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-47.1	172.8	-68	159.9	0	0	0	109.5	V58 L65 I103 C104 G110 F111 T251 F255	V58-I107 HydrophobicContact CG2-CG2 4.44Å; L65-I107 HydrophobicContact CD1-CD1 3.83Å; L65-I107 HydrophobicContact CD2-CD1 4.26Å; L65-I107 HydrophobicContact CG-CD1 3.89Å; I103-I107 HydrophobicContact CG2-CD1 3.91Å; I103-I107 HydrophobicContact CG2-CG1 4.44Å; I103-I107 WeakPolarHBondContact O-CG1 3.44Å; I103-I107 PolarHBondContact O-N 2.91Å; C104-I107 PolarHBondContact O-N 3.44Å; I107-G110 PolarHBondContact O-N 3.35Å; I107-F111 WeakPolarHBondContact O-CB 3.3Å; I107-F111 PolarHBondContact O-N 3.32Å; I107-T251 HydrophobicContact CG2-CG2 4.27Å; I107-F255 HydrophobicContact CD1-CD2 3.72Å; I107-F255 HydrophobicContact CD1-CE2 4.1Å; I107-F255 HydrophobicContact CD1-CG 4.24Å; I107-F255 HydrophobicContact CG1-CB 3.77Å; I107-F255 HydrophobicContact CG1-CD2 3.68Å; I107-F255 HydrophobicContact CG1-CG 3.84Å
108	F	98	Very high	96.8	Very high	138 Å²	138	39.4 Å²	39.4	61%	0.605	21%	0.214	S	C	*	.	H	α-helix	trans	-60.3	-48.7	177.7	169.1	-108.6	0	0	0	112.4	C104 C105 M106 F111 A112	C104-F108 PolarHBondContact O-N 3.43Å; C105-F108 PolarHBondContact O-N 3.35Å; M106-F108 VanDerWaalsContact C-N 3.3Å; M106-F108 PolarHBondContact O-N 3.4Å; F108-F111 PolarHBondContact O-N 2.73Å; F108-A112 WeakPolarHBondContact O-CB 3.41Å; F108-A112 PolarHBondContact O-N 2.98Å
109	L	96.1	Very high	96.4	Very high	31 Å²	31	47 Å²	47	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-69	-34.7	-178.1	-70.7	173.9	0	0	0	112.7	C105 M106 A112 D113 L126 A130	C105-L109 WeakPolarHBondContact O-CB 3.48Å; C105-L109 WeakPolarHBondContact O-CG 3.37Å; C105-L109 PolarHBondContact O-N 3.12Å; M106-L109 PolarHBondContact O-N 3.44Å; L109-A112 PolarHBondContact O-N 2.92Å; L109-D113 PolarHBondContact O-N 3.3Å; L109-L126 HydrophobicContact CB-CD1 4.37Å; L109-L126 HydrophobicContact CD1-CB 4.07Å; L109-L126 HydrophobicContact CD1-CD2 4.18Å; L109-L126 HydrophobicContact CD2-CD1 4.34Å; L109-L126 HydrophobicContact CD2-CD2 3.86Å; L109-A130 HydrophobicContact CD1-CB 3.99Å
110	G	97.1	Very high	95.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66	-40.8	172.7	0	0	0	0	0	112	M106 I107 D113 D114 T251	M106-G110 PolarHBondContact O-N 2.97Å; I107-G110 PolarHBondContact O-N 3.35Å; G110-D113 WeakPolarHBondContact O-CB 3.45Å; G110-D113 PolarHBondContact O-N 3.29Å; G110-D114 PolarHBondContact O-N 2.99Å; G110-T251 PolarHBondContact O-OG1 3.16Å
111	F	97.9	Very high	95.4	Very high	61 Å²	61	61.7 Å²	61.7	27%	0.268	30%	0.295	S	S	.	.	H	α-helix	trans	-65.7	-39.6	173.2	-173.9	-107.9	0	0	0	112.4	F34 L39 V58 I107 F108 D113 D114 V115 T251	F34-F111 HydrophobicContact CE1-CE2 4.37Å; L39-F111 HydrophobicContact CD1-CE2 3.89Å; L39-F111 HydrophobicContact CD1-CZ 3.85Å; V58-F111 HydrophobicContact CB-CD2 3.93Å; V58-F111 HydrophobicContact CB-CE2 4.39Å; V58-F111 HydrophobicContact CG1-CD2 4.23Å; V58-F111 HydrophobicContact CG1-CE2 4.2Å; V58-F111 HydrophobicContact CG2-CB 4.34Å; V58-F111 HydrophobicContact CG2-CD2 3.91Å; V58-F111 HydrophobicContact CG2-CE2 4.43Å; V58-F111 HydrophobicContact CG2-CG 4.09Å; I107-F111 WeakPolarHBondContact O-CB 3.3Å; I107-F111 PolarHBondContact O-N 3.32Å; F108-F111 PolarHBondContact O-N 2.73Å; F111-D113 VanDerWaalsContact C-N 3.3Å; F111-D113 PolarHBondContact O-N 2.74Å; F111-D114 PolarHBondContact O-N 3.13Å; F111-V115 HydrophobicContact CD1-CG2 4.22Å; F111-V115 HydrophobicContact CE1-CG2 3.86Å; F111-V115 HydrophobicContact CE2-CG2 4.23Å; F111-V115 HydrophobicContact CZ-CG2 3.86Å; F111-V115 VanDerWaalsContact O-CG2 3.23Å; F111-V115 WeakPolarHBondContact O-CG2 3.13Å; F111-V115 PolarHBondContact O-N 3.35Å; F111-T251 WeakPolarHBondContact CA-OG1 3.27Å; F111-T251 HydrophobicContact CB-CG2 4.16Å; F111-T251 PolarHBondContact N-OG1 3.36Å
112	A	96.9	Very high	95	Very high	21 Å²	21	60 Å²	60	17%	0.174	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-37.3	172.5	0	0	0	0	0	112	F108 L109 V115 L116	F108-A112 WeakPolarHBondContact O-CB 3.41Å; F108-A112 PolarHBondContact O-N 2.98Å; L109-A112 PolarHBondContact O-N 2.92Å; A112-V115 PolarHBondContact O-N 3.47Å; A112-L116 WeakPolarHBondContact O-CB 3.48Å; A112-L116 VanDerWaalsContact O-CG 3.25Å; A112-L116 WeakPolarHBondContact O-CG 3.27Å; A112-L116 PolarHBondContact O-N 3.46Å
113	D	95.1	Very high	94.6	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-44.9	175.4	-165.6	16.2	0	0	0	111.7	L109 G110 F111 V115 L116 N117 L118 K123 Y254	L109-D113 PolarHBondContact O-N 3.3Å; G110-D113 WeakPolarHBondContact O-CB 3.45Å; G110-D113 PolarHBondContact O-N 3.29Å; F111-D113 VanDerWaalsContact C-N 3.3Å; F111-D113 PolarHBondContact O-N 2.74Å; D113-V115 VanDerWaalsContact C-N 3.35Å; D113-V115 PolarHBondContact O-N 2.76Å; D113-L116 PolarHBondContact O-N 3.28Å; D113-N117 WeakPolarHBondContact O-CA 3.46Å; D113-N117 PolarHBondContact O-N 2.9Å; D113-L118 HydrophobicContact CB-CD1 4.26Å; D113-L118 VanDerWaalsContact OD1-CB 3.23Å; D113-L118 WeakPolarHBondContact OD1-CB 3.26Å; D113-L118 PolarHBondContact OD1-N 3.36Å; D113-K123 IonicContact OD1-NZ 2.99Å; D113-K123 WeakPolarHBondContact OD2-CE 3.38Å; D113-K123 IonicContact OD2-NZ 2.86Å; D113-K123 PolarHBondContact OD2-NZ 3.47Å; D113-K123 VanDerWaalsContact OD2-NZ 3.14Å; D113-Y254 HydrophobicContact CB-CE2 4.31Å; D113-Y254 PolarHBondContact OD2-OH 2.96Å
114	D	96.2	Very high	94.2	Very high	22 Å²	22	65.5 Å²	65.5	12%	0.118	31%	0.311	C	S	.	.	H	α-helix	trans	-59.3	-44.1	175.5	-81	-29.8	0	0	0	112.2	S55 G110 F111 D250 T251	S55-D114 WeakPolarHBondContact CB-OD2 3.47Å; S55-D114 WeakPolarHBondContact OG-CB 3.25Å; S55-D114 PolarHBondContact OG-OD2 2.69Å; G110-D114 PolarHBondContact O-N 2.99Å; F111-D114 PolarHBondContact O-N 3.13Å; D114-D250 VanDerWaalsContact OD1-CB 3.26Å; D114-D250 WeakPolarHBondContact OD1-CB 3.48Å; D114-D250 PolarHBondContact OD1-N 3.14Å; D114-D250 PolarHBondContact OD2-N 2.96Å; D114-T251 WeakPolarHBondContact OD2-CB 3.42Å; D114-T251 PolarHBondContact OD2-N 2.9Å; D114-T251 PolarHBondContact OD2-OG1 2.71Å
115	V	96.6	Very high	93.8	Very high	67 Å²	67	68.2 Å²	68.2	41%	0.406	32%	0.322	S	S	.	.	H	α-helix	trans	-72.1	-44	-178.7	175.4	0	0	0	0	111.6	L39 F111 A112 D113	L39-V115 HydrophobicContact CD1-CG2 4.34Å; L39-V115 HydrophobicContact CD2-CG2 3.91Å; F111-V115 HydrophobicContact CD1-CG2 4.22Å; F111-V115 HydrophobicContact CE1-CG2 3.86Å; F111-V115 HydrophobicContact CE2-CG2 4.23Å; F111-V115 HydrophobicContact CZ-CG2 3.86Å; F111-V115 VanDerWaalsContact O-CG2 3.23Å; F111-V115 WeakPolarHBondContact O-CG2 3.13Å; F111-V115 PolarHBondContact O-N 3.35Å; A112-V115 PolarHBondContact O-N 3.47Å; D113-V115 VanDerWaalsContact C-N 3.35Å; D113-V115 PolarHBondContact O-N 2.76Å
116	L	95.3	Very high	93.3	Very high	116 Å²	116	67.8 Å²	67.8	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-95.4	-11	-170.4	-58.3	175.8	0	0	0	113.7	A112 D113 L118	A112-L116 WeakPolarHBondContact O-CB 3.48Å; A112-L116 VanDerWaalsContact O-CG 3.25Å; A112-L116 WeakPolarHBondContact O-CG 3.27Å; A112-L116 PolarHBondContact O-N 3.46Å; D113-L116 PolarHBondContact O-N 3.28Å; L116-L118 HydrophobicContact CB-CD2 3.76Å; L116-L118 HydrophobicContact CB-CG 4.22Å; L116-L118 HydrophobicContact CD1-CD2 4.25Å
117	N	92.2	Very high	92.9	Very high	122 Å²	122	67.8 Å²	67.8	65%	0.652	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	65.1	-174.9	-73	-88.5	0	0	0	112	D113	D113-N117 WeakPolarHBondContact O-CA 3.46Å; D113-N117 PolarHBondContact O-N 2.9Å
118	L	91.4	Very high	92.5	Very high	47 Å²	47	69.9 Å²	69.9	25%	0.246	33%	0.33	C	S	.	.			trans	-70.7	152.3	-171.5	-56.6	173.9	0	0	0	112	D113 L116 H122 L126	D113-L118 HydrophobicContact CB-CD1 4.26Å; D113-L118 VanDerWaalsContact OD1-CB 3.23Å; D113-L118 WeakPolarHBondContact OD1-CB 3.26Å; D113-L118 PolarHBondContact OD1-N 3.36Å; L116-L118 HydrophobicContact CB-CD2 3.76Å; L116-L118 HydrophobicContact CB-CG 4.22Å; L116-L118 HydrophobicContact CD1-CD2 4.25Å; L118-H122 HydrophobicContact CB-CB 4.09Å; L118-H122 HydrophobicContact CD1-CB 4.25Å; L118-L126 HydrophobicContact CD1-CD1 3.55Å
119	R	90.4	Very high	92.2	Very high	167 Å²	167	69 Å²	69	63%	0.63	33%	0.329	S	S	*	.			trans	-63.9	148.4	174.4	-58.9	-176.9	-173.1	-178	2	111.1	R121 H122	R119-R121 HydrophobicContact CB-CG 4.3Å; R119-R121 PolarHBondContact O-N 2.88Å; R119-H122 PolarHBondContact O-N 2.93Å; R119-H122 PolarHBondContact O-ND1 3.48Å
120	W	85.4	Confident	92	Very high	195 Å²	195	67.7 Å²	67.7	74%	0.739	32%	0.323	S	S	*	.	H	α-helix	trans	-46.4	-35.8	-178.7	72.4	-94	0	0	0	115	H122 K123 L124	W120-H122 VanDerWaalsContact C-N 3.26Å; W120-H122 PolarHBondContact O-N 3.46Å; W120-K123 WeakPolarHBondContact O-CA 3.43Å; W120-K123 VanDerWaalsContact O-CB 3.29Å; W120-K123 WeakPolarHBondContact O-CB 3.39Å; W120-K123 PolarHBondContact O-N 2.81Å; W120-L124 HydrophobicContact CE3-CD1 3.99Å; W120-L124 HydrophobicContact CZ3-CD1 3.69Å
121	R	89.2	Confident	91.8	Very high	120 Å²	120	67.8 Å²	67.8	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-58.4	-36.7	177.5	68	-175.1	-176.3	-166.5	1.4	112.9	R119 K123 L124 L125	R119-R121 HydrophobicContact CB-CG 4.3Å; R119-R121 PolarHBondContact O-N 2.88Å; R121-K123 VanDerWaalsContact C-N 3.31Å; R121-L124 PolarHBondContact O-N 3.19Å; R121-L125 WeakPolarHBondContact O-CG 3.4Å; R121-L125 PolarHBondContact O-N 2.95Å; R121-L125 VanDerWaalsContact O-N 3.11Å
122	H	89.4	Confident	91.6	Very high	53 Å²	53	68.1 Å²	68.1	25%	0.245	33%	0.327	C	S	.	.	H	α-helix	trans	-73.2	-28.4	178.3	-49.3	111	0	0	0	110.8	L118 R119 W120 L124 L125 L126	L118-H122 HydrophobicContact CB-CB 4.09Å; L118-H122 HydrophobicContact CD1-CB 4.25Å; R119-H122 PolarHBondContact O-N 2.93Å; R119-H122 PolarHBondContact O-ND1 3.48Å; W120-H122 VanDerWaalsContact C-N 3.26Å; W120-H122 PolarHBondContact O-N 3.46Å; H122-L124 PolarHBondContact O-N 2.95Å; H122-L124 VanDerWaalsContact O-N 3.16Å; H122-L125 PolarHBondContact O-N 2.92Å; H122-L126 HydrophobicContact CB-CD1 4.25Å; H122-L126 HydrophobicContact CB-CG 4.26Å; H122-L126 VanDerWaalsContact O-CB 3.24Å; H122-L126 WeakPolarHBondContact O-CB 3.35Å; H122-L126 WeakPolarHBondContact O-CG 3.29Å; H122-L126 PolarHBondContact O-N 2.78Å
123	K	88.7	Confident	91.4	Very high	44 Å²	44	68.4 Å²	68.4	19%	0.191	33%	0.328	C	S	.	.	H	α-helix	trans	-63.8	-17.8	173.5	-51	-159.8	172.7	-141.7	0	113.4	D113 W120 R121 P127 N180 D250 Y254	D113-K123 IonicContact OD1-NZ 2.99Å; D113-K123 WeakPolarHBondContact OD2-CE 3.38Å; D113-K123 IonicContact OD2-NZ 2.86Å; D113-K123 PolarHBondContact OD2-NZ 3.47Å; D113-K123 VanDerWaalsContact OD2-NZ 3.14Å; W120-K123 WeakPolarHBondContact O-CA 3.43Å; W120-K123 VanDerWaalsContact O-CB 3.29Å; W120-K123 WeakPolarHBondContact O-CB 3.39Å; W120-K123 PolarHBondContact O-N 2.81Å; R121-K123 VanDerWaalsContact C-N 3.31Å; K123-P127 VanDerWaalsContact O-CD 3.24Å; K123-P127 WeakPolarHBondContact O-CD 3.47Å; K123-P127 WeakPolarHBondContact O-CG 3.32Å; K123-N180 PolarHBondContact O-ND2 3.11Å; K123-D250 IonicContact NZ-OD1 2.87Å; K123-D250 IonicContact NZ-OD2 3.92Å; K123-D250 PolarHBondContact NZ-OD2 3.4Å; K123-Y254 WeakPolarHBondContact CB-OH 3.22Å; K123-Y254 WeakPolarHBondContact CD-OH 3.38Å; K123-Y254 VanDerWaalsContact CG-OH 3.22Å; K123-Y254 WeakPolarHBondContact CG-OH 3.31Å
124	L	89.6	Confident	91.2	Very high	73 Å²	73	68.4 Å²	68.4	38%	0.382	33%	0.328	S	S	.	.	H	α-helix	trans	-94.6	-42.4	170.6	-58.5	178.2	0	0	0	112.4	W120 R121 H122 T128 V176	W120-L124 HydrophobicContact CE3-CD1 3.99Å; W120-L124 HydrophobicContact CZ3-CD1 3.69Å; R121-L124 PolarHBondContact O-N 3.19Å; H122-L124 PolarHBondContact O-N 2.95Å; H122-L124 VanDerWaalsContact O-N 3.16Å; L124-T128 PolarHBondContact O-OG1 3.31Å; L124-V176 HydrophobicContact CD2-CG1 3.68Å
125	L	90.4	Very high	91.1	Very high	103 Å²	103	68.3 Å²	68.3	54%	0.539	33%	0.327	S	S	.	.	H	α-helix	trans	-71.3	-40.8	-177.2	-67.7	171.3	0	0	0	113	R121 H122 T128 M129	R121-L125 WeakPolarHBondContact O-CG 3.4Å; R121-L125 PolarHBondContact O-N 2.95Å; R121-L125 VanDerWaalsContact O-N 3.11Å; H122-L125 PolarHBondContact O-N 2.92Å; L125-T128 WeakPolarHBondContact O-CB 3.41Å; L125-T128 PolarHBondContact O-N 3.42Å; L125-M129 WeakPolarHBondContact O-CG 3.29Å; L125-M129 PolarHBondContact O-N 3.45Å
126	L	88.1	Confident	91	Very high	35 Å²	35	70.6 Å²	70.6	18%	0.183	34%	0.335	C	S	.	.	H	α-helix	trans	-64	-46.2	-175.4	-68.1	-179.7	0	0	0	112.5	L109 L118 H122 T128 M129 A130	L109-L126 HydrophobicContact CB-CD1 4.37Å; L109-L126 HydrophobicContact CD1-CB 4.07Å; L109-L126 HydrophobicContact CD1-CD2 4.18Å; L109-L126 HydrophobicContact CD2-CD1 4.34Å; L109-L126 HydrophobicContact CD2-CD2 3.86Å; L118-L126 HydrophobicContact CD1-CD1 3.55Å; H122-L126 HydrophobicContact CB-CD1 4.25Å; H122-L126 HydrophobicContact CB-CG 4.26Å; H122-L126 VanDerWaalsContact O-CB 3.24Å; H122-L126 WeakPolarHBondContact O-CB 3.35Å; H122-L126 WeakPolarHBondContact O-CG 3.29Å; H122-L126 PolarHBondContact O-N 2.78Å; L126-T128 VanDerWaalsContact C-N 3.3Å; L126-T128 PolarHBondContact O-N 2.94Å; L126-M129 PolarHBondContact O-N 3.07Å; L126-A130 WeakPolarHBondContact O-CB 3.46Å; L126-A130 PolarHBondContact O-N 3.37Å
127	P	88.4	Confident	90.9	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.5	-34	172.7	-20.4	33.3	0	0	0	114.4	M106 K123 S131 V176	M106-P127 HydrophobicContact CE-CB 3.84Å; M106-P127 HydrophobicContact CE-CG 4.14Å; M106-P127 HydrophobicContact SD-CG 4.45Å; K123-P127 VanDerWaalsContact O-CD 3.24Å; K123-P127 WeakPolarHBondContact O-CD 3.47Å; K123-P127 WeakPolarHBondContact O-CG 3.32Å; P127-S131 WeakPolarHBondContact O-CB 3.18Å; P127-S131 PolarHBondContact O-N 3.05Å; P127-S131 PolarHBondContact O-OG 3.18Å; P127-V176 HydrophobicContact CB-CB 4.4Å; P127-V176 HydrophobicContact CB-CG2 3.89Å
128	T	90.8	Very high	90.9	Very high	53 Å²	53	59.8 Å²	59.8	33%	0.325	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-50.4	174	-52.9	0	0	0	0	110.5	L124 L125 L126 S131 V176	L124-T128 PolarHBondContact O-OG1 3.31Å; L125-T128 WeakPolarHBondContact O-CB 3.41Å; L125-T128 PolarHBondContact O-N 3.42Å; L126-T128 VanDerWaalsContact C-N 3.3Å; L126-T128 PolarHBondContact O-N 2.94Å; T128-S131 PolarHBondContact O-N 2.87Å; T128-S131 PolarHBondContact O-OG 2.91Å; T128-V176 VanDerWaalsContact OG1-CG2 3.28Å; T128-V176 WeakPolarHBondContact OG1-CG2 3.39Å
129	M	90.8	Very high	91	Very high	119 Å²	119	64 Å²	64	59%	0.586	29%	0.294	S	S	*	.	H	α-helix	trans	-64.9	-42.3	-180	-68.3	-59.1	-64.1	0	0	112.8	L125 L126 S131 L132	L125-M129 WeakPolarHBondContact O-CG 3.29Å; L125-M129 PolarHBondContact O-N 3.45Å; L126-M129 PolarHBondContact O-N 3.07Å; M129-S131 PolarHBondContact O-N 3.45Å; M129-L132 HydrophobicContact CE-CD1 3.79Å; M129-L132 WeakPolarHBondContact O-CB 3.31Å; M129-L132 WeakPolarHBondContact O-CG 3.4Å; M129-L132 PolarHBondContact O-N 3.38Å; M129-L132 HydrophobicContact SD-CD1 3.99Å
130	A	92.3	Very high	91.1	Very high	4 Å²	4	60.4 Å²	60.4	3%	0.033	29%	0.291	C	S	.	.	H	α-helix	trans	-70.3	-19	178.6	0	0	0	0	0	113.6	A102 C105 M106 L109 L126 L132 P133 M258	A102-A130 WeakPolarHBondContact CA-O 3.47Å; A102-A130 WeakPolarHBondContact CB-O 3.21Å; C105-A130 HydrophobicContact CB-CB 4.06Å; M106-A130 HydrophobicContact CE-CB 3.27Å; L109-A130 HydrophobicContact CD1-CB 3.99Å; L126-A130 WeakPolarHBondContact O-CB 3.46Å; L126-A130 PolarHBondContact O-N 3.37Å; A130-L132 VanDerWaalsContact C-N 3.33Å; A130-P133 WeakPolarHBondContact O-CD 3.33Å; A130-M258 HydrophobicContact CB-CE 4.02Å
131	S	92.3	Very high	91.2	Very high	1 Å²	1	53 Å²	53	1%	0.007	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-10.3	173.5	74.1	0	0	0	0	113.4	P127 T128 M129 L134 L135	P127-S131 WeakPolarHBondContact O-CB 3.18Å; P127-S131 PolarHBondContact O-N 3.05Å; P127-S131 PolarHBondContact O-OG 3.18Å; T128-S131 PolarHBondContact O-N 2.87Å; T128-S131 PolarHBondContact O-OG 2.91Å; M129-S131 PolarHBondContact O-N 3.45Å; S131-L134 VanDerWaalsContact O-CB 3.25Å; S131-L134 WeakPolarHBondContact O-CB 3.4Å; S131-L134 PolarHBondContact O-N 3.38Å; S131-L134 VanDerWaalsContact O-N 3.08Å; S131-L135 VanDerWaalsContact O-CD1 3.29Å; S131-L135 WeakPolarHBondContact O-CD1 3.31Å; S131-L135 PolarHBondContact O-N 3.32Å
132	L	93.4	Very high	91.1	Very high	68 Å²	68	50.3 Å²	50.3	36%	0.356	26%	0.257	S	S	.	.	H	α-helix	trans	-58	-42	-178	-67.2	175.4	0	0	0	114.2	M129 A130 L134 L135 M136	M129-L132 HydrophobicContact CE-CD1 3.79Å; M129-L132 WeakPolarHBondContact O-CB 3.31Å; M129-L132 WeakPolarHBondContact O-CG 3.4Å; M129-L132 PolarHBondContact O-N 3.38Å; M129-L132 HydrophobicContact SD-CD1 3.99Å; A130-L132 VanDerWaalsContact C-N 3.33Å; L132-L134 VanDerWaalsContact C-N 3.27Å; L132-L134 PolarHBondContact O-N 2.97Å; L132-L135 PolarHBondContact O-N 3.05Å; L132-M136 WeakPolarHBondContact O-CG 3.14Å; L132-M136 PolarHBondContact O-N 2.88Å
133	P	92.7	Very high	90.9	Very high	28 Å²	28	49.4 Å²	49.4	18%	0.182	26%	0.262	C	S	.	.	H	α-helix	trans	-56.7	-41.7	174.1	-25.5	35.7	0	0	0	112.7	L101 A130 M136 V137	L101-P133 HydrophobicContact CB-CB 4.41Å; L101-P133 HydrophobicContact CD2-CB 3.96Å; L101-P133 HydrophobicContact CD2-CG 3.83Å; L101-P133 HydrophobicContact CG-CB 4.22Å; L101-P133 HydrophobicContact CG-CG 3.94Å; A130-P133 WeakPolarHBondContact O-CD 3.33Å; P133-M136 PolarHBondContact O-N 2.96Å; P133-V137 WeakPolarHBondContact O-CG2 3.14Å; P133-V137 PolarHBondContact O-N 3.47Å
134	L	91.8	Very high	91	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.2	-44.6	177.3	177	67.8	0	0	0	111.5	A102 S131 L132 M136 V137 Y138 V262 I265 L266	A102-L134 HydrophobicContact CB-CB 4.42Å; S131-L134 VanDerWaalsContact O-CB 3.25Å; S131-L134 WeakPolarHBondContact O-CB 3.4Å; S131-L134 PolarHBondContact O-N 3.38Å; S131-L134 VanDerWaalsContact O-N 3.08Å; L132-L134 VanDerWaalsContact C-N 3.27Å; L132-L134 PolarHBondContact O-N 2.97Å; L134-M136 VanDerWaalsContact C-N 3.33Å; L134-M136 PolarHBondContact O-N 2.97Å; L134-V137 PolarHBondContact O-N 2.89Å; L134-Y138 WeakPolarHBondContact O-CB 3.32Å; L134-Y138 PolarHBondContact O-N 2.87Å; L134-V262 HydrophobicContact CD1-CB 4.5Å; L134-V262 HydrophobicContact CD1-CG2 4.18Å; L134-V262 HydrophobicContact CD2-CG2 4.04Å; L134-I265 HydrophobicContact CD1-CB 4.39Å; L134-I265 HydrophobicContact CD1-CG2 4.11Å; L134-I265 HydrophobicContact CD2-CB 4.16Å; L134-I265 HydrophobicContact CD2-CD1 3.47Å; L134-I265 VanDerWaalsContact CD2-CD1 3.47Å; L134-I265 HydrophobicContact CD2-CG1 4.38Å; L134-I265 HydrophobicContact CD2-CG2 4.24Å; L134-I265 HydrophobicContact CG-CB 4.48Å; L134-I265 HydrophobicContact CG-CD1 4.4Å; L134-I265 HydrophobicContact CG-CG2 4.1Å; L134-L266 HydrophobicContact CD1-CD1 3.57Å; L134-L266 HydrophobicContact CD1-CD2 3.79Å; L134-L266 HydrophobicContact CD1-CG 3.42Å; L134-L266 VanDerWaalsContact CD1-CG 3.42Å
135	L	93.6	Very high	91.1	Very high	20 Å²	20	48.9 Å²	48.9	11%	0.105	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-38.8	176.5	-89.3	64.5	0	0	0	111.9	S131 L132 Y138 F139 Y168 M171	S131-L135 VanDerWaalsContact O-CD1 3.29Å; S131-L135 WeakPolarHBondContact O-CD1 3.31Å; S131-L135 PolarHBondContact O-N 3.32Å; L132-L135 PolarHBondContact O-N 3.05Å; L135-Y138 PolarHBondContact O-N 3.17Å; L135-F139 WeakPolarHBondContact O-CB 3.17Å; L135-F139 PolarHBondContact O-N 3.2Å; L135-Y168 HydrophobicContact CB-CD1 4.22Å; L135-Y168 HydrophobicContact CD2-CD1 4.28Å; L135-Y168 HydrophobicContact CG-CD1 4.02Å; L135-M171 HydrophobicContact CD1-CB 3.98Å; L135-M171 HydrophobicContact CG-CE 4.38Å
136	M	94.6	Very high	91.3	Very high	115 Å²	115	46.9 Å²	46.9	57%	0.567	26%	0.255	S	S	*	.	H	α-helix	trans	-67.6	-44.1	178.1	-68.6	-62.1	143.6	0	0	111.8	L132 P133 L134 Y138 F139 T140	L132-M136 WeakPolarHBondContact O-CG 3.14Å; L132-M136 PolarHBondContact O-N 2.88Å; P133-M136 PolarHBondContact O-N 2.96Å; L134-M136 VanDerWaalsContact C-N 3.33Å; L134-M136 PolarHBondContact O-N 2.97Å; M136-Y138 VanDerWaalsContact C-N 3.31Å; M136-Y138 PolarHBondContact O-N 2.99Å; M136-F139 WeakPolarHBondContact O-CB 3.46Å; M136-F139 PolarHBondContact O-N 2.78Å; M136-T140 WeakPolarHBondContact O-CG2 3.25Å; M136-T140 PolarHBondContact O-N 2.85Å; M136-T140 PolarHBondContact O-OG1 3.11Å; M136-T140 VanDerWaalsContact O-OG1 3.13Å
137	V	93.4	Very high	91.5	Very high	8 Å²	8	47.2 Å²	47.2	5%	0.048	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-44.9	173.2	168.1	0	0	0	0	110.9	V94 Q95 P133 L134 F139 T140 N141 L266	V94-V137 HydrophobicContact CG1-CG2 4Å; Q95-V137 HydrophobicContact CB-CG1 4.18Å; Q95-V137 HydrophobicContact CG-CG1 3.66Å; P133-V137 WeakPolarHBondContact O-CG2 3.14Å; P133-V137 PolarHBondContact O-N 3.47Å; L134-V137 PolarHBondContact O-N 2.89Å; V137-F139 VanDerWaalsContact C-N 3.31Å; V137-F139 PolarHBondContact O-N 3.26Å; V137-T140 PolarHBondContact O-N 2.66Å; V137-T140 PolarHBondContact O-OG1 3.26Å; V137-N141 WeakPolarHBondContact O-CB 3.37Å; V137-N141 PolarHBondContact O-N 3.22Å; V137-N141 PolarHBondContact O-OD1 3.19Å; V137-L266 HydrophobicContact CG1-CD1 4.41Å; V137-L266 HydrophobicContact CG1-CD2 3.78Å
138	Y	93.1	Very high	91.6	Very high	2 Å²	2	50 Å²	50	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-43.4	178.2	-169.5	-86.9	0	0	0	111.6	L134 L135 M136 F142 G143 N144 Y167 Y168 M171 I265 H268	L134-Y138 WeakPolarHBondContact O-CB 3.32Å; L134-Y138 PolarHBondContact O-N 2.87Å; L135-Y138 PolarHBondContact O-N 3.17Å; M136-Y138 VanDerWaalsContact C-N 3.31Å; M136-Y138 PolarHBondContact O-N 2.99Å; Y138-F142 HydrophobicContact CD2-CB 4.43Å; Y138-F142 AromaticContact CD2-CD2 3.96Å; Y138-F142 HydrophobicContact CD2-CD2 3.96Å; Y138-F142 HydrophobicContact CE2-CB 4.26Å; Y138-F142 HydrophobicContact CE2-CD2 4.32Å; Y138-F142 PolarHBondContact O-N 3.01Å; Y138-F142 VanDerWaalsContact O-N 3.09Å; Y138-G143 PolarHBondContact O-N 2.83Å; Y138-N144 WeakPolarHBondContact CE1-O 3.42Å; Y138-N144 PolarHBondContact OH-O 3.23Å; Y138-Y167 AromaticContact CE1-CD1 3.99Å; Y138-Y167 HydrophobicContact CE1-CD1 3.99Å; Y138-Y167 AromaticContact CE1-CE1 3.7Å; Y138-Y167 HydrophobicContact CE1-CE1 3.7Å; Y138-Y167 HydrophobicContact CE2-CE1 4.26Å; Y138-Y167 AromaticContact CZ-CE1 3.51Å; Y138-Y167 VanDerWaalsContact OH-CE1 3.29Å; Y138-Y167 WeakPolarHBondContact OH-CE1 3.48Å; Y138-Y168 HydrophobicContact CD1-CE1 4.14Å; Y138-M171 HydrophobicContact CD1-CE 3.61Å; Y138-M171 HydrophobicContact CD1-SD 3.97Å; Y138-M171 HydrophobicContact CD2-SD 3.89Å; Y138-M171 HydrophobicContact CE1-CE 4.11Å; Y138-M171 HydrophobicContact CE1-SD 4.28Å; Y138-M171 HydrophobicContact CE2-SD 4.21Å; Y138-M171 HydrophobicContact CG-CE 3.88Å; Y138-M171 HydrophobicContact CG-SD 3.76Å; Y138-I265 HydrophobicContact CD2-CG2 4.03Å; Y138-H268 AromaticContact CE2-NE2 3.56Å
139	F	93.2	Very high	91.7	Very high	135 Å²	135	47.6 Å²	47.6	59%	0.592	26%	0.258	S	S	*	.	H	α-helix	trans	-62.4	-43.4	178	176.9	-99.7	0	0	0	112.8	L135 M136 V137 Y168	L135-F139 WeakPolarHBondContact O-CB 3.17Å; L135-F139 PolarHBondContact O-N 3.2Å; M136-F139 WeakPolarHBondContact O-CB 3.46Å; M136-F139 PolarHBondContact O-N 2.78Å; V137-F139 VanDerWaalsContact C-N 3.31Å; V137-F139 PolarHBondContact O-N 3.26Å; F139-Y168 WeakPolarHBondContact CA-OH 3.08Å; F139-Y168 HydrophobicContact CB-CE1 3.91Å; F139-Y168 WeakPolarHBondContact CD2-OH 3.36Å
140	T	90.9	Very high	91.6	Very high	92 Å²	92	43.4 Å²	43.4	56%	0.564	24%	0.24	S	C	*	.	H	α-helix	trans	-78.6	-34	-176.1	53.8	0	0	0	0	113.5	M136 V137	M136-T140 WeakPolarHBondContact O-CG2 3.25Å; M136-T140 PolarHBondContact O-N 2.85Å; M136-T140 PolarHBondContact O-OG1 3.11Å; M136-T140 VanDerWaalsContact O-OG1 3.13Å; V137-T140 PolarHBondContact O-N 2.66Å; V137-T140 PolarHBondContact O-OG1 3.26Å
141	N	87.8	Confident	91.6	Very high	39 Å²	39	46.9 Å²	46.9	21%	0.209	26%	0.255	C	S	.	.	H	α-helix	trans	-103.1	-30.9	-168.5	-63.6	33.1	0	0	0	113.4	D91 V137	D91-N141 WeakPolarHBondContact CA-ND2 3.1Å; D91-N141 PolarHBondContact O-ND2 3.49Å; V137-N141 WeakPolarHBondContact O-CB 3.37Å; V137-N141 PolarHBondContact O-N 3.22Å; V137-N141 PolarHBondContact O-OD1 3.19Å
142	F	87.9	Confident	91.5	Very high	64 Å²	64	51 Å²	51	28%	0.281	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-52.3	-175.5	-56.5	-69.2	0	0	0	112.5	Q95 Y138 N144 L266 H268	Q95-F142 VanDerWaalsContact CD-CZ 3.48Å; Q95-F142 HydrophobicContact CG-CE2 4.32Å; Q95-F142 HydrophobicContact CG-CZ 4.44Å; Y138-F142 HydrophobicContact CD2-CB 4.43Å; Y138-F142 AromaticContact CD2-CD2 3.96Å; Y138-F142 HydrophobicContact CD2-CD2 3.96Å; Y138-F142 HydrophobicContact CE2-CB 4.26Å; Y138-F142 HydrophobicContact CE2-CD2 4.32Å; Y138-F142 PolarHBondContact O-N 3.01Å; Y138-F142 VanDerWaalsContact O-N 3.09Å; F142-N144 PolarHBondContact O-N 3.38Å; F142-L266 HydrophobicContact CD2-CD2 4.47Å; F142-L266 HydrophobicContact CE2-CD2 3.94Å; F142-H268 AromaticContact CD1-CE1 3.54Å; F142-H268 AromaticContact CD1-NE2 3.89Å; F142-H268 AromaticContact CD2-CE1 3.9Å; F142-H268 AromaticContact CE1-CE1 3.53Å; F142-H268 AromaticContact CE2-CE1 3.89Å; F142-H268 AromaticContact CG-CE1 3.72Å; F142-H268 AromaticContact CG-NE2 3.71Å; F142-H268 AromaticContact CZ-CE1 3.68Å
143	G	84.9	Confident	91.4	Very high	34 Å²	34	53.6 Å²	53.6	35%	0.351	29%	0.29	S	S	.	.			trans	64.6	0.1	175.5	0	0	0	0	0	116.1	Y138 T145	Y138-G143 PolarHBondContact O-N 2.83Å; G143-T145 PolarHBondContact O-N 3.39Å
144	N	90.3	Very high	91.4	Very high	85 Å²	85	54.4 Å²	54.4	46%	0.455	29%	0.289	S	S	.	.			trans	-78	113.2	-175.7	-174	11.2	0	0	0	111.6	Y138 F142 V146	Y138-N144 WeakPolarHBondContact CE1-O 3.42Å; Y138-N144 PolarHBondContact OH-O 3.23Å; F142-N144 PolarHBondContact O-N 3.38Å; N144-V146 WeakPolarHBondContact OD1-CB 3.45Å; N144-V146 PolarHBondContact OD1-N 3.28Å
145	T	93.4	Very high	91.5	Very high	21 Å²	21	59.7 Å²	59.7	13%	0.129	33%	0.333	C	S	.	.			trans	-105.9	4.3	177.9	51.8	0	0	0	0	113.3	G143 D162 L163 Y167 Y168	G143-T145 PolarHBondContact O-N 3.39Å; T145-D162 WeakPolarHBondContact CB-OD1 3.14Å; T145-D162 PolarHBondContact OG1-OD1 3.02Å; T145-L163 PolarHBondContact O-N 3.23Å; T145-L163 VanDerWaalsContact O-N 3.13Å; T145-Y167 HydrophobicContact CG2-CD1 4.44Å; T145-Y167 HydrophobicContact CG2-CG 4.48Å; T145-Y168 HydrophobicContact CG2-CD2 4.28Å; T145-Y168 HydrophobicContact CG2-CE2 3.6Å
146	V	93.3	Very high	91.5	Very high	61 Å²	61	65.7 Å²	65.7	37%	0.37	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.2	-178.6	-176.4	0	0	0	0	110	N144 H160 L161 D162	N144-V146 WeakPolarHBondContact OD1-CB 3.45Å; N144-V146 PolarHBondContact OD1-N 3.28Å; V146-H160 HydrophobicContact CG1-CB 3.8Å; V146-L161 WeakPolarHBondContact CA-O 3.32Å; V146-D162 HydrophobicContact CG2-CB 4.11Å
147	I	92.6	Very high	91.4	Very high	42 Å²	42	63.9 Å²	63.9	22%	0.215	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	142.4	173.1	62.8	159.3	0	0	0	111.3	H160 L161 L163 Y167	I147-H160 WeakPolarHBondContact O-CA 3.28Å; I147-L161 HydrophobicContact CG1-CB 4.11Å; I147-L161 WeakPolarHBondContact CG1-O 3.44Å; I147-L161 PolarHBondContact N-O 3.44Å; I147-L161 PolarHBondContact O-N 2.87Å; I147-L163 HydrophobicContact CD1-CD1 3.73Å; I147-L163 HydrophobicContact CD1-CG 4.28Å; I147-L163 HydrophobicContact CG1-CD1 3.94Å; I147-L163 HydrophobicContact CG1-CG 4.16Å; I147-L163 HydrophobicContact CG2-CD1 3.94Å; I147-Y167 HydrophobicContact CG2-CD2 3.84Å; I147-Y167 HydrophobicContact CG2-CE2 3.63Å
148	V	91.2	Very high	91.4	Very high	58 Å²	58	65.1 Å²	65.1	35%	0.352	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.9	164.7	-174	0	0	0	0	108.7	K271 Y404	V148-K271 PolarHBondContact O-NZ 3.49Å; V148-Y404 HydrophobicContact CB-CD1 4.34Å; V148-Y404 HydrophobicContact CB-CE1 4.13Å; V148-Y404 HydrophobicContact CG1-CD1 3.68Å; V148-Y404 HydrophobicContact CG1-CE1 3.87Å; V148-Y404 WeakPolarHBondContact O-CE1 3.22Å
149	V	91.7	Very high	91.3	Very high	3 Å²	3	69.6 Å²	69.6	2%	0.018	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-81.9	131.2	-179.2	179.3	0	0	0	0	109.8	F153 R154 L157 G158 M159 L161	V149-F153 HydrophobicContact CG1-CB 3.66Å; V149-R154 HydrophobicContact CB-CG 4.25Å; V149-R154 HydrophobicContact CG1-CG 4.11Å; V149-R154 PolarHBondContact O-NE 3.12Å; V149-L157 HydrophobicContact CG1-CB 4.14Å; V149-L157 HydrophobicContact CG1-CD1 4.49Å; V149-L157 HydrophobicContact CG2-CB 4.24Å; V149-G158 VanDerWaalsContact CB-O 3.29Å; V149-G158 WeakPolarHBondContact CB-O 3.28Å; V149-M159 PolarHBondContact N-O 2.85Å; V149-L161 HydrophobicContact CG2-CB 3.73Å
150	P	90.2	Very high	91.4	Very high	32 Å²	32	68.8 Å²	68.8	21%	0.208	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-61.1	144.3	175.5	-16.4	26.4	0	0	0	112.4	P152 F153 R154 F403 Y404	P150-P152 VanDerWaalsContact C-N 3.33Å; P150-P152 VanDerWaalsContact O-N 3.09Å; P150-F153 HydrophobicContact CB-CD2 4.12Å; P150-F153 HydrophobicContact CG-CD2 4.15Å; P150-F153 PolarHBondContact O-N 2.92Å; P150-R154 PolarHBondContact O-N 2.84Å; P150-F403 CarbonylContact C-O 3.57Å; P150-F403 VanDerWaalsContact CA-O 3.26Å; P150-F403 WeakPolarHBondContact CA-O 3.31Å; P150-F403 HydrophobicContact CB-CB 4.47Å; P150-Y404 HydrophobicContact CB-CE1 4.44Å; P150-Y404 HydrophobicContact CG-CE1 4.32Å
151	K	90.8	Very high	91.6	Very high	76 Å²	76	66.9 Å²	66.9	33%	0.33	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-40	-48.2	-178.3	-76.6	175.4	-177.7	179.8	0	114.9	F153 R154 R401 L402 F403 Y404 D405	K151-F153 PolarHBondContact O-N 3.29Å; K151-F153 VanDerWaalsContact O-N 3.14Å; K151-R154 PolarHBondContact O-N 2.89Å; K151-R401 PolarHBondContact NZ-O 3.07Å; K151-L402 WeakPolarHBondContact CD-O 3.46Å; K151-F403 WeakPolarHBondContact CG-O 3.15Å; K151-F403 PolarHBondContact N-O 3.18Å; K151-Y404 WeakPolarHBondContact CE-O 3.07Å; K151-Y404 PolarHBondContact NZ-O 3.4Å; K151-D405 WeakPolarHBondContact CE-OD1 3.23Å; K151-D405 IonicContact NZ-OD1 3.4Å; K151-D405 PolarHBondContact NZ-OD1 3.32Å
152	P	90.9	Very high	91.9	Very high	88 Å²	88	69.8 Å²	69.8	57%	0.571	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-60.2	-25.1	-179.3	-25.3	35.9	0	0	0	115	P150	P150-P152 VanDerWaalsContact C-N 3.33Å; P150-P152 VanDerWaalsContact O-N 3.09Å
153	F	91.8	Very high	92.3	Very high	122 Å²	122	69 Å²	69	54%	0.535	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-102.4	-6.5	-175.4	-58.3	-72.3	0	0	0	113.6	V149 P150 K151 A155 L156 L157	V149-F153 HydrophobicContact CG1-CB 3.66Å; P150-F153 HydrophobicContact CB-CD2 4.12Å; P150-F153 HydrophobicContact CG-CD2 4.15Å; P150-F153 PolarHBondContact O-N 2.92Å; K151-F153 PolarHBondContact O-N 3.29Å; K151-F153 VanDerWaalsContact O-N 3.14Å; F153-A155 VanDerWaalsContact C-N 3.27Å; F153-A155 PolarHBondContact O-N 2.88Å; F153-L156 PolarHBondContact O-N 3.36Å; F153-L156 VanDerWaalsContact O-N 3.1Å; F153-L157 HydrophobicContact CB-CD1 4.32Å; F153-L157 PolarHBondContact O-N 3.31Å
154	R	92.6	Very high	92.8	Very high	45 Å²	45	68.6 Å²	68.6	17%	0.17	39%	0.387	C	S	.	.	H	α-helix	trans	-65	-29.1	-174.9	-67.7	-178.2	-175.9	174.1	-6.7	113.7	V149 P150 K151 L156 G158 M159 D405	V149-R154 HydrophobicContact CB-CG 4.25Å; V149-R154 HydrophobicContact CG1-CG 4.11Å; V149-R154 PolarHBondContact O-NE 3.12Å; P150-R154 PolarHBondContact O-N 2.84Å; K151-R154 PolarHBondContact O-N 2.89Å; R154-L156 PolarHBondContact O-N 2.87Å; R154-G158 WeakPolarHBondContact CA-O 3.41Å; R154-G158 VanDerWaalsContact O-CA 3.3Å; R154-G158 WeakPolarHBondContact O-CA 3.47Å; R154-G158 PolarHBondContact O-N 3.08Å; R154-M159 PolarHBondContact NH1-SD 3.1Å; R154-D405 IonicContact CZ-OD2 2.63Å; R154-D405 IonicContact NH1-OD1 3.14Å; R154-D405 IonicContact NH1-OD2 3.93Å; R154-D405 PolarHBondContact NH1-OD2 3.17Å; R154-D405 IonicContact NH2-OD2 3.76Å; R154-D405 PolarHBondContact NH2-OD2 2.85Å
155	A	92.6	Very high	93	Very high	111 Å²	111	70.6 Å²	70.6	92%	0.917	40%	0.396	S	S	*	.	H	α-helix	trans	-62.5	-30.1	176	0	0	0	0	0	112.5	F153	F153-A155 VanDerWaalsContact C-N 3.27Å; F153-A155 PolarHBondContact O-N 2.88Å
156	L	94.6	Very high	93.2	Very high	146 Å²	146	74.7 Å²	74.7	76%	0.764	42%	0.417	S	S	*	.	H	α-helix	trans	-95.2	-39.4	-179.1	-178.3	64.9	0	0	0	112.4	F153 R154	F153-L156 PolarHBondContact O-N 3.36Å; F153-L156 VanDerWaalsContact O-N 3.1Å; R154-L156 PolarHBondContact O-N 2.87Å
157	L	92.9	Very high	93.3	Very high	78 Å²	78	73 Å²	73	41%	0.408	40%	0.404	S	S	.	.	H	α-helix	trans	-113.7	-1.7	-166.8	-58.9	176	0	0	0	114.2	V149 F153 L161	V149-L157 HydrophobicContact CG1-CB 4.14Å; V149-L157 HydrophobicContact CG1-CD1 4.49Å; V149-L157 HydrophobicContact CG2-CB 4.24Å; F153-L157 HydrophobicContact CB-CD1 4.32Å; F153-L157 PolarHBondContact O-N 3.31Å; L157-L161 HydrophobicContact CD1-CD2 4.41Å
158	G	92.7	Very high	93.4	Very high	34 Å²	34	72.5 Å²	72.5	35%	0.351	40%	0.4	S	S	.	.			trans	77.6	-176.1	-173.5	0	0	0	0	0	113.7	V149 R154	V149-G158 VanDerWaalsContact CB-O 3.29Å; V149-G158 WeakPolarHBondContact CB-O 3.28Å; R154-G158 WeakPolarHBondContact CA-O 3.41Å; R154-G158 VanDerWaalsContact O-CA 3.3Å; R154-G158 WeakPolarHBondContact O-CA 3.47Å; R154-G158 PolarHBondContact O-N 3.08Å
159	M	91.9	Very high	93.6	Very high	96 Å²	96	73.5 Å²	73.5	47%	0.473	41%	0.406	S	S	.	.	S	Bend	trans	-74.9	-40.4	178.9	-73.2	-91.2	-75.5	0	0	112.4	V149 R154	V149-M159 PolarHBondContact N-O 2.85Å; R154-M159 PolarHBondContact NH1-SD 3.1Å
160	H	94.1	Very high	93.8	Very high	118 Å²	118	76.8 Å²	76.8	55%	0.546	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.5	-177.5	-60.1	-74.2	0	0	0	108.4	V146 I147	V146-H160 HydrophobicContact CG1-CB 3.8Å; I147-H160 WeakPolarHBondContact O-CA 3.28Å
161	L	94.6	Very high	94.1	Very high	51 Å²	51	75.3 Å²	75.3	27%	0.267	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.5	177.2	179.3	65.5	0	0	0	108.8	V146 I147 V149 L157 L163	V146-L161 WeakPolarHBondContact CA-O 3.32Å; I147-L161 HydrophobicContact CG1-CB 4.11Å; I147-L161 WeakPolarHBondContact CG1-O 3.44Å; I147-L161 PolarHBondContact N-O 3.44Å; I147-L161 PolarHBondContact O-N 2.87Å; V149-L161 HydrophobicContact CG2-CB 3.73Å; L157-L161 HydrophobicContact CD1-CD2 4.41Å; L161-L163 HydrophobicContact CD2-CD2 3.77Å; L161-L163 HydrophobicContact CG-CD2 4.1Å
162	D	95.6	Very high	94.3	Very high	101 Å²	101	71.9 Å²	71.9	54%	0.54	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	116	169.9	-173.9	7.3	0	0	0	109.7	T145 V146 G164	T145-D162 WeakPolarHBondContact CB-OD1 3.14Å; T145-D162 PolarHBondContact OG1-OD1 3.02Å; V146-D162 HydrophobicContact CG2-CB 4.11Å; D162-G164 PolarHBondContact OD1-N 2.92Å
163	L	95.1	Very high	94.6	Very high	48 Å²	48	72.7 Å²	72.7	25%	0.251	39%	0.392	S	S	.	.			trans	-89.8	-14.9	179.2	-70.7	178.2	0	0	0	112.7	T145 I147 L161 I165 L166 Y167	T145-L163 PolarHBondContact O-N 3.23Å; T145-L163 VanDerWaalsContact O-N 3.13Å; I147-L163 HydrophobicContact CD1-CD1 3.73Å; I147-L163 HydrophobicContact CD1-CG 4.28Å; I147-L163 HydrophobicContact CG1-CD1 3.94Å; I147-L163 HydrophobicContact CG1-CG 4.16Å; I147-L163 HydrophobicContact CG2-CD1 3.94Å; L161-L163 HydrophobicContact CD2-CD2 3.77Å; L161-L163 HydrophobicContact CG-CD2 4.1Å; L163-I165 PolarHBondContact O-N 2.94Å; L163-L166 HydrophobicContact CB-CB 4.26Å; L163-L166 WeakPolarHBondContact O-CB 3.4Å; L163-L166 PolarHBondContact O-N 3.01Å; L163-Y167 HydrophobicContact CD1-CD2 4.17Å
164	G	95.3	Very high	94.9	Very high	25 Å²	25	67.1 Å²	67.1	26%	0.258	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	-123.6	-175	0	0	0	0	0	112.5	D162 L166 Y167	D162-G164 PolarHBondContact OD1-N 2.92Å; G164-L166 PolarHBondContact O-N 3.23Å; G164-Y167 VanDerWaalsContact O-CB 3.3Å; G164-Y167 WeakPolarHBondContact O-CB 3.47Å; G164-Y167 PolarHBondContact O-N 3.18Å
165	I	95.4	Very high	95	Very high	127 Å²	127	65 Å²	65	65%	0.651	36%	0.36	S	S	*	.	H	α-helix	trans	-58.8	-29.3	179.7	-169	61.1	0	0	0	113.7	L163 Y167 Y168 V169	L163-I165 PolarHBondContact O-N 2.94Å; I165-Y167 PolarHBondContact O-N 2.8Å; I165-Y168 WeakPolarHBondContact O-CB 3.5Å; I165-Y168 PolarHBondContact O-N 3.24Å; I165-Y168 VanDerWaalsContact O-N 3.08Å; I165-V169 PolarHBondContact O-N 3.2Å
166	L	96.6	Very high	95.2	Very high	107 Å²	107	60 Å²	60	56%	0.56	32%	0.318	S	S	*	.	H	α-helix	trans	-66.4	-25	178.5	-61.7	177.3	0	0	0	111.8	L163 G164 V169 Y170	L163-L166 HydrophobicContact CB-CB 4.26Å; L163-L166 WeakPolarHBondContact O-CB 3.4Å; L163-L166 PolarHBondContact O-N 3.01Å; G164-L166 PolarHBondContact O-N 3.23Å; L166-V169 PolarHBondContact O-N 3.33Å; L166-Y170 WeakPolarHBondContact O-CB 3.48Å; L166-Y170 PolarHBondContact O-N 3.24Å
167	Y	95.5	Very high	95.4	Very high	24 Å²	24	54.8 Å²	54.8	9%	0.094	29%	0.29	C	S	.	.	H	α-helix	trans	-66.6	-39.7	172.2	-164.6	-99.2	0	0	0	111.6	Y138 T145 I147 L163 G164 I165 Y170 M171	Y138-Y167 AromaticContact CE1-CD1 3.99Å; Y138-Y167 HydrophobicContact CE1-CD1 3.99Å; Y138-Y167 AromaticContact CE1-CE1 3.7Å; Y138-Y167 HydrophobicContact CE1-CE1 3.7Å; Y138-Y167 HydrophobicContact CE2-CE1 4.26Å; Y138-Y167 AromaticContact CZ-CE1 3.51Å; Y138-Y167 VanDerWaalsContact OH-CE1 3.29Å; Y138-Y167 WeakPolarHBondContact OH-CE1 3.48Å; T145-Y167 HydrophobicContact CG2-CD1 4.44Å; T145-Y167 HydrophobicContact CG2-CG 4.48Å; I147-Y167 HydrophobicContact CG2-CD2 3.84Å; I147-Y167 HydrophobicContact CG2-CE2 3.63Å; L163-Y167 HydrophobicContact CD1-CD2 4.17Å; G164-Y167 VanDerWaalsContact O-CB 3.3Å; G164-Y167 WeakPolarHBondContact O-CB 3.47Å; G164-Y167 PolarHBondContact O-N 3.18Å; I165-Y167 PolarHBondContact O-N 2.8Å; Y167-Y170 HydrophobicContact CD2-CD1 4.49Å; Y167-Y170 HydrophobicContact CE2-CD1 4.34Å; Y167-Y170 WeakPolarHBondContact O-CB 3.16Å; Y167-Y170 PolarHBondContact O-N 2.95Å; Y167-M171 HydrophobicContact CD1-CE 3.76Å; Y167-M171 HydrophobicContact CD1-CG 4.29Å; Y167-M171 HydrophobicContact CD1-SD 4.05Å; Y167-M171 HydrophobicContact CE1-CE 4.03Å; Y167-M171 HydrophobicContact CE1-CG 4.05Å; Y167-M171 HydrophobicContact CE1-SD 3.7Å; Y167-M171 WeakPolarHBondContact O-CG 3.39Å; Y167-M171 PolarHBondContact O-N 2.92Å
168	Y	95.6	Very high	95.6	Very high	32 Å²	32	51.1 Å²	51.1	13%	0.125	27%	0.27	C	S	.	.	H	α-helix	trans	-67.6	-39.8	174.7	-69.1	-91.3	0	0	0	112.1	L135 Y138 F139 T145 I165 Y170 M171 G172	L135-Y168 HydrophobicContact CB-CD1 4.22Å; L135-Y168 HydrophobicContact CD2-CD1 4.28Å; L135-Y168 HydrophobicContact CG-CD1 4.02Å; Y138-Y168 HydrophobicContact CD1-CE1 4.14Å; F139-Y168 WeakPolarHBondContact CA-OH 3.08Å; F139-Y168 HydrophobicContact CB-CE1 3.91Å; F139-Y168 WeakPolarHBondContact CD2-OH 3.36Å; T145-Y168 HydrophobicContact CG2-CD2 4.28Å; T145-Y168 HydrophobicContact CG2-CE2 3.6Å; I165-Y168 WeakPolarHBondContact O-CB 3.5Å; I165-Y168 PolarHBondContact O-N 3.24Å; I165-Y168 VanDerWaalsContact O-N 3.08Å; Y168-Y170 VanDerWaalsContact C-N 3.3Å; Y168-Y170 PolarHBondContact O-N 2.96Å; Y168-M171 HydrophobicContact CD1-CE 3.4Å; Y168-M171 HydrophobicContact CD2-CE 4.5Å; Y168-M171 HydrophobicContact CE1-CE 3.7Å; Y168-M171 HydrophobicContact CG-CE 3.83Å; Y168-M171 PolarHBondContact O-N 3.09Å; Y168-G172 PolarHBondContact O-N 2.81Å
169	V	96.1	Very high	95.8	Very high	79 Å²	79	49.5 Å²	49.5	48%	0.479	25%	0.254	S	S	.	.	H	α-helix	trans	-59.8	-43.9	171.7	176.8	0	0	0	0	110.4	I165 L166 M171 G172 M173	I165-V169 PolarHBondContact O-N 3.2Å; L166-V169 PolarHBondContact O-N 3.33Å; V169-M171 PolarHBondContact O-N 3.21Å; V169-G172 PolarHBondContact O-N 2.86Å; V169-M173 HydrophobicContact CG1-CG 4.24Å; V169-M173 WeakPolarHBondContact O-CB 3.41Å; V169-M173 VanDerWaalsContact O-CG 3.28Å; V169-M173 WeakPolarHBondContact O-CG 3.49Å; V169-M173 PolarHBondContact O-N 3.07Å
170	Y	95.8	Very high	96	Very high	73 Å²	73	46 Å²	46	29%	0.286	24%	0.237	S	C	.	.	H	α-helix	trans	-57.6	-47.7	174.4	161	-99.5	0	0	0	112.1	L166 Y167 Y168 G172 M173 L174 S270	L166-Y170 WeakPolarHBondContact O-CB 3.48Å; L166-Y170 PolarHBondContact O-N 3.24Å; Y167-Y170 HydrophobicContact CD2-CD1 4.49Å; Y167-Y170 HydrophobicContact CE2-CD1 4.34Å; Y167-Y170 WeakPolarHBondContact O-CB 3.16Å; Y167-Y170 PolarHBondContact O-N 2.95Å; Y168-Y170 VanDerWaalsContact C-N 3.3Å; Y168-Y170 PolarHBondContact O-N 2.96Å; Y170-G172 PolarHBondContact O-N 3.03Å; Y170-M173 CarbonylContact O-C 3.49Å; Y170-M173 PolarHBondContact O-N 2.93Å; Y170-L174 HydrophobicContact CE1-CD2 4.44Å; Y170-L174 WeakPolarHBondContact O-CB 2.83Å; Y170-L174 PolarHBondContact O-N 3.27Å; Y170-S270 WeakPolarHBondContact OH-CB 3.48Å; Y170-S270 PolarHBondContact OH-OG 2.89Å
171	M	95.3	Very high	96.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-44.3	178.6	-70.8	-172.4	-67.7	0	0	112.3	L135 Y138 Y167 Y168 V169 L174 A175 I265	L135-M171 HydrophobicContact CD1-CB 3.98Å; L135-M171 HydrophobicContact CG-CE 4.38Å; Y138-M171 HydrophobicContact CD1-CE 3.61Å; Y138-M171 HydrophobicContact CD1-SD 3.97Å; Y138-M171 HydrophobicContact CD2-SD 3.89Å; Y138-M171 HydrophobicContact CE1-CE 4.11Å; Y138-M171 HydrophobicContact CE1-SD 4.28Å; Y138-M171 HydrophobicContact CE2-SD 4.21Å; Y138-M171 HydrophobicContact CG-CE 3.88Å; Y138-M171 HydrophobicContact CG-SD 3.76Å; Y167-M171 HydrophobicContact CD1-CE 3.76Å; Y167-M171 HydrophobicContact CD1-CG 4.29Å; Y167-M171 HydrophobicContact CD1-SD 4.05Å; Y167-M171 HydrophobicContact CE1-CE 4.03Å; Y167-M171 HydrophobicContact CE1-CG 4.05Å; Y167-M171 HydrophobicContact CE1-SD 3.7Å; Y167-M171 WeakPolarHBondContact O-CG 3.39Å; Y167-M171 PolarHBondContact O-N 2.92Å; Y168-M171 HydrophobicContact CD1-CE 3.4Å; Y168-M171 HydrophobicContact CD2-CE 4.5Å; Y168-M171 HydrophobicContact CE1-CE 3.7Å; Y168-M171 HydrophobicContact CG-CE 3.83Å; Y168-M171 PolarHBondContact O-N 3.09Å; V169-M171 PolarHBondContact O-N 3.21Å; M171-L174 WeakPolarHBondContact O-CB 3.48Å; M171-L174 PolarHBondContact O-N 3.14Å; M171-A175 PolarHBondContact O-N 3.14Å; M171-I265 HydrophobicContact CB-CD1 3.78Å; M171-I265 HydrophobicContact CB-CG1 4.36Å; M171-I265 HydrophobicContact CG-CD1 4.08Å; M171-I265 HydrophobicContact CG-CG1 4.09Å; M171-I265 HydrophobicContact CG-CG2 4.15Å; M171-I265 HydrophobicContact SD-CG2 3.46Å; M171-I265 WeakPolarHBondContact SD-CG2 3.47Å
172	G	96.2	Very high	96.4	Very high	5 Å²	5	38 Å²	38	5%	0.052	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-45.3	175.2	0	0	0	0	0	112.1	Y168 V169 Y170 L174 A175 V176	Y168-G172 PolarHBondContact O-N 2.81Å; V169-G172 PolarHBondContact O-N 2.86Å; Y170-G172 PolarHBondContact O-N 3.03Å; G172-L174 VanDerWaalsContact C-N 3.29Å; G172-L174 PolarHBondContact O-N 3.23Å; G172-A175 PolarHBondContact O-N 3.42Å; G172-V176 WeakPolarHBondContact O-CG2 3.47Å; G172-V176 PolarHBondContact O-N 3.21Å; G172-V176 VanDerWaalsContact O-N 3.11Å
173	M	96.6	Very high	96.5	Very high	104 Å²	104	34.8 Å²	34.8	51%	0.512	18%	0.181	S	C	.	.	H	α-helix	trans	-67.7	-28.1	177	-70.9	-56.2	-59.5	0	0	112.9	V169 Y170 V176 F177	V169-M173 HydrophobicContact CG1-CG 4.24Å; V169-M173 WeakPolarHBondContact O-CB 3.41Å; V169-M173 VanDerWaalsContact O-CG 3.28Å; V169-M173 WeakPolarHBondContact O-CG 3.49Å; V169-M173 PolarHBondContact O-N 3.07Å; Y170-M173 CarbonylContact O-C 3.49Å; Y170-M173 PolarHBondContact O-N 2.93Å; M173-V176 PolarHBondContact O-N 3.29Å; M173-F177 VanDerWaalsContact O-CB 3.23Å; M173-F177 WeakPolarHBondContact O-CB 3.25Å; M173-F177 PolarHBondContact O-N 3.37Å
174	L	96.9	Very high	96.6	Very high	6 Å²	6	34.4 Å²	34.4	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-42.7	173.7	-177.4	63.2	0	0	0	110.8	Y170 M171 G172 F177 C178 I265 M273 L274	Y170-L174 HydrophobicContact CE1-CD2 4.44Å; Y170-L174 WeakPolarHBondContact O-CB 2.83Å; Y170-L174 PolarHBondContact O-N 3.27Å; M171-L174 WeakPolarHBondContact O-CB 3.48Å; M171-L174 PolarHBondContact O-N 3.14Å; G172-L174 VanDerWaalsContact C-N 3.29Å; G172-L174 PolarHBondContact O-N 3.23Å; L174-F177 PolarHBondContact O-N 3.38Å; L174-C178 WeakPolarHBondContact O-CB 3.37Å; L174-C178 PolarHBondContact O-N 3.27Å; L174-C178 PolarHBondContact O-SG 3.44Å; L174-I265 HydrophobicContact CD2-CD1 4.09Å; L174-I265 HydrophobicContact CD2-CG1 3.87Å; L174-M273 HydrophobicContact CD1-CE 3.76Å; L174-M273 HydrophobicContact CD2-CE 3.95Å; L174-M273 HydrophobicContact CG-CE 4.04Å; L174-L274 HydrophobicContact CD1-CD1 3.98Å; L174-L274 HydrophobicContact CD1-CD2 3.65Å; L174-L274 HydrophobicContact CD1-CG 3.87Å
175	A	95.7	Very high	96.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-46.9	173.5	0	0	0	0	0	111.6	M171 G172 F177 C178 T179 M258 A261	M171-A175 PolarHBondContact O-N 3.14Å; G172-A175 PolarHBondContact O-N 3.42Å; A175-F177 VanDerWaalsContact C-N 3.32Å; A175-F177 PolarHBondContact O-N 3.1Å; A175-C178 PolarHBondContact O-N 3.35Å; A175-T179 WeakPolarHBondContact O-CG2 3.48Å; A175-T179 PolarHBondContact O-N 2.93Å; A175-T179 PolarHBondContact O-OG1 3.01Å; A175-M258 HydrophobicContact CB-CE 3.94Å; A175-M258 HydrophobicContact CB-SD 4.19Å; A175-A261 HydrophobicContact CB-CB 3.99Å
176	V	97.4	Very high	96.8	Very high	5 Å²	5	28.6 Å²	28.6	3%	0.03	15%	0.147	C	C	.	.	H	α-helix	trans	-58.5	-43.5	175.2	176.9	0	0	0	0	111.6	L124 P127 T128 G172 M173 T179 N180	L124-V176 HydrophobicContact CD2-CG1 3.68Å; P127-V176 HydrophobicContact CB-CB 4.4Å; P127-V176 HydrophobicContact CB-CG2 3.89Å; T128-V176 VanDerWaalsContact OG1-CG2 3.28Å; T128-V176 WeakPolarHBondContact OG1-CG2 3.39Å; G172-V176 WeakPolarHBondContact O-CG2 3.47Å; G172-V176 PolarHBondContact O-N 3.21Å; G172-V176 VanDerWaalsContact O-N 3.11Å; M173-V176 PolarHBondContact O-N 3.29Å; V176-T179 PolarHBondContact O-OG1 3.25Å; V176-T179 VanDerWaalsContact O-OG1 3.11Å; V176-N180 WeakPolarHBondContact O-CB 3.45Å; V176-N180 PolarHBondContact O-N 3.49Å; V176-N180 PolarHBondContact O-ND2 2.92Å
177	F	98.1	Very high	96.7	Very high	38 Å²	38	24.8 Å²	24.8	17%	0.167	13%	0.134	C	C	.	.	H	α-helix	trans	-64.3	-51.4	179.1	173.4	-99.8	0	0	0	111	M173 L174 A175 T179 N180 A181 L274 F277 V281 F284	M173-F177 VanDerWaalsContact O-CB 3.23Å; M173-F177 WeakPolarHBondContact O-CB 3.25Å; M173-F177 PolarHBondContact O-N 3.37Å; L174-F177 PolarHBondContact O-N 3.38Å; A175-F177 VanDerWaalsContact C-N 3.32Å; A175-F177 PolarHBondContact O-N 3.1Å; F177-T179 VanDerWaalsContact C-N 3.33Å; F177-T179 PolarHBondContact O-N 3.37Å; F177-N180 PolarHBondContact O-N 3.29Å; F177-A181 HydrophobicContact CD1-CB 4.45Å; F177-A181 HydrophobicContact CD2-CB 4.24Å; F177-A181 HydrophobicContact CE1-CB 4.09Å; F177-A181 HydrophobicContact CE2-CB 3.86Å; F177-A181 HydrophobicContact CZ-CB 3.76Å; F177-A181 WeakPolarHBondContact O-CB 3.43Å; F177-A181 PolarHBondContact O-N 3.19Å; F177-L274 HydrophobicContact CD1-CD2 3.97Å; F177-L274 HydrophobicContact CE1-CD2 3.8Å; F177-F277 HydrophobicContact CE1-CD1 4.19Å; F177-V281 HydrophobicContact CE1-CG2 3.98Å; F177-V281 HydrophobicContact CZ-CB 4.35Å; F177-V281 HydrophobicContact CZ-CG2 3.53Å; F177-F284 HydrophobicContact CD2-CD1 4.42Å; F177-F284 HydrophobicContact CD2-CG 4.49Å; F177-F284 HydrophobicContact CE2-CB 4.08Å; F177-F284 AromaticContact CE2-CD1 3.89Å; F177-F284 HydrophobicContact CE2-CD1 3.89Å; F177-F284 HydrophobicContact CE2-CD2 4.42Å; F177-F284 HydrophobicContact CE2-CE1 4.43Å; F177-F284 AromaticContact CE2-CG 3.88Å; F177-F284 HydrophobicContact CE2-CG 3.88Å
178	C	98	Very high	96.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.8	-40.9	-174.6	-65.9	0	0	0	0	112.3	L174 A175 G257 F277	L174-C178 WeakPolarHBondContact O-CB 3.37Å; L174-C178 PolarHBondContact O-N 3.27Å; L174-C178 PolarHBondContact O-SG 3.44Å; A175-C178 PolarHBondContact O-N 3.35Å; C178-G257 WeakPolarHBondContact CB-O 3.08Å; C178-F277 HydrophobicContact CB-CE1 4.05Å; C178-F277 HydrophobicContact CB-CZ 4.16Å
179	T	96.3	Very high	96.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.5	-47.5	178.8	58	0	0	0	0	112	M106 A175 V176 F177 N183 Y254	M106-T179 HydrophobicContact CG-CG2 4.43Å; M106-T179 HydrophobicContact SD-CG2 4.35Å; A175-T179 WeakPolarHBondContact O-CG2 3.48Å; A175-T179 PolarHBondContact O-N 2.93Å; A175-T179 PolarHBondContact O-OG1 3.01Å; V176-T179 PolarHBondContact O-OG1 3.25Å; V176-T179 VanDerWaalsContact O-OG1 3.11Å; F177-T179 VanDerWaalsContact C-N 3.33Å; F177-T179 PolarHBondContact O-N 3.37Å; T179-N183 WeakPolarHBondContact O-CB 3.16Å; T179-N183 PolarHBondContact O-N 3.4Å; T179-Y254 WeakPolarHBondContact CG2-O 3.14Å
180	N	96.9	Very high	97	Very high	24 Å²	24	18.8 Å²	18.8	13%	0.128	10%	0.103	C	C	.	.	H	α-helix	trans	-74.3	-33.7	-177.2	-74.7	-78.1	0	0	0	112.3	K123 V176 F177 N183 I184	K123-N180 PolarHBondContact O-ND2 3.11Å; V176-N180 WeakPolarHBondContact O-CB 3.45Å; V176-N180 PolarHBondContact O-N 3.49Å; V176-N180 PolarHBondContact O-ND2 2.92Å; F177-N180 PolarHBondContact O-N 3.29Å; N180-N183 PolarHBondContact O-N 3.37Å; N180-N183 VanDerWaalsContact O-N 3.13Å; N180-I184 WeakPolarHBondContact O-CG1 3.43Å; N180-I184 WeakPolarHBondContact O-CG2 3.35Å; N180-I184 PolarHBondContact O-N 2.86Å
181	A	98.1	Very high	97.2	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.008	9%	0.09	C	C	.	.	H	α-helix	trans	-67.7	-37.7	-176.2	0	0	0	0	0	112.3	F177 L185 Q280	F177-A181 HydrophobicContact CD1-CB 4.45Å; F177-A181 HydrophobicContact CD2-CB 4.24Å; F177-A181 HydrophobicContact CE1-CB 4.09Å; F177-A181 HydrophobicContact CE2-CB 3.86Å; F177-A181 HydrophobicContact CZ-CB 3.76Å; F177-A181 WeakPolarHBondContact O-CB 3.43Å; F177-A181 PolarHBondContact O-N 3.19Å; A181-L185 PolarHBondContact O-N 3.39Å; A181-Q280 HydrophobicContact CB-CB 3.97Å
182	I	98	Very high	97.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.9	-45.6	169	-62.8	171.6	0	0	0	109.4	I184 L185 Q195 C253 A256 F260 F277	I182-I184 VanDerWaalsContact C-N 3.34Å; I182-I184 PolarHBondContact O-N 3.44Å; I182-L185 CarbonylContact O-C 3.48Å; I182-L185 PolarHBondContact O-N 3.15Å; I182-L185 VanDerWaalsContact O-N 3.11Å; I182-Q195 HydrophobicContact CG2-CG 4.43Å; I182-C253 HydrophobicContact CG2-CB 4.33Å; I182-A256 HydrophobicContact CD1-CB 3.85Å; I182-F260 HydrophobicContact CD1-CD2 4.02Å; I182-F260 HydrophobicContact CD1-CE2 3.91Å; I182-F277 HydrophobicContact CD1-CE1 4.26Å; I182-F277 HydrophobicContact CD1-CZ 4.32Å; I182-F277 HydrophobicContact CG1-CE1 4.16Å
183	N	97.3	Very high	97.4	Very high	32 Å²	32	16.3 Å²	16.3	17%	0.171	9%	0.093	C	C	.	.	H	α-helix	trans	-63.6	-33.6	-175.7	-160.8	24.6	0	0	0	114.5	T179 N180 A186 D250 C253	T179-N183 WeakPolarHBondContact O-CB 3.16Å; T179-N183 PolarHBondContact O-N 3.4Å; N180-N183 PolarHBondContact O-N 3.37Å; N180-N183 VanDerWaalsContact O-N 3.13Å; N183-A186 WeakPolarHBondContact O-CB 3.35Å; N183-D250 VanDerWaalsContact CG-OD1 3.25Å; N183-D250 PolarHBondContact ND2-OD1 2.9Å; N183-D250 PolarHBondContact OD1-OD1 2.84Å; N183-C253 HydrophobicContact CB-CB 3.77Å
184	I	97.5	Very high	97.5	Very high	40 Å²	40	11.3 Å²	11.3	21%	0.205	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-10.8	177.5	66	166.1	0	0	0	113.3	N180 I182 N283 F284 L291	N180-I184 WeakPolarHBondContact O-CG1 3.43Å; N180-I184 WeakPolarHBondContact O-CG2 3.35Å; N180-I184 PolarHBondContact O-N 2.86Å; I182-I184 VanDerWaalsContact C-N 3.34Å; I182-I184 PolarHBondContact O-N 3.44Å; I184-N283 PolarHBondContact O-ND2 3.39Å; I184-F284 HydrophobicContact CD1-CB 4.1Å; I184-F284 HydrophobicContact CD1-CD2 3.75Å; I184-F284 HydrophobicContact CD1-CG 4.42Å; I184-L291 HydrophobicContact CD1-CD1 3.95Å
185	L	98.3	Very high	97.6	Very high	3 Å²	3	11.1 Å²	11.1	2%	0.016	7%	0.067	C	C	.	.	S	Bend	trans	-101.9	63.2	172.9	-173.2	53.6	0	0	0	109	A181 I182 Q195 Q280 N283 L361 I362 M381	A181-L185 PolarHBondContact O-N 3.39Å; I182-L185 CarbonylContact O-C 3.48Å; I182-L185 PolarHBondContact O-N 3.15Å; I182-L185 VanDerWaalsContact O-N 3.11Å; L185-Q195 PolarHBondContact O-NE2 3.43Å; L185-Q280 HydrophobicContact CD2-CG 4.25Å; L185-N283 HydrophobicContact CD1-CB 4.08Å; L185-N283 HydrophobicContact CD2-CB 4.27Å; L185-L361 HydrophobicContact CD1-CB 4.1Å; L185-I362 HydrophobicContact CD1-CD1 4.38Å; L185-I362 HydrophobicContact CD1-CG1 4.09Å; L185-M381 HydrophobicContact CD1-CE 3.79Å
186	A	97.2	Very high	97.8	Very high	27 Å²	27	11.1 Å²	11.1	22%	0.223	7%	0.067	C	C	.	.			trans	-138.4	175	-166	0	0	0	0	0	112	N183 E192	N183-A186 WeakPolarHBondContact O-CB 3.35Å; A186-E192 VanDerWaalsContact CA-OE1 3.31Å; A186-E192 WeakPolarHBondContact CA-OE1 3.29Å; A186-E192 HydrophobicContact CB-CG 3.71Å; A186-E192 WeakPolarHBondContact CB-OE1 3.45Å
187	G	93.2	Very high	97.8	Very high	28 Å²	28	11.5 Å²	11.5	29%	0.289	7%	0.069	S	C	.	.			trans	98.5	16.8	168	0	0	0	0	0	116	N45 E192	N45-G187 PolarHBondContact ND2-O 2.8Å; G187-E192 PolarHBondContact N-OE1 3.4Å
188	I	98.1	Very high	97.9	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.015	8%	0.078	C	C	.	.	S	Bend	trans	-131.2	144.8	163	63.6	179.8	0	0	0	109	G190 I191 P303 L312 I362 E374 L377 T378 M381	I188-G190 PolarHBondContact O-N 2.97Å; I188-G190 VanDerWaalsContact O-N 3.16Å; I188-I191 HydrophobicContact CD1-CB 4.36Å; I188-I191 HydrophobicContact CG1-CB 3.69Å; I188-I191 HydrophobicContact CG1-CG1 4.3Å; I188-I191 HydrophobicContact CG1-CG2 3.82Å; I188-I191 VanDerWaalsContact O-CG2 3.22Å; I188-I191 WeakPolarHBondContact O-CG2 3.48Å; I188-I191 PolarHBondContact O-N 3.45Å; I188-P303 HydrophobicContact CG2-CG 3.82Å; I188-L312 HydrophobicContact CG2-CD1 3.94Å; I188-I362 HydrophobicContact CD1-CD1 4.25Å; I188-I362 HydrophobicContact CD1-CG2 4.49Å; I188-I362 HydrophobicContact CG1-CD1 4.29Å; I188-I362 HydrophobicContact CG2-CG2 4.43Å; I188-E374 WeakPolarHBondContact CA-OE1 3.25Å; I188-E374 HydrophobicContact CB-CG 4.12Å; I188-L377 HydrophobicContact CD1-CB 4.44Å; I188-L377 HydrophobicContact CD1-CD2 4.14Å; I188-L377 HydrophobicContact CD1-CG 3.88Å; I188-L377 HydrophobicContact CG2-CD2 4.33Å; I188-T378 WeakPolarHBondContact CD1-OG1 3.44Å; I188-M381 HydrophobicContact CD1-CG 4.31Å
189	N	98.5	Very high	97.9	Very high	5 Å²	5	13.5 Å²	13.5	3%	0.027	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	119.5	-172.6	-71.4	-41.1	0	0	0	113	D43 K46 Y242 S244 E374 T378	D43-N189 PolarHBondContact OD2-ND2 3.25Å; D43-N189 PolarHBondContact OD2-OD1 3.32Å; K46-N189 WeakPolarHBondContact CE-ND2 3.45Å; K46-N189 PolarHBondContact NZ-ND2 3.23Å; N189-Y242 HydrophobicContact CB-CD2 4.1Å; N189-S244 VanDerWaalsContact CB-OG 3.22Å; N189-S244 WeakPolarHBondContact CB-OG 3.28Å; N189-S244 WeakPolarHBondContact OD1-CB 3.42Å; N189-S244 PolarHBondContact OD1-OG 2.72Å; N189-E374 PolarHBondContact N-OE1 3.48Å; N189-E374 PolarHBondContact ND2-OE1 3.2Å; N189-E374 VanDerWaalsContact ND2-OE1 3.17Å; N189-E374 PolarHBondContact ND2-OE2 3.04Å; N189-T378 VanDerWaalsContact O-CG2 3.31Å; N189-T378 WeakPolarHBondContact O-CG2 3.19Å; N189-T378 PolarHBondContact O-OG1 2.86Å
190	G	98.3	Very high	98	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.7	-0.6	176.4	0	0	0	0	0	116.4	I188 G194 F237 N240	I188-G190 PolarHBondContact O-N 2.97Å; I188-G190 VanDerWaalsContact O-N 3.16Å; G190-G194 VanDerWaalsContact O-CA 3.32Å; G190-G194 WeakPolarHBondContact O-CA 3.41Å; G190-G194 PolarHBondContact O-N 2.94Å; G190-F237 WeakPolarHBondContact O-CE2 3.36Å; G190-N240 WeakPolarHBondContact CA-O 3.32Å; G190-N240 WeakPolarHBondContact CA-OD1 3.46Å; G190-N240 PolarHBondContact N-O 3.01Å; G190-N240 VanDerWaalsContact N-O 3.11Å
191	I	98.6	Very high	98.1	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-75	-39.8	-171.7	-168	53.9	0	0	0	113.4	I188 Q195 T378 M381 L382	I188-I191 HydrophobicContact CD1-CB 4.36Å; I188-I191 HydrophobicContact CG1-CB 3.69Å; I188-I191 HydrophobicContact CG1-CG1 4.3Å; I188-I191 HydrophobicContact CG1-CG2 3.82Å; I188-I191 VanDerWaalsContact O-CG2 3.22Å; I188-I191 WeakPolarHBondContact O-CG2 3.48Å; I188-I191 PolarHBondContact O-N 3.45Å; I191-Q195 WeakPolarHBondContact O-CB 3.29Å; I191-Q195 WeakPolarHBondContact O-CG 3.13Å; I191-Q195 PolarHBondContact O-N 3.27Å; I191-Q195 PolarHBondContact O-NE2 3.29Å; I191-T378 HydrophobicContact CB-CG2 4.48Å; I191-M381 HydrophobicContact CD1-CB 3.5Å; I191-M381 VanDerWaalsContact CD1-CB 3.5Å; I191-M381 HydrophobicContact CD1-CG 4.3Å; I191-L382 HydrophobicContact CD1-CD2 4.32Å
192	E	98.6	Very high	98.2	Very high	24 Å²	24	13.9 Å²	13.9	11%	0.112	9%	0.085	C	C	.	.	H	α-helix	trans	-69.8	-52.6	-175.2	-56.2	83.2	177	0	0	110.4	A186 G187 Q195 A196 V248 F252	A186-E192 VanDerWaalsContact CA-OE1 3.31Å; A186-E192 WeakPolarHBondContact CA-OE1 3.29Å; A186-E192 HydrophobicContact CB-CG 3.71Å; A186-E192 WeakPolarHBondContact CB-OE1 3.45Å; G187-E192 PolarHBondContact N-OE1 3.4Å; E192-Q195 WeakPolarHBondContact O-CG 3.47Å; E192-A196 WeakPolarHBondContact O-CB 3.1Å; E192-A196 PolarHBondContact O-N 2.87Å; E192-V248 HydrophobicContact CB-CG2 3.69Å; E192-V248 HydrophobicContact CG-CG2 4.07Å; E192-F252 HydrophobicContact CB-CD1 4.44Å; E192-F252 WeakPolarHBondContact O-CE1 3.28Å
193	S	98.7	Very high	98.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-68.9	-38.1	176.4	55.8	0	0	0	0	112.1	L197 T233 F237 N240	S193-L197 VanDerWaalsContact O-CB 3.29Å; S193-L197 WeakPolarHBondContact O-CB 3.35Å; S193-L197 PolarHBondContact O-N 2.88Å; S193-T233 WeakPolarHBondContact O-CG2 3.28Å; S193-F237 WeakPolarHBondContact OG-CD2 3.1Å; S193-N240 PolarHBondContact OG-OD1 3.21Å
194	G	98.8	Very high	98.3	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65	-49.9	179.2	0	0	0	0	0	112.9	G190 A196 L197 F198	G190-G194 VanDerWaalsContact O-CA 3.32Å; G190-G194 WeakPolarHBondContact O-CA 3.41Å; G190-G194 PolarHBondContact O-N 2.94Å; G194-A196 VanDerWaalsContact C-N 3.31Å; G194-A196 PolarHBondContact O-N 3.26Å; G194-L197 WeakPolarHBondContact O-CB 3.39Å; G194-L197 PolarHBondContact O-N 3.38Å; G194-F198 VanDerWaalsContact O-CD2 3.28Å; G194-F198 WeakPolarHBondContact O-CD2 3.44Å; G194-F198 PolarHBondContact O-N 3.18Å
195	Q	98.6	Very high	98.3	Very high	2 Å²	2	15 Å²	15	1%	0.009	9%	0.094	C	C	.	.	H	α-helix	trans	-62.6	-40.3	-179.8	75.7	-168.6	-88.5	0	0	111.4	I182 L185 I191 E192 F198 I199	I182-Q195 HydrophobicContact CG2-CG 4.43Å; L185-Q195 PolarHBondContact O-NE2 3.43Å; I191-Q195 WeakPolarHBondContact O-CB 3.29Å; I191-Q195 WeakPolarHBondContact O-CG 3.13Å; I191-Q195 PolarHBondContact O-N 3.27Å; I191-Q195 PolarHBondContact O-NE2 3.29Å; E192-Q195 WeakPolarHBondContact O-CG 3.47Å; Q195-F198 PolarHBondContact O-N 3.05Å; Q195-I199 VanDerWaalsContact O-CG1 3.25Å; Q195-I199 WeakPolarHBondContact O-CG1 3.19Å; Q195-I199 PolarHBondContact O-N 3.17Å
196	A	98.8	Very high	98.3	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.2	-38.7	175.8	0	0	0	0	0	111.9	E192 G194 I199 S200 F229 F252 A256 F260	E192-A196 WeakPolarHBondContact O-CB 3.1Å; E192-A196 PolarHBondContact O-N 2.87Å; G194-A196 VanDerWaalsContact C-N 3.31Å; G194-A196 PolarHBondContact O-N 3.26Å; A196-I199 PolarHBondContact O-N 3.06Å; A196-S200 WeakPolarHBondContact O-CB 3.3Å; A196-S200 PolarHBondContact O-N 3.38Å; A196-S200 PolarHBondContact O-OG 3.33Å; A196-S200 VanDerWaalsContact O-OG 3.06Å; A196-F229 HydrophobicContact CB-CE1 4.38Å; A196-F229 HydrophobicContact CB-CZ 4.21Å; A196-F252 HydrophobicContact CB-CE1 3.85Å; A196-F252 HydrophobicContact CB-CZ 3.76Å; A196-A256 HydrophobicContact CB-CB 4.15Å; A196-F260 HydrophobicContact CB-CE2 4.08Å; A196-F260 HydrophobicContact CB-CZ 4.19Å; A196-F260 WeakPolarHBondContact O-CZ 3.45Å
197	L	98.8	Very high	98.4	Very high	13 Å²	13	13.7 Å²	13.7	7%	0.068	8%	0.083	C	C	.	.	H	α-helix	trans	-60.2	-46.9	174.9	-172.8	69	0	0	0	111.5	S193 G194 S200 G201 F230 T233 L234 F237	S193-L197 VanDerWaalsContact O-CB 3.29Å; S193-L197 WeakPolarHBondContact O-CB 3.35Å; S193-L197 PolarHBondContact O-N 2.88Å; G194-L197 WeakPolarHBondContact O-CB 3.39Å; G194-L197 PolarHBondContact O-N 3.38Å; L197-S200 PolarHBondContact O-N 3.17Å; L197-S200 PolarHBondContact O-OG 3.03Å; L197-G201 PolarHBondContact O-N 3.27Å; L197-F230 HydrophobicContact CD1-CD1 4.37Å; L197-F230 HydrophobicContact CD1-CD2 3.55Å; L197-F230 HydrophobicContact CD1-CE1 4.34Å; L197-F230 HydrophobicContact CD1-CE2 3.51Å; L197-F230 HydrophobicContact CD1-CG 3.98Å; L197-F230 HydrophobicContact CD1-CZ 3.93Å; L197-F230 WeakPolarHBondContact CD1-O 3.01Å; L197-F230 HydrophobicContact CG-CD2 4.29Å; L197-F230 HydrophobicContact CG-CE2 3.9Å; L197-F230 HydrophobicContact CG-CZ 4.41Å; L197-T233 HydrophobicContact CB-CG2 4.14Å; L197-T233 HydrophobicContact CD1-CG2 4.29Å; L197-L234 HydrophobicContact CD1-CB 3.96Å; L197-L234 HydrophobicContact CD2-CD1 3.84Å; L197-F237 HydrophobicContact CD2-CB 4.5Å; L197-F237 HydrophobicContact CD2-CD1 4.12Å; L197-F237 HydrophobicContact CD2-CG 4.32Å
198	F	98.8	Very high	98.6	Very high	79 Å²	79	16.9 Å²	16.9	35%	0.346	9%	0.093	S	C	.	.	H	α-helix	trans	-68.2	-38	177.4	-79.1	-78.1	0	0	0	113	G194 Q195 G201 S202 L382 Q385 V386	G194-F198 VanDerWaalsContact O-CD2 3.28Å; G194-F198 WeakPolarHBondContact O-CD2 3.44Å; G194-F198 PolarHBondContact O-N 3.18Å; Q195-F198 PolarHBondContact O-N 3.05Å; F198-G201 PolarHBondContact O-N 2.93Å; F198-S202 PolarHBondContact O-N 3.32Å; F198-S202 PolarHBondContact O-OG 3.41Å; F198-S202 VanDerWaalsContact O-OG 3.07Å; F198-L382 HydrophobicContact CD2-CB 4.32Å; F198-L382 HydrophobicContact CD2-CD2 3.98Å; F198-L382 HydrophobicContact CE2-CB 4.02Å; F198-L382 HydrophobicContact CE2-CD1 4.13Å; F198-L382 HydrophobicContact CE2-CD2 4.22Å; F198-L382 HydrophobicContact CE2-CG 4.34Å; F198-Q385 HydrophobicContact CB-CG 3.83Å; F198-V386 HydrophobicContact CD1-CG2 3.38Å; F198-V386 HydrophobicContact CE1-CG2 3.48Å; F198-V386 VanDerWaalsContact CE1-CG2 3.48Å; F198-V386 HydrophobicContact CG-CG2 4.07Å; F198-V386 HydrophobicContact CZ-CG2 4.25Å
199	I	98.9	Very high	98.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.4	-48.8	174.1	-69.7	166	0	0	0	110.5	Q195 A196 G201 S202 I203 F260 F276 F277 Q385	Q195-I199 VanDerWaalsContact O-CG1 3.25Å; Q195-I199 WeakPolarHBondContact O-CG1 3.19Å; Q195-I199 PolarHBondContact O-N 3.17Å; A196-I199 PolarHBondContact O-N 3.06Å; I199-G201 VanDerWaalsContact C-N 3.34Å; I199-G201 PolarHBondContact O-N 3Å; I199-S202 WeakPolarHBondContact O-CB 3.49Å; I199-S202 PolarHBondContact O-N 2.99Å; I199-I203 HydrophobicContact CG2-CD1 3.9Å; I199-I203 WeakPolarHBondContact O-CG1 3.5Å; I199-I203 PolarHBondContact O-N 3.03Å; I199-F260 HydrophobicContact CB-CE1 4.35Å; I199-F260 HydrophobicContact CB-CE2 4.38Å; I199-F260 HydrophobicContact CB-CZ 3.96Å; I199-F260 HydrophobicContact CG2-CD1 4.04Å; I199-F260 HydrophobicContact CG2-CD2 4.39Å; I199-F260 HydrophobicContact CG2-CE1 3.71Å; I199-F260 HydrophobicContact CG2-CE2 4.05Å; I199-F260 HydrophobicContact CG2-CG 4.38Å; I199-F260 HydrophobicContact CG2-CZ 3.7Å; I199-F276 HydrophobicContact CG2-CB 4.4Å; I199-F277 HydrophobicContact CD1-CD2 4.15Å; I199-F277 HydrophobicContact CD1-CE2 4.05Å; I199-F277 HydrophobicContact CD1-CG 4.48Å; I199-F277 HydrophobicContact CD1-CZ 4.26Å; I199-F277 HydrophobicContact CG2-CD2 4.16Å; I199-F277 HydrophobicContact CG2-CE2 3.69Å; I199-Q385 HydrophobicContact CG1-CG 4.46Å; I199-Q385 VanDerWaalsContact CG1-NE2 3.3Å
200	S	98.9	Very high	98.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.9	-39.7	178.4	61.1	0	0	0	0	112.4	A196 L197 S202 I203 I204 F230	A196-S200 WeakPolarHBondContact O-CB 3.3Å; A196-S200 PolarHBondContact O-N 3.38Å; A196-S200 PolarHBondContact O-OG 3.33Å; A196-S200 VanDerWaalsContact O-OG 3.06Å; L197-S200 PolarHBondContact O-N 3.17Å; L197-S200 PolarHBondContact O-OG 3.03Å; S200-S202 PolarHBondContact O-N 2.88Å; S200-I203 PolarHBondContact O-N 2.84Å; S200-I204 VanDerWaalsContact O-CG1 3.29Å; S200-I204 WeakPolarHBondContact O-CG1 3.48Å; S200-I204 PolarHBondContact O-N 2.77Å; S200-F230 WeakPolarHBondContact OG-CD2 3.1Å
201	G	98.9	Very high	98.1	Very high	18 Å²	18	23.5 Å²	23.5	19%	0.186	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-44.3	171.9	0	0	0	0	0	112.6	L197 F198 I199 I204 V205	L197-G201 PolarHBondContact O-N 3.27Å; F198-G201 PolarHBondContact O-N 2.93Å; I199-G201 VanDerWaalsContact C-N 3.34Å; I199-G201 PolarHBondContact O-N 3Å; G201-I204 PolarHBondContact O-N 3.13Å; G201-V205 WeakPolarHBondContact O-CG2 3.39Å; G201-V205 PolarHBondContact O-N 3.28Å
202	S	98.9	Very high	97.6	Very high	15 Å²	15	28.4 Å²	28.4	11%	0.105	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-41.4	175.1	-63.4	0	0	0	0	112.5	F198 I199 S200 V205 F206 S389 F393	F198-S202 PolarHBondContact O-N 3.32Å; F198-S202 PolarHBondContact O-OG 3.41Å; F198-S202 VanDerWaalsContact O-OG 3.07Å; I199-S202 WeakPolarHBondContact O-CB 3.49Å; I199-S202 PolarHBondContact O-N 2.99Å; S200-S202 PolarHBondContact O-N 2.88Å; S202-V205 PolarHBondContact O-N 3.43Å; S202-F206 WeakPolarHBondContact O-CB 3.32Å; S202-F206 PolarHBondContact O-N 3.4Å; S202-S389 WeakPolarHBondContact OG-CB 3.49Å; S202-S389 PolarHBondContact OG-OG 3.3Å; S202-F393 WeakPolarHBondContact O-CZ 3.34Å
203	I	98.9	Very high	97	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-40.8	175.7	-64.7	167.8	0	0	0	110.8	I199 S200 F206 N207 M226 F260 F269 M273 F276	I199-I203 HydrophobicContact CG2-CD1 3.9Å; I199-I203 WeakPolarHBondContact O-CG1 3.5Å; I199-I203 PolarHBondContact O-N 3.03Å; S200-I203 PolarHBondContact O-N 2.84Å; I203-F206 PolarHBondContact O-N 3.14Å; I203-N207 WeakPolarHBondContact O-CB 3.47Å; I203-N207 PolarHBondContact O-N 2.64Å; I203-N207 PolarHBondContact O-ND2 3.27Å; I203-M226 HydrophobicContact CB-CG 4.39Å; I203-M226 HydrophobicContact CB-SD 4.13Å; I203-M226 HydrophobicContact CD1-SD 4.01Å; I203-M226 HydrophobicContact CG2-CG 3.74Å; I203-M226 HydrophobicContact CG2-SD 3.91Å; I203-F260 HydrophobicContact CD1-CD1 3.59Å; I203-F260 HydrophobicContact CD1-CE1 3.98Å; I203-F269 HydrophobicContact CG2-CE2 4.09Å; I203-F269 HydrophobicContact CG2-CZ 4.19Å; I203-M273 HydrophobicContact CD1-CG 4.19Å; I203-F276 HydrophobicContact CG1-CD2 3.78Å; I203-F276 HydrophobicContact CG1-CE2 4.15Å
204	I	98.9	Very high	96.3	Very high	28 Å²	28	35.4 Å²	35.4	14%	0.144	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-50.1	174.7	-70.6	166.4	0	0	0	110.3	S200 G201 F206 N207 L208 L223 M226 I227 F230	S200-I204 VanDerWaalsContact O-CG1 3.29Å; S200-I204 WeakPolarHBondContact O-CG1 3.48Å; S200-I204 PolarHBondContact O-N 2.77Å; G201-I204 PolarHBondContact O-N 3.13Å; I204-F206 VanDerWaalsContact C-N 3.32Å; I204-F206 PolarHBondContact O-N 2.89Å; I204-N207 PolarHBondContact O-N 3.37Å; I204-L208 HydrophobicContact CG2-CD1 3.96Å; I204-L208 HydrophobicContact CG2-CG 4.37Å; I204-L208 VanDerWaalsContact O-CG 3.28Å; I204-L208 WeakPolarHBondContact O-CG 3.36Å; I204-L208 PolarHBondContact O-N 2.93Å; I204-L223 HydrophobicContact CB-CD2 4.34Å; I204-L223 HydrophobicContact CG1-CD2 4.29Å; I204-L223 HydrophobicContact CG2-CD2 3.99Å; I204-M226 HydrophobicContact CD1-CB 4.25Å; I204-M226 HydrophobicContact CG1-CB 3.69Å; I204-I227 HydrophobicContact CD1-CG1 4.39Å; I204-F230 HydrophobicContact CD1-CB 3.78Å; I204-F230 HydrophobicContact CD1-CD2 4.28Å; I204-F230 HydrophobicContact CD1-CG 4.09Å
205	V	98.7	Very high	95.9	Very high	69 Å²	69	43 Å²	43	42%	0.418	24%	0.235	S	C	.	.	H	α-helix	trans	-59.1	-45.6	178	171.1	0	0	0	0	110.7	G201 S202 L208 L209 F393	G201-V205 WeakPolarHBondContact O-CG2 3.39Å; G201-V205 PolarHBondContact O-N 3.28Å; S202-V205 PolarHBondContact O-N 3.43Å; V205-L208 PolarHBondContact O-N 3.03Å; V205-L209 HydrophobicContact CG1-CD1 4.08Å; V205-L209 VanDerWaalsContact O-CG 3.31Å; V205-L209 WeakPolarHBondContact O-CG 3.49Å; V205-L209 PolarHBondContact O-N 3.49Å; V205-F393 HydrophobicContact CB-CZ 4.07Å; V205-F393 HydrophobicContact CG1-CE1 4.44Å; V205-F393 HydrophobicContact CG1-CE2 4.38Å; V205-F393 HydrophobicContact CG1-CZ 3.8Å
206	F	98.3	Very high	95.6	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-57.4	-50.2	176	171.8	-114.1	0	0	0	112	S202 I203 I204 L208 L209 E210 H219 F269 T272 F276 F393 R396	S202-F206 WeakPolarHBondContact O-CB 3.32Å; S202-F206 PolarHBondContact O-N 3.4Å; I203-F206 PolarHBondContact O-N 3.14Å; I204-F206 VanDerWaalsContact C-N 3.32Å; I204-F206 PolarHBondContact O-N 2.89Å; F206-L208 VanDerWaalsContact C-N 3.33Å; F206-L208 PolarHBondContact O-N 2.86Å; F206-L209 PolarHBondContact O-N 2.8Å; F206-E210 HydrophobicContact CD2-CG 3.9Å; F206-E210 HydrophobicContact CE1-CG 4.41Å; F206-E210 HydrophobicContact CE2-CG 3.43Å; F206-E210 VanDerWaalsContact CE2-CG 3.43Å; F206-E210 HydrophobicContact CZ-CG 3.73Å; F206-E210 WeakPolarHBondContact O-CG 3.45Å; F206-E210 PolarHBondContact O-N 3.49Å; F206-H219 AromaticContact CE1-CE1 3.49Å; F206-H219 VanDerWaalsContact CE1-CE1 3.49Å; F206-H219 WeakPolarHBondContact CE1-CE1 3.05Å; F206-H219 AromaticContact CZ-CE1 3.74Å; F206-F269 HydrophobicContact CD1-CD2 4.45Å; F206-F269 HydrophobicContact CD1-CG 4.46Å; F206-F269 HydrophobicContact CE1-CB 3.73Å; F206-F269 HydrophobicContact CE1-CD1 4Å; F206-F269 HydrophobicContact CE1-CD2 4.01Å; F206-F269 AromaticContact CE1-CG 3.66Å; F206-F269 HydrophobicContact CE1-CG 3.66Å; F206-F269 HydrophobicContact CZ-CB 4.17Å; F206-T272 HydrophobicContact CD1-CG2 4.42Å; F206-T272 HydrophobicContact CD2-CG2 4.2Å; F206-T272 HydrophobicContact CE1-CG2 4.19Å; F206-T272 HydrophobicContact CE2-CG2 3.97Å; F206-T272 HydrophobicContact CG-CG2 4.42Å; F206-T272 HydrophobicContact CZ-CG2 3.97Å; F206-F276 HydrophobicContact CB-CE2 4.05Å; F206-F276 HydrophobicContact CB-CZ 3.99Å; F206-F276 HydrophobicContact CG-CE2 4.31Å; F206-F276 HydrophobicContact CG-CZ 4.41Å; F206-F393 HydrophobicContact CB-CE1 3.83Å; F206-F393 HydrophobicContact CB-CZ 4.1Å; F206-F393 HydrophobicContact CD2-CE1 4.4Å; F206-R396 HydrophobicContact CE2-CG 4.22Å
207	N	98.3	Very high	95.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-43.3	178.8	-70.3	-25.9	0	0	0	112	I203 I204 L209 E210 L211 H219 S222 L223	I203-N207 WeakPolarHBondContact O-CB 3.47Å; I203-N207 PolarHBondContact O-N 2.64Å; I203-N207 PolarHBondContact O-ND2 3.27Å; I204-N207 PolarHBondContact O-N 3.37Å; N207-L209 VanDerWaalsContact C-N 3.3Å; N207-L209 PolarHBondContact O-N 3.04Å; N207-E210 CarbonylContact O-C 3.5Å; N207-E210 PolarHBondContact O-N 3.44Å; N207-L211 WeakPolarHBondContact O-CG 3.3Å; N207-L211 PolarHBondContact O-N 3.32Å; N207-H219 HydrophobicContact CB-CB 4.05Å; N207-H219 PolarHBondContact OD1-ND1 2.9Å; N207-S222 WeakPolarHBondContact ND2-CB 3.21Å; N207-S222 PolarHBondContact ND2-OG 3.4Å; N207-L223 HydrophobicContact CB-CD1 4.09Å; N207-L223 HydrophobicContact CB-CD2 3.85Å; N207-L223 HydrophobicContact CB-CG 3.7Å
208	L	97.1	Very high	95	Very high	96 Å²	96	49.3 Å²	49.3	50%	0.503	27%	0.267	S	S	.	.	H	α-helix	trans	-61	-38.3	177.8	-69.9	173.8	0	0	0	112.3	I204 V205 F206 L211 L223	I204-L208 HydrophobicContact CG2-CD1 3.96Å; I204-L208 HydrophobicContact CG2-CG 4.37Å; I204-L208 VanDerWaalsContact O-CG 3.28Å; I204-L208 WeakPolarHBondContact O-CG 3.36Å; I204-L208 PolarHBondContact O-N 2.93Å; V205-L208 PolarHBondContact O-N 3.03Å; F206-L208 VanDerWaalsContact C-N 3.33Å; F206-L208 PolarHBondContact O-N 2.86Å; L208-L211 HydrophobicContact CD2-CD1 3.91Å; L208-L223 HydrophobicContact CD2-CD1 4.09Å; L208-L223 HydrophobicContact CD2-CD2 4.49Å; L208-L223 HydrophobicContact CG-CD2 4.46Å
209	L	95.6	Very high	95	Very high	92 Å²	92	45.9 Å²	45.9	48%	0.482	25%	0.252	S	S	.	.	H	α-helix	trans	-68.7	-34.5	176.1	-68.8	172.2	0	0	0	112.4	V205 F206 N207 F393 Y397	V205-L209 HydrophobicContact CG1-CD1 4.08Å; V205-L209 VanDerWaalsContact O-CG 3.31Å; V205-L209 WeakPolarHBondContact O-CG 3.49Å; V205-L209 PolarHBondContact O-N 3.49Å; F206-L209 PolarHBondContact O-N 2.8Å; N207-L209 VanDerWaalsContact C-N 3.3Å; N207-L209 PolarHBondContact O-N 3.04Å; L209-F393 HydrophobicContact CD1-CE1 4.28Å; L209-Y397 WeakPolarHBondContact CB-OH 3.39Å; L209-Y397 HydrophobicContact CD1-CE2 3.79Å
210	E	95.1	Very high	94.9	Very high	30 Å²	30	46.2 Å²	46.2	14%	0.14	25%	0.254	C	S	.	.	H	α-helix	trans	-88.2	-2	-179.8	-54.8	-76.8	135.3	0	0	113.3	F206 N207 S212 G213 H219 R396 Y397	F206-E210 HydrophobicContact CD2-CG 3.9Å; F206-E210 HydrophobicContact CE1-CG 4.41Å; F206-E210 HydrophobicContact CE2-CG 3.43Å; F206-E210 VanDerWaalsContact CE2-CG 3.43Å; F206-E210 HydrophobicContact CZ-CG 3.73Å; F206-E210 WeakPolarHBondContact O-CG 3.45Å; F206-E210 PolarHBondContact O-N 3.49Å; N207-E210 CarbonylContact O-C 3.5Å; N207-E210 PolarHBondContact O-N 3.44Å; E210-S212 PolarHBondContact O-N 3.1Å; E210-S212 VanDerWaalsContact O-N 3.17Å; E210-G213 PolarHBondContact O-N 2.89Å; E210-H219 WeakPolarHBondContact CB-CD2 3.42Å; E210-H219 WeakPolarHBondContact CB-NE2 3.49Å; E210-R396 IonicContact OE1-NE 2.86Å; E210-R396 IonicContact OE1-NH2 3.2Å; E210-R396 IonicContact OE2-NH2 2.64Å; E210-R396 PolarHBondContact OE2-NH2 2.93Å; E210-Y397 WeakPolarHBondContact OE1-CE1 3.37Å; E210-Y397 VanDerWaalsContact OE1-CZ 3.27Å; E210-Y397 PolarHBondContact OE1-OH 3.23Å
211	L	93.1	Very high	94.8	Very high	24 Å²	24	47 Å²	47	13%	0.126	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.8	177.7	-78.7	-176.1	0	0	0	113.8	V4 N207 L208 R216 H219 V220 L223	V4-L211 HydrophobicContact CG1-CD1 4.45Å; N207-L211 WeakPolarHBondContact O-CG 3.3Å; N207-L211 PolarHBondContact O-N 3.32Å; L208-L211 HydrophobicContact CD2-CD1 3.91Å; L211-R216 HydrophobicContact CD2-CG 3.97Å; L211-R216 WeakPolarHBondContact O-CD 3.4Å; L211-R216 VanDerWaalsContact O-CG 3.27Å; L211-R216 WeakPolarHBondContact O-CG 3.26Å; L211-H219 HydrophobicContact CD2-CB 4.19Å; L211-V220 HydrophobicContact CD2-CG2 3.55Å; L211-L223 HydrophobicContact CD1-CD1 4.1Å; L211-L223 HydrophobicContact CD2-CD1 4.16Å; L211-L223 HydrophobicContact CG-CD1 4.36Å
212	S	88.4	Confident	94.8	Very high	105 Å²	105	46.1 Å²	46.1	73%	0.734	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-3	173.6	56.9	0	0	0	0	113.8	E210	E210-S212 PolarHBondContact O-N 3.1Å; E210-S212 VanDerWaalsContact O-N 3.17Å
213	G	86.5	Confident	94.8	Very high	26 Å²	26	45.4 Å²	45.4	27%	0.268	24%	0.244	S	C	.	.	S	Bend	trans	-91.9	-174.3	-177.3	0	0	0	0	0	114.3	E210 Y215	E210-G213 PolarHBondContact O-N 2.89Å; G213-Y215 PolarHBondContact O-N 3.28Å
214	D	84.1	Confident	94.8	Very high	146 Å²	146	46.3 Å²	46.3	78%	0.781	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-27.9	-173.7	-62.4	-37.1	0	0	0	113.8
215	Y	89.7	Confident	94.7	Very high	159 Å²	159	45 Å²	45	62%	0.624	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101	32.9	-176.7	-60.5	-77.4	0	0	0	112.8	G213 D217 D218 H219	G213-Y215 PolarHBondContact O-N 3.28Å; Y215-D217 VanDerWaalsContact C-N 3.3Å; Y215-D217 PolarHBondContact O-N 3.15Å; Y215-D218 WeakPolarHBondContact O-CB 3.4Å; Y215-D218 PolarHBondContact O-N 3.03Å; Y215-H219 PolarHBondContact O-CD2 2.83Å; Y215-H219 PolarHBondContact O-N 3.21Å
216	R	92.1	Very high	94.8	Very high	27 Å²	27	41.7 Å²	41.7	10%	0.102	22%	0.22	C	C	.	.	H	α-helix	trans	-55.4	-42	-172.8	177.7	-164.6	65.8	-171.1	-2.8	113.7	S2 L211 D218 H219 V220	S2-R216 PolarHBondContact O-NH1 3.37Å; S2-R216 PolarHBondContact OG-NH2 3.46Å; L211-R216 HydrophobicContact CD2-CG 3.97Å; L211-R216 WeakPolarHBondContact O-CD 3.4Å; L211-R216 VanDerWaalsContact O-CG 3.27Å; L211-R216 WeakPolarHBondContact O-CG 3.26Å; R216-D218 VanDerWaalsContact C-N 3.27Å; R216-D218 PolarHBondContact O-N 3.01Å; R216-H219 PolarHBondContact O-N 3.36Å; R216-V220 HydrophobicContact CG-CG2 4.16Å; R216-V220 WeakPolarHBondContact O-CG2 3.46Å; R216-V220 PolarHBondContact O-N 3.36Å
217	D	92.4	Very high	94.8	Very high	94 Å²	94	42.3 Å²	42.3	50%	0.503	22%	0.223	S	C	.	.	H	α-helix	trans	-65.4	-34.5	-172.9	-58.4	-20.3	0	0	0	111	Y215 H219 V220 F221	Y215-D217 VanDerWaalsContact C-N 3.3Å; Y215-D217 PolarHBondContact O-N 3.15Å; D217-H219 PolarHBondContact O-N 3.47Å; D217-V220 PolarHBondContact O-N 3.29Å; D217-F221 WeakPolarHBondContact O-CB 3.38Å; D217-F221 PolarHBondContact O-N 3.16Å
218	D	94.6	Very high	94.8	Very high	26 Å²	26	42.3 Å²	42.3	14%	0.139	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-41.4	171.1	-69.1	9.1	0	0	0	112.1	Y215 R216 F221 S222 H268	Y215-D218 WeakPolarHBondContact O-CB 3.4Å; Y215-D218 PolarHBondContact O-N 3.03Å; R216-D218 VanDerWaalsContact C-N 3.27Å; R216-D218 PolarHBondContact O-N 3.01Å; D218-F221 PolarHBondContact O-N 3.11Å; D218-S222 PolarHBondContact O-N 3.4Å; D218-H268 IonicContact OD2-CE1 3.88Å; D218-H268 IonicContact OD2-CG 3.68Å; D218-H268 IonicContact OD2-ND1 3.86Å; D218-H268 PolarHBondContact OD2-ND1 3.04Å
219	H	97.1	Very high	94.9	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-72.7	-36.2	178.3	-67.9	-63.2	0	0	0	112.6	F206 N207 E210 L211 Y215 R216 D217 S222 L223 F269	F206-H219 AromaticContact CE1-CE1 3.49Å; F206-H219 VanDerWaalsContact CE1-CE1 3.49Å; F206-H219 WeakPolarHBondContact CE1-CE1 3.05Å; F206-H219 AromaticContact CZ-CE1 3.74Å; N207-H219 HydrophobicContact CB-CB 4.05Å; N207-H219 PolarHBondContact OD1-ND1 2.9Å; E210-H219 WeakPolarHBondContact CB-CD2 3.42Å; E210-H219 WeakPolarHBondContact CB-NE2 3.49Å; L211-H219 HydrophobicContact CD2-CB 4.19Å; Y215-H219 PolarHBondContact O-CD2 2.83Å; Y215-H219 PolarHBondContact O-N 3.21Å; R216-H219 PolarHBondContact O-N 3.36Å; D217-H219 PolarHBondContact O-N 3.47Å; H219-S222 PolarHBondContact O-N 3.23Å; H219-L223 VanDerWaalsContact O-CG 3.31Å; H219-L223 WeakPolarHBondContact O-CG 3.46Å; H219-L223 PolarHBondContact O-N 3.39Å; H219-F269 AromaticContact CE1-CD1 3.88Å
220	V	97	Very high	95.1	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-63.1	-47.1	171.3	170.3	0	0	0	0	110.3	P5 L211 R216 D217 S222 L223 Y224	P5-V220 HydrophobicContact CG-CB 4.46Å; P5-V220 HydrophobicContact CG-CG1 3.61Å; P5-V220 HydrophobicContact CG-CG2 4.04Å; L211-V220 HydrophobicContact CD2-CG2 3.55Å; R216-V220 HydrophobicContact CG-CG2 4.16Å; R216-V220 WeakPolarHBondContact O-CG2 3.46Å; R216-V220 PolarHBondContact O-N 3.36Å; D217-V220 PolarHBondContact O-N 3.29Å; V220-S222 VanDerWaalsContact C-N 3.31Å; V220-S222 PolarHBondContact O-N 2.83Å; V220-L223 WeakPolarHBondContact O-CB 3.37Å; V220-L223 PolarHBondContact O-N 3.47Å; V220-L223 VanDerWaalsContact O-N 3.14Å; V220-Y224 HydrophobicContact CG1-CE1 3.79Å; V220-Y224 HydrophobicContact CG1-CE2 3.81Å; V220-Y224 WeakPolarHBondContact CG1-OH 3.37Å; V220-Y224 PolarHBondContact O-N 2.82Å; V220-Y224 VanDerWaalsContact O-N 3.1Å
221	F	97.1	Very high	95.2	Very high	15 Å²	15	37.3 Å²	37.3	7%	0.066	19%	0.194	C	C	.	.	H	α-helix	trans	-54.3	-49.1	174.4	171.4	-91.3	0	0	0	110.8	Q95 A99 D217 D218 L223 Y224 F225 L266	Q95-F221 HydrophobicContact CB-CE2 3.95Å; A99-F221 HydrophobicContact CB-CZ 3.96Å; D217-F221 WeakPolarHBondContact O-CB 3.38Å; D217-F221 PolarHBondContact O-N 3.16Å; D218-F221 PolarHBondContact O-N 3.11Å; F221-L223 VanDerWaalsContact C-N 3.34Å; F221-L223 PolarHBondContact O-N 3.18Å; F221-Y224 WeakPolarHBondContact O-CB 3.35Å; F221-Y224 PolarHBondContact O-N 3.29Å; F221-F225 HydrophobicContact CD2-CE2 4.15Å; F221-F225 HydrophobicContact CE1-CD2 4.21Å; F221-F225 AromaticContact CE1-CE2 3.97Å; F221-F225 HydrophobicContact CE1-CE2 3.97Å; F221-F225 HydrophobicContact CE2-CD2 4.41Å; F221-F225 AromaticContact CE2-CE2 3.52Å; F221-F225 HydrophobicContact CE2-CE2 3.52Å; F221-F225 HydrophobicContact CE2-CZ 4.25Å; F221-F225 HydrophobicContact CZ-CD2 4.09Å; F221-F225 AromaticContact CZ-CE2 3.39Å; F221-F225 HydrophobicContact CZ-CE2 3.39Å; F221-F225 HydrophobicContact CZ-CZ 4.06Å; F221-F225 WeakPolarHBondContact O-CD2 3.34Å; F221-L266 HydrophobicContact CD1-CB 4.26Å; F221-L266 HydrophobicContact CE1-CB 3.63Å; F221-L266 HydrophobicContact CE1-CD1 3.93Å; F221-L266 HydrophobicContact CE1-CG 4.41Å; F221-L266 HydrophobicContact CZ-CB 4.1Å; F221-L266 HydrophobicContact CZ-CD1 3.57Å; F221-L266 HydrophobicContact CZ-CG 4.48Å
222	S	98.6	Very high	95.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-41.4	177.8	178.3	0	0	0	0	112.8	N207 D218 H219 V220 Y224 F225 M226 V263 F269	N207-S222 WeakPolarHBondContact ND2-CB 3.21Å; N207-S222 PolarHBondContact ND2-OG 3.4Å; D218-S222 PolarHBondContact O-N 3.4Å; H219-S222 PolarHBondContact O-N 3.23Å; V220-S222 VanDerWaalsContact C-N 3.31Å; V220-S222 PolarHBondContact O-N 2.83Å; S222-Y224 VanDerWaalsContact C-N 3.28Å; S222-Y224 PolarHBondContact O-N 3.13Å; S222-F225 PolarHBondContact O-N 2.96Å; S222-F225 VanDerWaalsContact O-N 3.16Å; S222-M226 WeakPolarHBondContact O-CB 3.4Å; S222-M226 VanDerWaalsContact O-CG 3.31Å; S222-M226 WeakPolarHBondContact O-CG 3.26Å; S222-M226 PolarHBondContact O-N 2.96Å; S222-V263 WeakPolarHBondContact OG-CB 3.47Å; S222-F269 WeakPolarHBondContact OG-CZ 3.37Å
223	L	98.7	Very high	96	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-60.9	-35.1	177.3	-75.3	167.9	0	0	0	112.6	L9 I204 N207 L208 L211 H219 V220 F221 F225 M226 I227	L9-L223 HydrophobicContact CD1-CD1 4.42Å; L9-L223 HydrophobicContact CD2-CB 3.77Å; L9-L223 HydrophobicContact CD2-CD1 4.15Å; I204-L223 HydrophobicContact CB-CD2 4.34Å; I204-L223 HydrophobicContact CG1-CD2 4.29Å; I204-L223 HydrophobicContact CG2-CD2 3.99Å; N207-L223 HydrophobicContact CB-CD1 4.09Å; N207-L223 HydrophobicContact CB-CD2 3.85Å; N207-L223 HydrophobicContact CB-CG 3.7Å; L208-L223 HydrophobicContact CD2-CD1 4.09Å; L208-L223 HydrophobicContact CD2-CD2 4.49Å; L208-L223 HydrophobicContact CG-CD2 4.46Å; L211-L223 HydrophobicContact CD1-CD1 4.1Å; L211-L223 HydrophobicContact CD2-CD1 4.16Å; L211-L223 HydrophobicContact CG-CD1 4.36Å; H219-L223 VanDerWaalsContact O-CG 3.31Å; H219-L223 WeakPolarHBondContact O-CG 3.46Å; H219-L223 PolarHBondContact O-N 3.39Å; V220-L223 WeakPolarHBondContact O-CB 3.37Å; V220-L223 PolarHBondContact O-N 3.47Å; V220-L223 VanDerWaalsContact O-N 3.14Å; F221-L223 VanDerWaalsContact C-N 3.34Å; F221-L223 PolarHBondContact O-N 3.18Å; L223-F225 PolarHBondContact O-N 3.28Å; L223-M226 PolarHBondContact O-N 3.17Å; L223-I227 HydrophobicContact CB-CD1 4.11Å; L223-I227 HydrophobicContact CD2-CD1 4.22Å; L223-I227 HydrophobicContact CD2-CG1 4.3Å; L223-I227 WeakPolarHBondContact O-CB 3.3Å; L223-I227 VanDerWaalsContact O-CG1 3.31Å; L223-I227 WeakPolarHBondContact O-CG1 3.35Å; L223-I227 PolarHBondContact O-N 3.06Å; L223-I227 VanDerWaalsContact O-N 3.08Å
224	Y	98.6	Very high	96.6	Very high	18 Å²	18	33 Å²	33	7%	0.071	16%	0.156	C	C	.	.	H	α-helix	trans	-57.9	-33.6	176.4	-64.1	-26.4	0	0	0	112.9	P8 L9 L68 F71 P75 V220 F221 S222 P228	P8-Y224 HydrophobicContact CB-CE1 3.84Å; P8-Y224 WeakPolarHBondContact CB-OH 3.47Å; L9-Y224 HydrophobicContact CD2-CD1 3.97Å; L9-Y224 HydrophobicContact CD2-CE1 3.81Å; L9-Y224 HydrophobicContact CG-CE1 4.35Å; L68-Y224 WeakPolarHBondContact CD2-O 3.36Å; F71-Y224 AromaticContact CE1-CD1 3.53Å; F71-Y224 HydrophobicContact CE1-CD1 3.53Å; F71-Y224 HydrophobicContact CE1-CD2 4.08Å; F71-Y224 AromaticContact CE1-CE1 3.98Å; F71-Y224 HydrophobicContact CE1-CE1 3.98Å; F71-Y224 HydrophobicContact CE1-CE2 4.48Å; F71-Y224 AromaticContact CE1-CG 3.59Å; F71-Y224 HydrophobicContact CE1-CG 3.59Å; F71-Y224 AromaticContact CZ-CD1 3.57Å; F71-Y224 HydrophobicContact CZ-CD1 3.57Å; F71-Y224 AromaticContact CZ-CE1 3.71Å; F71-Y224 HydrophobicContact CZ-CE1 3.71Å; F71-Y224 HydrophobicContact CZ-CG 4.14Å; P75-Y224 HydrophobicContact CB-CE2 4.01Å; P75-Y224 HydrophobicContact CG-CD2 4.2Å; P75-Y224 HydrophobicContact CG-CE2 3.65Å; V220-Y224 HydrophobicContact CG1-CE1 3.79Å; V220-Y224 HydrophobicContact CG1-CE2 3.81Å; V220-Y224 WeakPolarHBondContact CG1-OH 3.37Å; V220-Y224 PolarHBondContact O-N 2.82Å; V220-Y224 VanDerWaalsContact O-N 3.1Å; F221-Y224 WeakPolarHBondContact O-CB 3.35Å; F221-Y224 PolarHBondContact O-N 3.29Å; S222-Y224 VanDerWaalsContact C-N 3.28Å; S222-Y224 PolarHBondContact O-N 3.13Å; Y224-P228 WeakPolarHBondContact O-CD 3.23Å; Y224-P228 VanDerWaalsContact O-CG 3.29Å; Y224-P228 WeakPolarHBondContact O-CG 3.49Å
225	F	98.8	Very high	97.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-90.6	-41.7	176.3	-68.6	-95.5	0	0	0	112.6	F64 L68 L96 A99 L100 I103 F221 S222 L223 I227 P228 F229 T259 V263	F64-F225 WeakPolarHBondContact CE2-O 3.25Å; F64-F225 HydrophobicContact CZ-CD1 4.09Å; L68-F225 HydrophobicContact CD1-CD1 3.58Å; L68-F225 HydrophobicContact CD1-CE1 3.78Å; L68-F225 HydrophobicContact CD1-CG 4.41Å; L96-F225 HydrophobicContact CD1-CE2 3.64Å; L96-F225 HydrophobicContact CD1-CZ 3.61Å; A99-F225 HydrophobicContact CB-CE1 3.82Å; A99-F225 HydrophobicContact CB-CE2 4.19Å; A99-F225 HydrophobicContact CB-CZ 3.42Å; A99-F225 VanDerWaalsContact CB-CZ 3.42Å; L100-F225 HydrophobicContact CD2-CE1 4.2Å; L100-F225 HydrophobicContact CG-CE1 4.04Å; L100-F225 HydrophobicContact CG-CZ 4.43Å; I103-F225 HydrophobicContact CD1-CD1 3.67Å; I103-F225 HydrophobicContact CD1-CE1 3.86Å; F221-F225 HydrophobicContact CD2-CE2 4.15Å; F221-F225 HydrophobicContact CE1-CD2 4.21Å; F221-F225 AromaticContact CE1-CE2 3.97Å; F221-F225 HydrophobicContact CE1-CE2 3.97Å; F221-F225 HydrophobicContact CE2-CD2 4.41Å; F221-F225 AromaticContact CE2-CE2 3.52Å; F221-F225 HydrophobicContact CE2-CE2 3.52Å; F221-F225 HydrophobicContact CE2-CZ 4.25Å; F221-F225 HydrophobicContact CZ-CD2 4.09Å; F221-F225 AromaticContact CZ-CE2 3.39Å; F221-F225 HydrophobicContact CZ-CE2 3.39Å; F221-F225 HydrophobicContact CZ-CZ 4.06Å; F221-F225 WeakPolarHBondContact O-CD2 3.34Å; S222-F225 PolarHBondContact O-N 2.96Å; S222-F225 VanDerWaalsContact O-N 3.16Å; L223-F225 PolarHBondContact O-N 3.28Å; F225-I227 PolarHBondContact O-N 2.85Å; F225-P228 WeakPolarHBondContact O-CD 3.19Å; F225-F229 VanDerWaalsContact O-CB 3.25Å; F225-F229 WeakPolarHBondContact O-CB 3.43Å; F225-F229 PolarHBondContact O-N 3.45Å; F225-F229 VanDerWaalsContact O-N 3.09Å; F225-T259 HydrophobicContact CB-CG2 4.48Å; F225-V263 HydrophobicContact CB-CG1 3.73Å; F225-V263 HydrophobicContact CD2-CG1 4.41Å; F225-V263 HydrophobicContact CG-CG1 4.24Å
226	M	98.9	Very high	97.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-68.7	-35	-173.2	-69	-69.2	95.8	0	0	113.1	I203 I204 S222 L223 F229 F230 T259 F260 V263	I203-M226 HydrophobicContact CB-CG 4.39Å; I203-M226 HydrophobicContact CB-SD 4.13Å; I203-M226 HydrophobicContact CD1-SD 4.01Å; I203-M226 HydrophobicContact CG2-CG 3.74Å; I203-M226 HydrophobicContact CG2-SD 3.91Å; I204-M226 HydrophobicContact CD1-CB 4.25Å; I204-M226 HydrophobicContact CG1-CB 3.69Å; S222-M226 WeakPolarHBondContact O-CB 3.4Å; S222-M226 VanDerWaalsContact O-CG 3.31Å; S222-M226 WeakPolarHBondContact O-CG 3.26Å; S222-M226 PolarHBondContact O-N 2.96Å; L223-M226 PolarHBondContact O-N 3.17Å; M226-F229 HydrophobicContact CE-CB 4.46Å; M226-F229 PolarHBondContact O-N 3.09Å; M226-F230 VanDerWaalsContact O-CB 3.29Å; M226-F230 WeakPolarHBondContact O-CB 3.21Å; M226-F230 PolarHBondContact O-N 2.89Å; M226-T259 HydrophobicContact CE-CG2 3.43Å; M226-T259 VanDerWaalsContact CE-CG2 3.43Å; M226-F260 HydrophobicContact CE-CD1 4.06Å; M226-F260 HydrophobicContact CE-CE1 4.28Å; M226-F260 HydrophobicContact SD-CD1 4Å; M226-F260 HydrophobicContact SD-CE1 3.99Å; M226-V263 HydrophobicContact CE-CB 4.45Å; M226-V263 HydrophobicContact CE-CG1 3.85Å; M226-V263 HydrophobicContact CE-CG2 3.73Å; M226-V263 HydrophobicContact CG-CG1 4.37Å; M226-V263 HydrophobicContact CG-CG2 4.27Å; M226-V263 HydrophobicContact SD-CG2 3.94Å
227	I	98.9	Very high	98.1	Very high	14 Å²	14	18.9 Å²	18.9	7%	0.072	9%	0.092	C	C	.	.	H	α-helix	trans	-65.5	-54.9	179.8	-63.4	166.3	0	0	0	110.6	L9 I204 L223 F225 F229 F230 F231	L9-I227 HydrophobicContact CD2-CD1 4.42Å; I204-I227 HydrophobicContact CD1-CG1 4.39Å; L223-I227 HydrophobicContact CB-CD1 4.11Å; L223-I227 HydrophobicContact CD2-CD1 4.22Å; L223-I227 HydrophobicContact CD2-CG1 4.3Å; L223-I227 WeakPolarHBondContact O-CB 3.3Å; L223-I227 VanDerWaalsContact O-CG1 3.31Å; L223-I227 WeakPolarHBondContact O-CG1 3.35Å; L223-I227 PolarHBondContact O-N 3.06Å; L223-I227 VanDerWaalsContact O-N 3.08Å; F225-I227 PolarHBondContact O-N 2.85Å; I227-F229 VanDerWaalsContact C-N 3.3Å; I227-F229 PolarHBondContact O-N 3.28Å; I227-F230 PolarHBondContact O-N 2.95Å; I227-F231 HydrophobicContact CG2-CD2 3.98Å; I227-F231 HydrophobicContact CG2-CE2 4.03Å; I227-F231 WeakPolarHBondContact O-CD2 3.31Å; I227-F231 PolarHBondContact O-N 3.28Å; I227-F231 VanDerWaalsContact O-N 3.15Å
228	P	98.9	Very high	98.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-57.2	-41.6	173.8	-25.2	33.1	0	0	0	113.1	S16 F64 I67 L68 Y224 F225 F230 F231 T232	S16-P228 VanDerWaalsContact OG-CA 3.23Å; S16-P228 WeakPolarHBondContact OG-CA 3.35Å; S16-P228 WeakPolarHBondContact OG-CD 3.29Å; S16-P228 WeakPolarHBondContact OG-CG 3.48Å; F64-P228 HydrophobicContact CD2-CB 3.75Å; F64-P228 HydrophobicContact CE2-CB 3.97Å; I67-P228 HydrophobicContact CD1-CB 4.41Å; I67-P228 HydrophobicContact CG2-CB 4Å; I67-P228 HydrophobicContact CG2-CG 3.96Å; L68-P228 HydrophobicContact CD2-CG 3.97Å; Y224-P228 WeakPolarHBondContact O-CD 3.23Å; Y224-P228 VanDerWaalsContact O-CG 3.29Å; Y224-P228 WeakPolarHBondContact O-CG 3.49Å; F225-P228 WeakPolarHBondContact O-CD 3.19Å; P228-F230 PolarHBondContact O-N 3.24Å; P228-F231 PolarHBondContact O-N 3.45Å; P228-T232 WeakPolarHBondContact O-CG2 3.47Å; P228-T232 PolarHBondContact O-N 2.64Å; P228-T232 PolarHBondContact O-OG1 3.45Å; P228-T232 VanDerWaalsContact O-OG1 3.05Å
229	F	98.9	Very high	98.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.6	-46.1	178.4	178.5	-90.4	0	0	0	111.9	F64 A196 F225 M226 I227 T232 T233 F252 F255 A256 T259 F260	F64-F229 HydrophobicContact CD2-CB 4.21Å; F64-F229 HydrophobicContact CE2-CB 3.83Å; A196-F229 HydrophobicContact CB-CE1 4.38Å; A196-F229 HydrophobicContact CB-CZ 4.21Å; F225-F229 VanDerWaalsContact O-CB 3.25Å; F225-F229 WeakPolarHBondContact O-CB 3.43Å; F225-F229 PolarHBondContact O-N 3.45Å; F225-F229 VanDerWaalsContact O-N 3.09Å; M226-F229 HydrophobicContact CE-CB 4.46Å; M226-F229 PolarHBondContact O-N 3.09Å; I227-F229 VanDerWaalsContact C-N 3.3Å; I227-F229 PolarHBondContact O-N 3.28Å; F229-T232 PolarHBondContact O-OG1 3.47Å; F229-T233 WeakPolarHBondContact O-CB 3.45Å; F229-T233 PolarHBondContact O-N 3.3Å; F229-T233 PolarHBondContact O-OG1 3.25Å; F229-F252 HydrophobicContact CZ-CE2 4.48Å; F229-F252 HydrophobicContact CZ-CZ 4.29Å; F229-F255 AromaticContact CD2-CE1 3.83Å; F229-F255 HydrophobicContact CD2-CE1 3.83Å; F229-F255 AromaticContact CD2-CE2 3.88Å; F229-F255 HydrophobicContact CD2-CE2 3.88Å; F229-F255 AromaticContact CD2-CZ 3.42Å; F229-F255 HydrophobicContact CD2-CZ 3.42Å; F229-F255 VanDerWaalsContact CD2-CZ 3.42Å; F229-F255 HydrophobicContact CE2-CD1 4.12Å; F229-F255 AromaticContact CE2-CE1 3.72Å; F229-F255 HydrophobicContact CE2-CE1 3.72Å; F229-F255 HydrophobicContact CE2-CE2 4.18Å; F229-F255 AromaticContact CE2-CZ 3.76Å; F229-F255 HydrophobicContact CE2-CZ 3.76Å; F229-A256 HydrophobicContact CE2-CB 3.95Å; F229-A256 HydrophobicContact CZ-CB 3.63Å; F229-T259 HydrophobicContact CB-CG2 4.27Å; F229-T259 HydrophobicContact CD2-CG2 3.9Å; F229-T259 HydrophobicContact CG-CG2 4.18Å; F229-F260 HydrophobicContact CD1-CE1 4.33Å; F229-F260 HydrophobicContact CD1-CZ 4.35Å; F229-F260 AromaticContact CE1-CE1 3.93Å; F229-F260 HydrophobicContact CE1-CE1 3.93Å; F229-F260 HydrophobicContact CE1-CE2 4.32Å; F229-F260 AromaticContact CE1-CZ 3.52Å; F229-F260 HydrophobicContact CE1-CZ 3.52Å; F229-F260 HydrophobicContact CZ-CE2 4.29Å; F229-F260 AromaticContact CZ-CZ 3.92Å; F229-F260 HydrophobicContact CZ-CZ 3.92Å
230	F	98.9	Very high	98.6	Very high	53 Å²	53	21.8 Å²	21.8	23%	0.232	10%	0.096	C	C	.	.	H	α-helix	trans	-60.4	-48	178.9	179.1	-87.5	0	0	0	111.2	L197 S200 I204 M226 I227 P228 T233 L234	L197-F230 HydrophobicContact CD1-CD1 4.37Å; L197-F230 HydrophobicContact CD1-CD2 3.55Å; L197-F230 HydrophobicContact CD1-CE1 4.34Å; L197-F230 HydrophobicContact CD1-CE2 3.51Å; L197-F230 HydrophobicContact CD1-CG 3.98Å; L197-F230 HydrophobicContact CD1-CZ 3.93Å; L197-F230 WeakPolarHBondContact CD1-O 3.01Å; L197-F230 HydrophobicContact CG-CD2 4.29Å; L197-F230 HydrophobicContact CG-CE2 3.9Å; L197-F230 HydrophobicContact CG-CZ 4.41Å; S200-F230 WeakPolarHBondContact OG-CD2 3.1Å; I204-F230 HydrophobicContact CD1-CB 3.78Å; I204-F230 HydrophobicContact CD1-CD2 4.28Å; I204-F230 HydrophobicContact CD1-CG 4.09Å; M226-F230 VanDerWaalsContact O-CB 3.29Å; M226-F230 WeakPolarHBondContact O-CB 3.21Å; M226-F230 PolarHBondContact O-N 2.89Å; I227-F230 PolarHBondContact O-N 2.95Å; P228-F230 PolarHBondContact O-N 3.24Å; F230-T233 PolarHBondContact O-N 3.47Å; F230-L234 HydrophobicContact CE1-CD2 4.33Å; F230-L234 VanDerWaalsContact O-CB 3.27Å; F230-L234 WeakPolarHBondContact O-CB 3.45Å; F230-L234 PolarHBondContact O-N 3.2Å
231	F	98.9	Very high	98.7	Very high	61 Å²	61	24.9 Å²	24.9	27%	0.268	11%	0.107	S	C	.	.	H	α-helix	trans	-71	-38.9	-176.2	-86.3	-80	0	0	0	113.8	S16 C20 I227 P228 L234 A235	S16-F231 WeakPolarHBondContact O-CB 3.48Å; C20-F231 HydrophobicContact CB-CB 4.09Å; C20-F231 HydrophobicContact CB-CD1 3.95Å; C20-F231 PolarHBondContact SG-O 2.93Å; I227-F231 HydrophobicContact CG2-CD2 3.98Å; I227-F231 HydrophobicContact CG2-CE2 4.03Å; I227-F231 WeakPolarHBondContact O-CD2 3.31Å; I227-F231 PolarHBondContact O-N 3.28Å; I227-F231 VanDerWaalsContact O-N 3.15Å; P228-F231 PolarHBondContact O-N 3.45Å; F231-L234 PolarHBondContact O-N 3.5Å; F231-A235 PolarHBondContact O-N 2.93Å
232	T	98.9	Very high	98.8	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-71.2	-35.8	174.8	59.1	0	0	0	0	111.4	V63 F64 I67 P228 F229 A235 L236	V63-T232 HydrophobicContact CB-CG2 4.36Å; V63-T232 HydrophobicContact CG1-CG2 3.92Å; F64-T232 HydrophobicContact CB-CG2 4.24Å; I67-T232 HydrophobicContact CD1-CG2 3.88Å; P228-T232 WeakPolarHBondContact O-CG2 3.47Å; P228-T232 PolarHBondContact O-N 2.64Å; P228-T232 PolarHBondContact O-OG1 3.45Å; P228-T232 VanDerWaalsContact O-OG1 3.05Å; F229-T232 PolarHBondContact O-OG1 3.47Å; T232-A235 PolarHBondContact O-N 3.48Å; T232-L236 PolarHBondContact O-N 3Å; T232-L236 VanDerWaalsContact O-N 3.11Å
233	T	98.9	Very high	98.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.1	-37.5	173.6	-58.9	0	0	0	0	111.8	S193 L197 F229 F230 A235 L236 F237 F252	S193-T233 WeakPolarHBondContact O-CG2 3.28Å; L197-T233 HydrophobicContact CB-CG2 4.14Å; L197-T233 HydrophobicContact CD1-CG2 4.29Å; F229-T233 WeakPolarHBondContact O-CB 3.45Å; F229-T233 PolarHBondContact O-N 3.3Å; F229-T233 PolarHBondContact O-OG1 3.25Å; F230-T233 PolarHBondContact O-N 3.47Å; T233-A235 VanDerWaalsContact C-N 3.29Å; T233-A235 PolarHBondContact O-N 2.89Å; T233-L236 PolarHBondContact O-N 2.82Å; T233-F237 VanDerWaalsContact O-CB 3.29Å; T233-F237 WeakPolarHBondContact O-CB 3.5Å; T233-F237 PolarHBondContact O-N 3.48Å; T233-F252 HydrophobicContact CG2-CE2 3.87Å; T233-F252 HydrophobicContact CG2-CZ 3.57Å
234	L	98.9	Very high	98.7	Very high	64 Å²	64	31.5 Å²	31.5	34%	0.335	14%	0.144	S	C	.	.	H	α-helix	trans	-59.2	-42.3	175.9	178.9	63.4	0	0	0	111.3	L197 F230 F231 F237 Y238	L197-L234 HydrophobicContact CD1-CB 3.96Å; L197-L234 HydrophobicContact CD2-CD1 3.84Å; F230-L234 HydrophobicContact CE1-CD2 4.33Å; F230-L234 VanDerWaalsContact O-CB 3.27Å; F230-L234 WeakPolarHBondContact O-CB 3.45Å; F230-L234 PolarHBondContact O-N 3.2Å; F231-L234 PolarHBondContact O-N 3.5Å; L234-F237 PolarHBondContact O-N 3.34Å; L234-Y238 PolarHBondContact O-N 2.86Å
235	A	98.8	Very high	98.6	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-66.8	-39.3	175.4	0	0	0	0	0	112.9	C20 T23 L24 F231 T232 T233 Y238 H239	C20-A235 WeakPolarHBondContact O-CB 3.49Å; T23-A235 HydrophobicContact CG2-CB 3.57Å; L24-A235 HydrophobicContact CD2-CB 3.98Å; L24-A235 HydrophobicContact CG-CB 3.71Å; F231-A235 PolarHBondContact O-N 2.93Å; T232-A235 PolarHBondContact O-N 3.48Å; T233-A235 VanDerWaalsContact C-N 3.29Å; T233-A235 PolarHBondContact O-N 2.89Å; A235-Y238 WeakPolarHBondContact O-CB 3.35Å; A235-Y238 PolarHBondContact O-N 3.09Å; A235-H239 PolarHBondContact O-CD2 3.08Å
236	L	98.9	Very high	98.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.5	-45.3	173.7	178.6	62.7	0	0	0	111.4	I27 Q56 T232 T233 Y238 H239 N240 V246 V248 F252	I27-L236 HydrophobicContact CD1-CB 4.31Å; I27-L236 HydrophobicContact CD1-CD1 3.78Å; Q56-L236 HydrophobicContact CB-CD1 3.85Å; T232-L236 PolarHBondContact O-N 3Å; T232-L236 VanDerWaalsContact O-N 3.11Å; T233-L236 PolarHBondContact O-N 2.82Å; L236-Y238 VanDerWaalsContact C-N 3.26Å; L236-Y238 PolarHBondContact O-N 3.46Å; L236-H239 PolarHBondContact O-N 3.17Å; L236-H239 VanDerWaalsContact O-N 3.13Å; L236-N240 VanDerWaalsContact O-CB 3.26Å; L236-N240 WeakPolarHBondContact O-CB 3.45Å; L236-N240 PolarHBondContact O-N 2.89Å; L236-V246 HydrophobicContact CD1-CG2 4.27Å; L236-V248 HydrophobicContact CD1-CG1 4.17Å; L236-V248 HydrophobicContact CD2-CB 4.19Å; L236-V248 HydrophobicContact CD2-CG1 3.7Å; L236-V248 HydrophobicContact CG-CG1 3.9Å; L236-F252 HydrophobicContact CD2-CB 4.4Å; L236-F252 HydrophobicContact CD2-CD2 3.35Å; L236-F252 HydrophobicContact CD2-CE2 3.76Å; L236-F252 HydrophobicContact CD2-CG 3.88Å
237	F	98.8	Very high	98.6	Very high	34 Å²	34	35 Å²	35	15%	0.149	17%	0.167	C	C	.	.	H	α-helix	trans	-58.6	-37.9	176.7	177.6	-105.5	0	0	0	111.4	G190 S193 L197 T233 L234 H239 N240 W241 L382	G190-F237 WeakPolarHBondContact O-CE2 3.36Å; S193-F237 WeakPolarHBondContact OG-CD2 3.1Å; L197-F237 HydrophobicContact CD2-CB 4.5Å; L197-F237 HydrophobicContact CD2-CD1 4.12Å; L197-F237 HydrophobicContact CD2-CG 4.32Å; T233-F237 VanDerWaalsContact O-CB 3.29Å; T233-F237 WeakPolarHBondContact O-CB 3.5Å; T233-F237 PolarHBondContact O-N 3.48Å; L234-F237 PolarHBondContact O-N 3.34Å; F237-H239 VanDerWaalsContact C-N 3.32Å; F237-H239 PolarHBondContact O-N 3Å; F237-N240 CarbonylContact O-C 3.52Å; F237-N240 PolarHBondContact O-N 3.32Å; F237-W241 HydrophobicContact CD2-CE3 4.43Å; F237-W241 HydrophobicContact CE1-CD2 4.48Å; F237-W241 HydrophobicContact CE1-CE3 4.08Å; F237-W241 HydrophobicContact CE2-CD2 4.4Å; F237-W241 AromaticContact CE2-CE3 3.37Å; F237-W241 HydrophobicContact CE2-CE3 3.37Å; F237-W241 AromaticContact CE2-CZ3 3.76Å; F237-W241 HydrophobicContact CE2-CZ3 3.76Å; F237-W241 AromaticContact CZ-CD2 3.94Å; F237-W241 HydrophobicContact CZ-CD2 3.94Å; F237-W241 AromaticContact CZ-CE3 3.15Å; F237-W241 HydrophobicContact CZ-CE3 3.15Å; F237-W241 HydrophobicContact CZ-CH2 4.45Å; F237-W241 AromaticContact CZ-CZ3 3.47Å; F237-W241 HydrophobicContact CZ-CZ3 3.47Å; F237-W241 VanDerWaalsContact CZ-CZ3 3.47Å; F237-W241 WeakPolarHBondContact O-CA 3.31Å; F237-W241 VanDerWaalsContact O-CB 3.27Å; F237-W241 WeakPolarHBondContact O-CB 3.49Å; F237-W241 PolarHBondContact O-N 3.26Å; F237-L382 HydrophobicContact CE2-CD1 4.33Å; F237-L382 HydrophobicContact CZ-CD1 4.23Å
238	Y	98.8	Very high	98.6	Very high	162 Å²	162	34.5 Å²	34.5	64%	0.635	17%	0.165	S	C	*	.	H	α-helix	trans	-55.1	-45.3	174.4	175.3	-91.5	0	0	0	112.7	L24 L234 A235 L236	L24-Y238 HydrophobicContact CD2-CD1 3.55Å; L24-Y238 HydrophobicContact CD2-CE1 4.3Å; L24-Y238 HydrophobicContact CD2-CG 3.77Å; L234-Y238 PolarHBondContact O-N 2.86Å; A235-Y238 WeakPolarHBondContact O-CB 3.35Å; A235-Y238 PolarHBondContact O-N 3.09Å; L236-Y238 VanDerWaalsContact C-N 3.26Å; L236-Y238 PolarHBondContact O-N 3.46Å
239	H	98.7	Very high	98.5	Very high	26 Å²	26	34.9 Å²	34.9	12%	0.12	17%	0.169	C	C	.	.	H	α-helix	trans	-81.3	-27	179.8	-68.6	-67.8	0	0	0	113.3	L24 I27 A235 L236 F237 S245 V246	L24-H239 PolarHBondContact O-NE2 3.21Å; I27-H239 HydrophobicContact CG2-CB 4.11Å; A235-H239 PolarHBondContact O-CD2 3.08Å; L236-H239 PolarHBondContact O-N 3.17Å; L236-H239 VanDerWaalsContact O-N 3.13Å; F237-H239 VanDerWaalsContact C-N 3.32Å; F237-H239 PolarHBondContact O-N 3Å; H239-S245 PolarHBondContact O-N 3.05Å; H239-S245 PolarHBondContact O-OG 2.86Å; H239-V246 HydrophobicContact CB-CG1 4.37Å; H239-V246 HydrophobicContact CB-CG2 3.71Å; H239-V246 PolarHBondContact O-N 2.88Å
240	N	98.7	Very high	98.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-89.7	-7.9	179.1	-178.7	-121.5	0	0	0	113.2	G190 S193 L236 F237 S244 V246 V248	G190-N240 WeakPolarHBondContact CA-O 3.32Å; G190-N240 WeakPolarHBondContact CA-OD1 3.46Å; G190-N240 PolarHBondContact N-O 3.01Å; G190-N240 VanDerWaalsContact N-O 3.11Å; S193-N240 PolarHBondContact OG-OD1 3.21Å; L236-N240 VanDerWaalsContact O-CB 3.26Å; L236-N240 WeakPolarHBondContact O-CB 3.45Å; L236-N240 PolarHBondContact O-N 2.89Å; F237-N240 CarbonylContact O-C 3.52Å; F237-N240 PolarHBondContact O-N 3.32Å; N240-S244 PolarHBondContact O-OG 3.09Å; N240-V246 HydrophobicContact CB-CG2 4.3Å; N240-V246 PolarHBondContact ND2-O 3Å; N240-V248 HydrophobicContact CB-CG1 4.11Å
241	W	98.7	Very high	98.4	Very high	73 Å²	73	33.6 Å²	33.6	28%	0.277	16%	0.164	S	C	.	.	S	Bend	trans	-66.1	153.4	175.5	-175.9	-112.9	0	0	0	110.9	F237 P243 S244 R375 T378 V379 L382	F237-W241 HydrophobicContact CD2-CE3 4.43Å; F237-W241 HydrophobicContact CE1-CD2 4.48Å; F237-W241 HydrophobicContact CE1-CE3 4.08Å; F237-W241 HydrophobicContact CE2-CD2 4.4Å; F237-W241 AromaticContact CE2-CE3 3.37Å; F237-W241 HydrophobicContact CE2-CE3 3.37Å; F237-W241 AromaticContact CE2-CZ3 3.76Å; F237-W241 HydrophobicContact CE2-CZ3 3.76Å; F237-W241 AromaticContact CZ-CD2 3.94Å; F237-W241 HydrophobicContact CZ-CD2 3.94Å; F237-W241 AromaticContact CZ-CE3 3.15Å; F237-W241 HydrophobicContact CZ-CE3 3.15Å; F237-W241 HydrophobicContact CZ-CH2 4.45Å; F237-W241 AromaticContact CZ-CZ3 3.47Å; F237-W241 HydrophobicContact CZ-CZ3 3.47Å; F237-W241 VanDerWaalsContact CZ-CZ3 3.47Å; F237-W241 WeakPolarHBondContact O-CA 3.31Å; F237-W241 VanDerWaalsContact O-CB 3.27Å; F237-W241 WeakPolarHBondContact O-CB 3.49Å; F237-W241 PolarHBondContact O-N 3.26Å; W241-P243 CarbonylContact O-C 3.59Å; W241-S244 WeakPolarHBondContact O-CA 3.25Å; W241-S244 PolarHBondContact O-N 3.45Å; W241-S244 VanDerWaalsContact O-N 3.09Å; W241-R375 HydrophobicContact CZ2-CG 4.07Å; W241-T378 HydrophobicContact CH2-CG2 4.22Å; W241-T378 HydrophobicContact CZ3-CG2 3.65Å; W241-V379 HydrophobicContact CH2-CG2 3.68Å; W241-V379 HydrophobicContact CZ2-CG2 3.96Å; W241-L382 HydrophobicContact CH2-CD1 4.22Å; W241-L382 HydrophobicContact CZ3-CD1 3.77Å
242	Y	97.9	Very high	98.4	Very high	59 Å²	59	30.7 Å²	30.7	23%	0.231	15%	0.152	C	C	.	.	S	Bend	trans	-60.5	131.8	178.6	-178.8	-80.5	0	0	0	112.1	N189 H373 E374 R375	N189-Y242 HydrophobicContact CB-CD2 4.1Å; Y242-H373 AromaticContact CE1-CE1 3.56Å; Y242-H373 AromaticContact CE2-CE1 3.96Å; Y242-H373 AromaticContact CZ-CE1 3.35Å; Y242-H373 AromaticContact CZ-NE2 3.77Å; Y242-H373 PolarHBondContact OH-CE1 3.33Å; Y242-H373 VanDerWaalsContact OH-CE1 3.31Å; Y242-H373 PolarHBondContact OH-NE2 3.08Å; Y242-E374 HydrophobicContact CD2-CB 4.05Å; Y242-E374 HydrophobicContact CD2-CG 4.05Å; Y242-E374 VanDerWaalsContact CD2-OE2 3.3Å; Y242-E374 WeakPolarHBondContact CD2-OE2 3.31Å; Y242-E374 HydrophobicContact CE2-CB 3.94Å; Y242-E374 HydrophobicContact CE2-CG 4.34Å; Y242-E374 WeakPolarHBondContact CE2-OE2 3.47Å; Y242-R375 HydrophobicContact CD1-CB 3.72Å; Y242-R375 HydrophobicContact CD1-CG 4.14Å; Y242-R375 HydrophobicContact CD2-CB 4.39Å; Y242-R375 HydrophobicContact CE1-CB 4.31Å; Y242-R375 HydrophobicContact CG-CB 3.79Å; Y242-R375 HydrophobicContact CG-CG 4.32Å
243	P	97.3	Very high	98.4	Very high	87 Å²	87	30.7 Å²	30.7	57%	0.565	15%	0.152	S	C	*	.	S	Bend	cis	-78.6	124.3	-8.4	30.6	-32.2	0	0	0	111.3	W241 S245	W241-P243 CarbonylContact O-C 3.59Å; P243-S245 PolarHBondContact O-N 3.46Å
244	S	97.7	Very high	98.3	Very high	8 Å²	8	30.7 Å²	30.7	6%	0.056	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-55.5	124.8	-175.9	-66.4	0	0	0	0	112.7	N189 N240 W241	N189-S244 VanDerWaalsContact CB-OG 3.22Å; N189-S244 WeakPolarHBondContact CB-OG 3.28Å; N189-S244 WeakPolarHBondContact OD1-CB 3.42Å; N189-S244 PolarHBondContact OD1-OG 2.72Å; N240-S244 PolarHBondContact O-OG 3.09Å; W241-S244 WeakPolarHBondContact O-CA 3.25Å; W241-S244 PolarHBondContact O-N 3.45Å; W241-S244 VanDerWaalsContact O-N 3.09Å
245	S	97.8	Very high	98.3	Very high	58 Å²	58	27.7 Å²	27.7	41%	0.406	14%	0.136	S	C	.	.	S	Bend	trans	-88.1	-16.9	167.8	67.7	0	0	0	0	112.4	P53 H239 P243	P53-S245 WeakPolarHBondContact CD-O 3.3Å; H239-S245 PolarHBondContact O-N 3.05Å; H239-S245 PolarHBondContact O-OG 2.86Å; P243-S245 PolarHBondContact O-N 3.46Å
246	V	98.4	Very high	98.3	Very high	5 Å²	5	27.6 Å²	27.6	3%	0.03	14%	0.136	C	C	.	.	S	Bend	trans	-147.4	155.2	178.6	-52.4	0	0	0	0	112	I27 V52 P53 Q56 L236 H239 N240	I27-V246 HydrophobicContact CG2-CG1 3.63Å; I27-V246 HydrophobicContact CG2-CG2 4.27Å; V52-V246 VanDerWaalsContact CG1-CA 3.48Å; P53-V246 HydrophobicContact CG-CB 4.13Å; P53-V246 HydrophobicContact CG-CG1 3.72Å; Q56-V246 HydrophobicContact CB-CB 4.19Å; Q56-V246 HydrophobicContact CB-CG2 4.07Å; Q56-V246 HydrophobicContact CG-CB 3.5Å; Q56-V246 VanDerWaalsContact CG-CB 3.5Å; Q56-V246 HydrophobicContact CG-CG1 3.85Å; Q56-V246 HydrophobicContact CG-CG2 3.93Å; L236-V246 HydrophobicContact CD1-CG2 4.27Å; H239-V246 HydrophobicContact CB-CG1 4.37Å; H239-V246 HydrophobicContact CB-CG2 3.71Å; H239-V246 PolarHBondContact O-N 2.88Å; N240-V246 HydrophobicContact CB-CG2 4.3Å; N240-V246 PolarHBondContact ND2-O 3Å
247	F	98.6	Very high	98.3	Very high	28 Å²	28	27.6 Å²	27.6	12%	0.123	14%	0.136	C	C	.	.			trans	-107.7	146.8	168.5	-60	-45.8	0	0	0	111.9	D43 V52 P53 E54 S55 Q56	D43-F247 HydrophobicContact CB-CZ 3.93Å; V52-F247 HydrophobicContact CB-CD2 3.99Å; V52-F247 HydrophobicContact CB-CE2 3.65Å; V52-F247 HydrophobicContact CB-CZ 4.07Å; V52-F247 HydrophobicContact CG1-CD1 4.23Å; V52-F247 HydrophobicContact CG1-CD2 3.8Å; V52-F247 HydrophobicContact CG1-CE1 4.23Å; V52-F247 HydrophobicContact CG1-CE2 3.81Å; V52-F247 HydrophobicContact CG1-CG 4.01Å; V52-F247 HydrophobicContact CG1-CZ 4.01Å; V52-F247 HydrophobicContact CG2-CE2 4.34Å; V52-F247 HydrophobicContact CG2-CZ 4.35Å; P53-F247 PolarHBondContact O-N 3.43Å; E54-F247 CarbonylContact C-O 3.36Å; E54-F247 WeakPolarHBondContact OE1-CB 3.49Å; E54-F247 WeakPolarHBondContact OE2-CD2 3.22Å; S55-F247 PolarHBondContact N-O 3.02Å; Q56-F247 WeakPolarHBondContact CB-O 3.33Å; Q56-F247 PolarHBondContact N-O 3.1Å
248	V	98.6	Very high	98.3	Very high	5 Å²	5	26 Å²	26	3%	0.03	13%	0.128	C	C	.	.			trans	-78.3	-29.5	-172	-59.2	0	0	0	0	113	S55 G57 E192 L236 N240 F252	S55-V248 CarbonylContact C-O 3.58Å; S55-V248 WeakPolarHBondContact CA-O 3.43Å; G57-V248 PolarHBondContact N-O 2.72Å; E192-V248 HydrophobicContact CB-CG2 3.69Å; E192-V248 HydrophobicContact CG-CG2 4.07Å; L236-V248 HydrophobicContact CD1-CG1 4.17Å; L236-V248 HydrophobicContact CD2-CB 4.19Å; L236-V248 HydrophobicContact CD2-CG1 3.7Å; L236-V248 HydrophobicContact CG-CG1 3.9Å; N240-V248 HydrophobicContact CB-CG1 4.11Å; V248-F252 HydrophobicContact CB-CB 3.59Å; V248-F252 HydrophobicContact CB-CD1 4.14Å; V248-F252 HydrophobicContact CB-CG 3.96Å; V248-F252 HydrophobicContact CG1-CG 4.48Å; V248-F252 HydrophobicContact CG2-CB 4.01Å; V248-F252 HydrophobicContact CG2-CD1 4.1Å; V248-F252 HydrophobicContact CG2-CG 4.35Å
249	G	97.6	Very high	98.3	Very high	7 Å²	7	18.3 Å²	18.3	7%	0.072	10%	0.098	C	C	.	.	H	α-helix	trans	70	171.1	-174.1	0	0	0	0	0	114.8	T251 F252	G249-T251 PolarHBondContact O-N 3.24Å; G249-F252 PolarHBondContact O-N 2.99Å; G249-F252 VanDerWaalsContact O-N 3.17Å
250	D	97	Very high	98.3	Very high	26 Å²	26	17 Å²	17	14%	0.139	9%	0.092	C	C	.	.	H	α-helix	trans	-57.2	-31	170.9	-73.9	-29.1	0	0	0	110.4	D114 K123 N183 F252 C253 Y254	D114-D250 VanDerWaalsContact OD1-CB 3.26Å; D114-D250 WeakPolarHBondContact OD1-CB 3.48Å; D114-D250 PolarHBondContact OD1-N 3.14Å; D114-D250 PolarHBondContact OD2-N 2.96Å; K123-D250 IonicContact NZ-OD1 2.87Å; K123-D250 IonicContact NZ-OD2 3.92Å; K123-D250 PolarHBondContact NZ-OD2 3.4Å; N183-D250 VanDerWaalsContact CG-OD1 3.25Å; N183-D250 PolarHBondContact ND2-OD1 2.9Å; N183-D250 PolarHBondContact OD1-OD1 2.84Å; D250-F252 VanDerWaalsContact C-N 3.27Å; D250-F252 PolarHBondContact O-N 2.8Å; D250-C253 PolarHBondContact O-N 3.25Å; D250-C253 VanDerWaalsContact O-N 3.16Å; D250-Y254 VanDerWaalsContact O-CB 3.32Å; D250-Y254 WeakPolarHBondContact O-CB 3.32Å; D250-Y254 WeakPolarHBondContact O-CD1 3.26Å; D250-Y254 PolarHBondContact O-N 3.39Å
251	T	98.3	Very high	98.3	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-47.3	-49.1	174.2	-54.2	0	0	0	0	112.4	V58 I107 G110 F111 D114 G249 F255	V58-T251 HydrophobicContact CB-CG2 3.91Å; V58-T251 HydrophobicContact CG2-CG2 4.41Å; I107-T251 HydrophobicContact CG2-CG2 4.27Å; G110-T251 PolarHBondContact O-OG1 3.16Å; F111-T251 WeakPolarHBondContact CA-OG1 3.27Å; F111-T251 HydrophobicContact CB-CG2 4.16Å; F111-T251 PolarHBondContact N-OG1 3.36Å; D114-T251 WeakPolarHBondContact OD2-CB 3.42Å; D114-T251 PolarHBondContact OD2-N 2.9Å; D114-T251 PolarHBondContact OD2-OG1 2.71Å; G249-T251 PolarHBondContact O-N 3.24Å; T251-F255 VanDerWaalsContact O-CB 3.22Å; T251-F255 WeakPolarHBondContact O-CB 3.41Å; T251-F255 PolarHBondContact O-N 3.16Å
252	F	98.8	Very high	98.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-70.6	-44.3	-179.1	178.6	-99.2	0	0	0	112.1	E192 A196 F229 T233 L236 V248 G249 D250 Y254 F255 A256	E192-F252 HydrophobicContact CB-CD1 4.44Å; E192-F252 WeakPolarHBondContact O-CE1 3.28Å; A196-F252 HydrophobicContact CB-CE1 3.85Å; A196-F252 HydrophobicContact CB-CZ 3.76Å; F229-F252 HydrophobicContact CZ-CE2 4.48Å; F229-F252 HydrophobicContact CZ-CZ 4.29Å; T233-F252 HydrophobicContact CG2-CE2 3.87Å; T233-F252 HydrophobicContact CG2-CZ 3.57Å; L236-F252 HydrophobicContact CD2-CB 4.4Å; L236-F252 HydrophobicContact CD2-CD2 3.35Å; L236-F252 HydrophobicContact CD2-CE2 3.76Å; L236-F252 HydrophobicContact CD2-CG 3.88Å; V248-F252 HydrophobicContact CB-CB 3.59Å; V248-F252 HydrophobicContact CB-CD1 4.14Å; V248-F252 HydrophobicContact CB-CG 3.96Å; V248-F252 HydrophobicContact CG1-CG 4.48Å; V248-F252 HydrophobicContact CG2-CB 4.01Å; V248-F252 HydrophobicContact CG2-CD1 4.1Å; V248-F252 HydrophobicContact CG2-CG 4.35Å; G249-F252 PolarHBondContact O-N 2.99Å; G249-F252 VanDerWaalsContact O-N 3.17Å; D250-F252 VanDerWaalsContact C-N 3.27Å; D250-F252 PolarHBondContact O-N 2.8Å; F252-Y254 PolarHBondContact O-N 3.47Å; F252-F255 HydrophobicContact CD2-CD1 4.08Å; F252-F255 HydrophobicContact CE2-CD1 4.32Å; F252-F255 WeakPolarHBondContact O-CB 3.21Å; F252-F255 PolarHBondContact O-N 3.3Å; F252-A256 HydrophobicContact CE1-CB 4.1Å; F252-A256 HydrophobicContact CZ-CB 4.11Å; F252-A256 VanDerWaalsContact O-CB 3.3Å; F252-A256 WeakPolarHBondContact O-CB 3.37Å; F252-A256 PolarHBondContact O-N 3.22Å
253	C	98.4	Very high	98.3	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.007	7%	0.068	C	C	.	.	H	α-helix	trans	-58.7	-40.2	179.8	-63.1	0	0	0	0	111.1	I182 N183 D250 G257	I182-C253 HydrophobicContact CG2-CB 4.33Å; N183-C253 HydrophobicContact CB-CB 3.77Å; D250-C253 PolarHBondContact O-N 3.25Å; D250-C253 VanDerWaalsContact O-N 3.16Å; C253-G257 PolarHBondContact O-N 3.26Å
254	Y	98.3	Very high	98.3	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-68.9	-48.9	177.6	-82.4	28.9	0	0	0	111	M106 D113 K123 T179 D250 F252 A256 G257 M258	M106-Y254 HydrophobicContact CG-CG 4.48Å; M106-Y254 WeakPolarHBondContact CG-O 3.35Å; M106-Y254 VanDerWaalsContact SD-CB 3.56Å; M106-Y254 HydrophobicContact SD-CD2 3.46Å; M106-Y254 WeakPolarHBondContact SD-CD2 3.26Å; M106-Y254 HydrophobicContact SD-CE2 4.47Å; M106-Y254 HydrophobicContact SD-CG 3.73Å; D113-Y254 HydrophobicContact CB-CE2 4.31Å; D113-Y254 PolarHBondContact OD2-OH 2.96Å; K123-Y254 WeakPolarHBondContact CB-OH 3.22Å; K123-Y254 WeakPolarHBondContact CD-OH 3.38Å; K123-Y254 VanDerWaalsContact CG-OH 3.22Å; K123-Y254 WeakPolarHBondContact CG-OH 3.31Å; T179-Y254 WeakPolarHBondContact CG2-O 3.14Å; D250-Y254 VanDerWaalsContact O-CB 3.32Å; D250-Y254 WeakPolarHBondContact O-CB 3.32Å; D250-Y254 WeakPolarHBondContact O-CD1 3.26Å; D250-Y254 PolarHBondContact O-N 3.39Å; F252-Y254 PolarHBondContact O-N 3.47Å; Y254-A256 PolarHBondContact O-N 3.04Å; Y254-G257 PolarHBondContact O-N 2.79Å; Y254-M258 WeakPolarHBondContact O-CB 3.43Å; Y254-M258 PolarHBondContact O-N 2.87Å
255	F	98.7	Very high	98.3	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-53.8	-52.3	173.8	167.6	-138.5	0	0	0	112.4	F64 I103 I107 F229 T251 F252 T259	F64-F255 HydrophobicContact CB-CE2 4.44Å; F64-F255 HydrophobicContact CB-CZ 3.82Å; F64-F255 AromaticContact CD1-CE2 3.57Å; F64-F255 HydrophobicContact CD1-CE2 3.57Å; F64-F255 AromaticContact CD1-CZ 3.8Å; F64-F255 HydrophobicContact CD1-CZ 3.8Å; F64-F255 HydrophobicContact CD2-CE2 4.33Å; F64-F255 AromaticContact CD2-CZ 3.92Å; F64-F255 HydrophobicContact CD2-CZ 3.92Å; F64-F255 AromaticContact CE1-CE2 3.77Å; F64-F255 HydrophobicContact CE1-CE2 3.77Å; F64-F255 HydrophobicContact CE1-CZ 4.31Å; F64-F255 HydrophobicContact CE2-CE2 4.48Å; F64-F255 HydrophobicContact CE2-CZ 4.4Å; F64-F255 AromaticContact CG-CE2 3.87Å; F64-F255 HydrophobicContact CG-CE2 3.87Å; F64-F255 AromaticContact CG-CZ 3.57Å; F64-F255 HydrophobicContact CG-CZ 3.57Å; F64-F255 HydrophobicContact CZ-CE2 4.19Å; I103-F255 HydrophobicContact CG2-CD2 3.75Å; I103-F255 HydrophobicContact CG2-CE2 3.84Å; I107-F255 HydrophobicContact CD1-CD2 3.72Å; I107-F255 HydrophobicContact CD1-CE2 4.1Å; I107-F255 HydrophobicContact CD1-CG 4.24Å; I107-F255 HydrophobicContact CG1-CB 3.77Å; I107-F255 HydrophobicContact CG1-CD2 3.68Å; I107-F255 HydrophobicContact CG1-CG 3.84Å; F229-F255 AromaticContact CD2-CE1 3.83Å; F229-F255 HydrophobicContact CD2-CE1 3.83Å; F229-F255 AromaticContact CD2-CE2 3.88Å; F229-F255 HydrophobicContact CD2-CE2 3.88Å; F229-F255 AromaticContact CD2-CZ 3.42Å; F229-F255 HydrophobicContact CD2-CZ 3.42Å; F229-F255 VanDerWaalsContact CD2-CZ 3.42Å; F229-F255 HydrophobicContact CE2-CD1 4.12Å; F229-F255 AromaticContact CE2-CE1 3.72Å; F229-F255 HydrophobicContact CE2-CE1 3.72Å; F229-F255 HydrophobicContact CE2-CE2 4.18Å; F229-F255 AromaticContact CE2-CZ 3.76Å; F229-F255 HydrophobicContact CE2-CZ 3.76Å; T251-F255 VanDerWaalsContact O-CB 3.22Å; T251-F255 WeakPolarHBondContact O-CB 3.41Å; T251-F255 PolarHBondContact O-N 3.16Å; F252-F255 HydrophobicContact CD2-CD1 4.08Å; F252-F255 HydrophobicContact CE2-CD1 4.32Å; F252-F255 WeakPolarHBondContact O-CB 3.21Å; F252-F255 PolarHBondContact O-N 3.3Å; F255-T259 WeakPolarHBondContact CD2-OG1 3.46Å; F255-T259 VanDerWaalsContact CE2-OG1 3.31Å; F255-T259 WeakPolarHBondContact CE2-OG1 3.22Å; F255-T259 WeakPolarHBondContact O-CB 3.44Å; F255-T259 PolarHBondContact O-N 3.25Å; F255-T259 PolarHBondContact O-OG1 3.17Å
256	A	98.8	Very high	98.2	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-61.2	-52.8	-179.6	0	0	0	0	0	111.5	I182 A196 F229 F252 Y254 M258 T259 F260	I182-A256 HydrophobicContact CD1-CB 3.85Å; A196-A256 HydrophobicContact CB-CB 4.15Å; F229-A256 HydrophobicContact CE2-CB 3.95Å; F229-A256 HydrophobicContact CZ-CB 3.63Å; F252-A256 HydrophobicContact CE1-CB 4.1Å; F252-A256 HydrophobicContact CZ-CB 4.11Å; F252-A256 VanDerWaalsContact O-CB 3.3Å; F252-A256 WeakPolarHBondContact O-CB 3.37Å; F252-A256 PolarHBondContact O-N 3.22Å; Y254-A256 PolarHBondContact O-N 3.04Å; A256-M258 VanDerWaalsContact C-N 3.34Å; A256-M258 PolarHBondContact O-N 3.4Å; A256-T259 PolarHBondContact O-N 2.91Å; A256-F260 HydrophobicContact CB-CE2 4.09Å; A256-F260 WeakPolarHBondContact O-CD2 3.09Å; A256-F260 WeakPolarHBondContact O-CG 3.32Å; A256-F260 PolarHBondContact O-N 3.39Å
257	G	98.4	Very high	98	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-59.4	-42.4	-178.1	0	0	0	0	0	113.4	C178 C253 Y254 A261	C178-G257 WeakPolarHBondContact CB-O 3.08Å; C253-G257 PolarHBondContact O-N 3.26Å; Y254-G257 PolarHBondContact O-N 2.79Å; G257-A261 WeakPolarHBondContact O-CB 3.45Å; G257-A261 PolarHBondContact O-N 2.91Å
258	M	98.6	Very high	97.8	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-69.5	-40.2	176.7	-178.3	62.6	72.5	0	0	112.2	A102 I103 M106 A130 A175 Y254 A256 F260 A261 V262	A102-M258 HydrophobicContact CB-CG 4.47Å; A102-M258 HydrophobicContact CB-SD 4.18Å; I103-M258 HydrophobicContact CG1-CG 4.14Å; M106-M258 HydrophobicContact CB-CB 3.72Å; M106-M258 HydrophobicContact CB-CE 4.42Å; M106-M258 HydrophobicContact CB-CG 3.86Å; M106-M258 HydrophobicContact CE-CE 3.5Å; M106-M258 HydrophobicContact CG-CB 3.61Å; M106-M258 HydrophobicContact CG-CG 4.26Å; A130-M258 HydrophobicContact CB-CE 4.02Å; A175-M258 HydrophobicContact CB-CE 3.94Å; A175-M258 HydrophobicContact CB-SD 4.19Å; Y254-M258 WeakPolarHBondContact O-CB 3.43Å; Y254-M258 PolarHBondContact O-N 2.87Å; A256-M258 VanDerWaalsContact C-N 3.34Å; A256-M258 PolarHBondContact O-N 3.4Å; M258-F260 VanDerWaalsContact C-N 3.3Å; M258-F260 PolarHBondContact O-N 2.8Å; M258-A261 PolarHBondContact O-N 3.48Å; M258-V262 HydrophobicContact CG-CG2 4.18Å; M258-V262 WeakPolarHBondContact O-CB 2.98Å; M258-V262 VanDerWaalsContact O-CG2 3.24Å; M258-V262 WeakPolarHBondContact O-CG2 3.41Å; M258-V262 PolarHBondContact O-N 3.19Å; M258-V262 HydrophobicContact SD-CG2 4.02Å
259	T	98.9	Very high	97.7	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-60.8	-41.9	177.3	-52.1	0	0	0	0	110.9	F64 I103 F225 M226 F229 F255 A256 V263	F64-T259 HydrophobicContact CZ-CG2 4.13Å; I103-T259 HydrophobicContact CD1-CG2 4.06Å; F225-T259 HydrophobicContact CB-CG2 4.48Å; M226-T259 HydrophobicContact CE-CG2 3.43Å; M226-T259 VanDerWaalsContact CE-CG2 3.43Å; F229-T259 HydrophobicContact CB-CG2 4.27Å; F229-T259 HydrophobicContact CD2-CG2 3.9Å; F229-T259 HydrophobicContact CG-CG2 4.18Å; F255-T259 WeakPolarHBondContact CD2-OG1 3.46Å; F255-T259 VanDerWaalsContact CE2-OG1 3.31Å; F255-T259 WeakPolarHBondContact CE2-OG1 3.22Å; F255-T259 WeakPolarHBondContact O-CB 3.44Å; F255-T259 PolarHBondContact O-N 3.25Å; F255-T259 PolarHBondContact O-OG1 3.17Å; A256-T259 PolarHBondContact O-N 2.91Å; T259-V263 PolarHBondContact O-N 3.06Å
260	F	98.8	Very high	97.5	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-63.4	-50.4	173.5	-63.9	-46.7	0	0	0	112.1	I182 A196 I199 I203 M226 F229 A256 M258 V262 V263 G264 M273 F277	I182-F260 HydrophobicContact CD1-CD2 4.02Å; I182-F260 HydrophobicContact CD1-CE2 3.91Å; A196-F260 HydrophobicContact CB-CE2 4.08Å; A196-F260 HydrophobicContact CB-CZ 4.19Å; A196-F260 WeakPolarHBondContact O-CZ 3.45Å; I199-F260 HydrophobicContact CB-CE1 4.35Å; I199-F260 HydrophobicContact CB-CE2 4.38Å; I199-F260 HydrophobicContact CB-CZ 3.96Å; I199-F260 HydrophobicContact CG2-CD1 4.04Å; I199-F260 HydrophobicContact CG2-CD2 4.39Å; I199-F260 HydrophobicContact CG2-CE1 3.71Å; I199-F260 HydrophobicContact CG2-CE2 4.05Å; I199-F260 HydrophobicContact CG2-CG 4.38Å; I199-F260 HydrophobicContact CG2-CZ 3.7Å; I203-F260 HydrophobicContact CD1-CD1 3.59Å; I203-F260 HydrophobicContact CD1-CE1 3.98Å; M226-F260 HydrophobicContact CE-CD1 4.06Å; M226-F260 HydrophobicContact CE-CE1 4.28Å; M226-F260 HydrophobicContact SD-CD1 4Å; M226-F260 HydrophobicContact SD-CE1 3.99Å; F229-F260 HydrophobicContact CD1-CE1 4.33Å; F229-F260 HydrophobicContact CD1-CZ 4.35Å; F229-F260 AromaticContact CE1-CE1 3.93Å; F229-F260 HydrophobicContact CE1-CE1 3.93Å; F229-F260 HydrophobicContact CE1-CE2 4.32Å; F229-F260 AromaticContact CE1-CZ 3.52Å; F229-F260 HydrophobicContact CE1-CZ 3.52Å; F229-F260 HydrophobicContact CZ-CE2 4.29Å; F229-F260 AromaticContact CZ-CZ 3.92Å; F229-F260 HydrophobicContact CZ-CZ 3.92Å; A256-F260 HydrophobicContact CB-CE2 4.09Å; A256-F260 WeakPolarHBondContact O-CD2 3.09Å; A256-F260 WeakPolarHBondContact O-CG 3.32Å; A256-F260 PolarHBondContact O-N 3.39Å; M258-F260 VanDerWaalsContact C-N 3.3Å; M258-F260 PolarHBondContact O-N 2.8Å; F260-V262 VanDerWaalsContact C-N 3.29Å; F260-V262 PolarHBondContact O-N 2.98Å; F260-V263 VanDerWaalsContact O-CG2 3.31Å; F260-V263 WeakPolarHBondContact O-CG2 3.44Å; F260-V263 PolarHBondContact O-N 3.4Å; F260-G264 PolarHBondContact O-N 3.35Å; F260-M273 HydrophobicContact CB-SD 3.93Å; F260-F277 HydrophobicContact CB-CE2 4.1Å; F260-F277 HydrophobicContact CB-CZ 4Å; F260-F277 AromaticContact CD2-CE2 3.97Å; F260-F277 HydrophobicContact CD2-CE2 3.97Å; F260-F277 AromaticContact CD2-CZ 3.53Å; F260-F277 HydrophobicContact CD2-CZ 3.53Å; F260-F277 HydrophobicContact CE2-CZ 4.27Å; F260-F277 HydrophobicContact CG-CE2 4.06Å; F260-F277 AromaticContact CG-CZ 3.98Å; F260-F277 HydrophobicContact CG-CZ 3.98Å
261	A	98.4	Very high	97.3	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-57.4	-42.6	179.2	0	0	0	0	0	112.2	A175 G257 M258 G264 I265	A175-A261 HydrophobicContact CB-CB 3.99Å; G257-A261 WeakPolarHBondContact O-CB 3.45Å; G257-A261 PolarHBondContact O-N 2.91Å; M258-A261 PolarHBondContact O-N 3.48Å; A261-G264 PolarHBondContact O-N 3.02Å; A261-I265 HydrophobicContact CB-CD1 4.47Å; A261-I265 VanDerWaalsContact O-CB 3.25Å; A261-I265 WeakPolarHBondContact O-CB 3.42Å; A261-I265 WeakPolarHBondContact O-CD1 3.43Å; A261-I265 WeakPolarHBondContact O-CG1 3.29Å; A261-I265 PolarHBondContact O-N 3.19Å
262	V	98.5	Very high	97.2	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-57.7	-53.1	176.6	162.6	0	0	0	0	111.5	A99 A102 I103 L134 M258 F260 G264 I265 L266	A99-V262 HydrophobicContact CB-CG1 3.41Å; A99-V262 VanDerWaalsContact CB-CG1 3.41Å; A102-V262 HydrophobicContact CB-CG2 4.23Å; I103-V262 HydrophobicContact CD1-CB 4.42Å; I103-V262 HydrophobicContact CD1-CG1 4.27Å; I103-V262 HydrophobicContact CD1-CG2 4.39Å; I103-V262 HydrophobicContact CG1-CG2 4.07Å; L134-V262 HydrophobicContact CD1-CB 4.5Å; L134-V262 HydrophobicContact CD1-CG2 4.18Å; L134-V262 HydrophobicContact CD2-CG2 4.04Å; M258-V262 HydrophobicContact CG-CG2 4.18Å; M258-V262 WeakPolarHBondContact O-CB 2.98Å; M258-V262 VanDerWaalsContact O-CG2 3.24Å; M258-V262 WeakPolarHBondContact O-CG2 3.41Å; M258-V262 PolarHBondContact O-N 3.19Å; M258-V262 HydrophobicContact SD-CG2 4.02Å; F260-V262 VanDerWaalsContact C-N 3.29Å; F260-V262 PolarHBondContact O-N 2.98Å; V262-G264 PolarHBondContact O-N 2.97Å; V262-I265 PolarHBondContact O-N 2.66Å; V262-L266 HydrophobicContact CG1-CD1 4.37Å; V262-L266 PolarHBondContact O-N 2.75Å
263	V	98.4	Very high	97.2	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-70.5	-32.9	-178.4	-60.6	0	0	0	0	112.6	S222 F225 M226 T259 F260 G267 F269	S222-V263 WeakPolarHBondContact OG-CB 3.47Å; F225-V263 HydrophobicContact CB-CG1 3.73Å; F225-V263 HydrophobicContact CD2-CG1 4.41Å; F225-V263 HydrophobicContact CG-CG1 4.24Å; M226-V263 HydrophobicContact CE-CB 4.45Å; M226-V263 HydrophobicContact CE-CG1 3.85Å; M226-V263 HydrophobicContact CE-CG2 3.73Å; M226-V263 HydrophobicContact CG-CG1 4.37Å; M226-V263 HydrophobicContact CG-CG2 4.27Å; M226-V263 HydrophobicContact SD-CG2 3.94Å; T259-V263 PolarHBondContact O-N 3.06Å; F260-V263 VanDerWaalsContact O-CG2 3.31Å; F260-V263 WeakPolarHBondContact O-CG2 3.44Å; F260-V263 PolarHBondContact O-N 3.4Å; V263-G267 VanDerWaalsContact O-CA 3.25Å; V263-G267 WeakPolarHBondContact O-CA 3.33Å; V263-G267 PolarHBondContact O-N 3.14Å; V263-F269 HydrophobicContact CB-CZ 4.11Å; V263-F269 HydrophobicContact CG2-CE2 4.34Å; V263-F269 HydrophobicContact CG2-CZ 4.13Å; V263-F269 WeakPolarHBondContact O-CE1 3.33Å; V263-F269 WeakPolarHBondContact O-CZ 3.32Å
264	G	97.8	Very high	97.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-69.6	-35.4	176.1	0	0	0	0	0	113.1	F260 A261 V262 H268 F269 S270	F260-G264 PolarHBondContact O-N 3.35Å; A261-G264 PolarHBondContact O-N 3.02Å; V262-G264 PolarHBondContact O-N 2.97Å; G264-H268 PolarHBondContact O-N 3.48Å; G264-F269 PolarHBondContact O-N 3.15Å; G264-F269 VanDerWaalsContact O-N 3.15Å; G264-S270 WeakPolarHBondContact O-CA 3.47Å; G264-S270 WeakPolarHBondContact O-CB 3.48Å; G264-S270 PolarHBondContact O-N 2.97Å
265	I	96.8	Very high	97.1	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.01	7%	0.068	C	C	.	.	H	α-helix	trans	-77	-56.9	179.5	-72.6	164.8	0	0	0	110.7	L134 Y138 M171 L174 A261 V262 G267 H268	L134-I265 HydrophobicContact CD1-CB 4.39Å; L134-I265 HydrophobicContact CD1-CG2 4.11Å; L134-I265 HydrophobicContact CD2-CB 4.16Å; L134-I265 HydrophobicContact CD2-CD1 3.47Å; L134-I265 VanDerWaalsContact CD2-CD1 3.47Å; L134-I265 HydrophobicContact CD2-CG1 4.38Å; L134-I265 HydrophobicContact CD2-CG2 4.24Å; L134-I265 HydrophobicContact CG-CB 4.48Å; L134-I265 HydrophobicContact CG-CD1 4.4Å; L134-I265 HydrophobicContact CG-CG2 4.1Å; Y138-I265 HydrophobicContact CD2-CG2 4.03Å; M171-I265 HydrophobicContact CB-CD1 3.78Å; M171-I265 HydrophobicContact CB-CG1 4.36Å; M171-I265 HydrophobicContact CG-CD1 4.08Å; M171-I265 HydrophobicContact CG-CG1 4.09Å; M171-I265 HydrophobicContact CG-CG2 4.15Å; M171-I265 HydrophobicContact SD-CG2 3.46Å; M171-I265 WeakPolarHBondContact SD-CG2 3.47Å; L174-I265 HydrophobicContact CD2-CD1 4.09Å; L174-I265 HydrophobicContact CD2-CG1 3.87Å; A261-I265 HydrophobicContact CB-CD1 4.47Å; A261-I265 VanDerWaalsContact O-CB 3.25Å; A261-I265 WeakPolarHBondContact O-CB 3.42Å; A261-I265 WeakPolarHBondContact O-CD1 3.43Å; A261-I265 WeakPolarHBondContact O-CG1 3.29Å; A261-I265 PolarHBondContact O-N 3.19Å; V262-I265 PolarHBondContact O-N 2.66Å; I265-G267 VanDerWaalsContact C-N 3.31Å; I265-G267 PolarHBondContact O-N 3.49Å; I265-H268 PolarHBondContact O-N 3.1Å
266	L	95.8	Very high	97.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-74.8	-23.2	-177.1	-62.3	175.7	0	0	0	112.8	A99 L134 V137 F142 F221 V262 H268	A99-L266 HydrophobicContact CB-CD1 4.03Å; L134-L266 HydrophobicContact CD1-CD1 3.57Å; L134-L266 HydrophobicContact CD1-CD2 3.79Å; L134-L266 HydrophobicContact CD1-CG 3.42Å; L134-L266 VanDerWaalsContact CD1-CG 3.42Å; V137-L266 HydrophobicContact CG1-CD1 4.41Å; V137-L266 HydrophobicContact CG1-CD2 3.78Å; F142-L266 HydrophobicContact CD2-CD2 4.47Å; F142-L266 HydrophobicContact CE2-CD2 3.94Å; F221-L266 HydrophobicContact CD1-CB 4.26Å; F221-L266 HydrophobicContact CE1-CB 3.63Å; F221-L266 HydrophobicContact CE1-CD1 3.93Å; F221-L266 HydrophobicContact CE1-CG 4.41Å; F221-L266 HydrophobicContact CZ-CB 4.1Å; F221-L266 HydrophobicContact CZ-CD1 3.57Å; F221-L266 HydrophobicContact CZ-CG 4.48Å; V262-L266 HydrophobicContact CG1-CD1 4.37Å; V262-L266 PolarHBondContact O-N 2.75Å; L266-H268 VanDerWaalsContact C-N 3.32Å; L266-H268 PolarHBondContact O-CE1 2.63Å; L266-H268 PolarHBondContact O-ND1 2.88Å
267	G	94.6	Very high	97.1	Very high	3 Å²	3	13.9 Å²	13.9	3%	0.031	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	4.4	171.8	0	0	0	0	0	114.3	V263 I265 F269	V263-G267 VanDerWaalsContact O-CA 3.25Å; V263-G267 WeakPolarHBondContact O-CA 3.33Å; V263-G267 PolarHBondContact O-N 3.14Å; I265-G267 VanDerWaalsContact C-N 3.31Å; I265-G267 PolarHBondContact O-N 3.49Å; G267-F269 WeakPolarHBondContact O-CD1 3.23Å; G267-F269 PolarHBondContact O-N 2.96Å
268	H	94.3	Very high	97.1	Very high	70 Å²	70	15.9 Å²	15.9	32%	0.324	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	18.2	178.5	-56.8	91.7	0	0	0	116.7	Y138 F142 D218 G264 I265 L266	Y138-H268 AromaticContact CE2-NE2 3.56Å; F142-H268 AromaticContact CD1-CE1 3.54Å; F142-H268 AromaticContact CD1-NE2 3.89Å; F142-H268 AromaticContact CD2-CE1 3.9Å; F142-H268 AromaticContact CE1-CE1 3.53Å; F142-H268 AromaticContact CE2-CE1 3.89Å; F142-H268 AromaticContact CG-CE1 3.72Å; F142-H268 AromaticContact CG-NE2 3.71Å; F142-H268 AromaticContact CZ-CE1 3.68Å; D218-H268 IonicContact OD2-CE1 3.88Å; D218-H268 IonicContact OD2-CG 3.68Å; D218-H268 IonicContact OD2-ND1 3.86Å; D218-H268 PolarHBondContact OD2-ND1 3.04Å; G264-H268 PolarHBondContact O-N 3.48Å; I265-H268 PolarHBondContact O-N 3.1Å; L266-H268 VanDerWaalsContact C-N 3.32Å; L266-H268 PolarHBondContact O-CE1 2.63Å; L266-H268 PolarHBondContact O-ND1 2.88Å
269	F	95.4	Very high	97.1	Very high	10 Å²	10	16.2 Å²	16.2	4%	0.044	8%	0.08	C	C	.	.			trans	-113.4	22.4	178.9	59.9	-104.7	0	0	0	113.7	I203 F206 H219 S222 V263 G264 G267 K271 T272 M273	I203-F269 HydrophobicContact CG2-CE2 4.09Å; I203-F269 HydrophobicContact CG2-CZ 4.19Å; F206-F269 HydrophobicContact CD1-CD2 4.45Å; F206-F269 HydrophobicContact CD1-CG 4.46Å; F206-F269 HydrophobicContact CE1-CB 3.73Å; F206-F269 HydrophobicContact CE1-CD1 4Å; F206-F269 HydrophobicContact CE1-CD2 4.01Å; F206-F269 AromaticContact CE1-CG 3.66Å; F206-F269 HydrophobicContact CE1-CG 3.66Å; F206-F269 HydrophobicContact CZ-CB 4.17Å; H219-F269 AromaticContact CE1-CD1 3.88Å; S222-F269 WeakPolarHBondContact OG-CZ 3.37Å; V263-F269 HydrophobicContact CB-CZ 4.11Å; V263-F269 HydrophobicContact CG2-CE2 4.34Å; V263-F269 HydrophobicContact CG2-CZ 4.13Å; V263-F269 WeakPolarHBondContact O-CE1 3.33Å; V263-F269 WeakPolarHBondContact O-CZ 3.32Å; G264-F269 PolarHBondContact O-N 3.15Å; G264-F269 VanDerWaalsContact O-N 3.15Å; G267-F269 WeakPolarHBondContact O-CD1 3.23Å; G267-F269 PolarHBondContact O-N 2.96Å; F269-K271 PolarHBondContact O-N 3.42Å; F269-T272 WeakPolarHBondContact O-CA 3.29Å; F269-T272 WeakPolarHBondContact O-CB 3.25Å; F269-T272 PolarHBondContact O-N 2.88Å; F269-M273 HydrophobicContact CD2-CB 4.22Å; F269-M273 HydrophobicContact CE2-CB 4.46Å; F269-M273 PolarHBondContact O-N 3.36Å
270	S	95	Very high	97.1	Very high	7 Å²	7	16.2 Å²	16.2	5%	0.049	8%	0.08	C	C	.	.	H	α-helix	trans	-48.7	-34.7	178.6	58.4	0	0	0	0	114.2	Y170 G264 L274	Y170-S270 WeakPolarHBondContact OH-CB 3.48Å; Y170-S270 PolarHBondContact OH-OG 2.89Å; G264-S270 WeakPolarHBondContact O-CA 3.47Å; G264-S270 WeakPolarHBondContact O-CB 3.48Å; G264-S270 PolarHBondContact O-N 2.97Å; S270-L274 WeakPolarHBondContact O-CB 3.35Å; S270-L274 WeakPolarHBondContact O-CG 3.4Å; S270-L274 PolarHBondContact O-N 3.33Å
271	K	93.2	Very high	97.1	Very high	93 Å²	93	18.2 Å²	18.2	40%	0.404	9%	0.093	S	C	.	.	H	α-helix	trans	-63.8	-48	173.6	-62.7	179.8	-175	177.5	0	112.2	V148 F269 L274 L275 Y404	V148-K271 PolarHBondContact O-NZ 3.49Å; F269-K271 PolarHBondContact O-N 3.42Å; K271-L274 PolarHBondContact O-N 3.24Å; K271-L275 PolarHBondContact O-N 3.11Å; K271-Y404 PolarHBondContact NZ-OH 2.06Å; K271-Y404 VanDerWaalsContact NZ-OH 3.14Å
272	T	95.4	Very high	97.1	Very high	11 Å²	11	21.6 Å²	21.6	7%	0.067	11%	0.113	C	C	.	.	H	α-helix	trans	-66.2	-41	176.6	-53	0	0	0	0	110.7	F206 F269 L274 L275 F276 R396	F206-T272 HydrophobicContact CD1-CG2 4.42Å; F206-T272 HydrophobicContact CD2-CG2 4.2Å; F206-T272 HydrophobicContact CE1-CG2 4.19Å; F206-T272 HydrophobicContact CE2-CG2 3.97Å; F206-T272 HydrophobicContact CG-CG2 4.42Å; F206-T272 HydrophobicContact CZ-CG2 3.97Å; F269-T272 WeakPolarHBondContact O-CA 3.29Å; F269-T272 WeakPolarHBondContact O-CB 3.25Å; F269-T272 PolarHBondContact O-N 2.88Å; T272-L274 VanDerWaalsContact C-N 3.32Å; T272-L274 PolarHBondContact O-N 3.41Å; T272-L275 WeakPolarHBondContact O-CA 3.46Å; T272-L275 WeakPolarHBondContact O-CB 3.24Å; T272-L275 PolarHBondContact O-N 3.14Å; T272-F276 HydrophobicContact CG2-CE2 3.98Å; T272-F276 HydrophobicContact CG2-CZ 4.2Å; T272-F276 PolarHBondContact O-N 3.32Å; T272-R396 HydrophobicContact CG2-CG 4.49Å
273	M	97.7	Very high	97.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.4	-44.6	174.4	-175.7	-159.8	75.5	0	0	111.5	L174 I203 F260 F269 L275 F276 F277	L174-M273 HydrophobicContact CD1-CE 3.76Å; L174-M273 HydrophobicContact CD2-CE 3.95Å; L174-M273 HydrophobicContact CG-CE 4.04Å; I203-M273 HydrophobicContact CD1-CG 4.19Å; F260-M273 HydrophobicContact CB-SD 3.93Å; F269-M273 HydrophobicContact CD2-CB 4.22Å; F269-M273 HydrophobicContact CE2-CB 4.46Å; F269-M273 PolarHBondContact O-N 3.36Å; M273-L275 PolarHBondContact O-N 2.9Å; M273-F276 WeakPolarHBondContact O-CA 3.42Å; M273-F276 WeakPolarHBondContact O-CB 3.46Å; M273-F276 PolarHBondContact O-N 3.23Å; M273-F277 HydrophobicContact CG-CD2 4.42Å; M273-F277 HydrophobicContact CG-CE2 4.25Å; M273-F277 WeakPolarHBondContact O-CD2 3.34Å; M273-F277 PolarHBondContact O-N 3.4Å
274	L	97.4	Very high	97.1	Very high	46 Å²	46	24.5 Å²	24.5	24%	0.241	13%	0.126	C	C	.	.	H	α-helix	trans	-62.5	-27.2	175.9	-79.3	173.9	0	0	0	113.2	L174 F177 S270 K271 T272 F277	L174-L274 HydrophobicContact CD1-CD1 3.98Å; L174-L274 HydrophobicContact CD1-CD2 3.65Å; L174-L274 HydrophobicContact CD1-CG 3.87Å; F177-L274 HydrophobicContact CD1-CD2 3.97Å; F177-L274 HydrophobicContact CE1-CD2 3.8Å; S270-L274 WeakPolarHBondContact O-CB 3.35Å; S270-L274 WeakPolarHBondContact O-CG 3.4Å; S270-L274 PolarHBondContact O-N 3.33Å; K271-L274 PolarHBondContact O-N 3.24Å; T272-L274 VanDerWaalsContact C-N 3.32Å; T272-L274 PolarHBondContact O-N 3.41Å; L274-F277 CarbonylContact O-C 3.57Å; L274-F277 WeakPolarHBondContact O-CB 3.22Å; L274-F277 PolarHBondContact O-N 2.85Å; L274-F277 VanDerWaalsContact O-N 3.17Å
275	L	97.6	Very high	97.1	Very high	49 Å²	49	29.4 Å²	29.4	26%	0.257	15%	0.151	S	C	.	.	H	α-helix	trans	-69.1	-35.6	171	-62.2	174.8	0	0	0	111.7	K271 T272 M273 F277 I278 A392 I395	K271-L275 PolarHBondContact O-N 3.11Å; T272-L275 WeakPolarHBondContact O-CA 3.46Å; T272-L275 WeakPolarHBondContact O-CB 3.24Å; T272-L275 PolarHBondContact O-N 3.14Å; M273-L275 PolarHBondContact O-N 2.9Å; L275-F277 PolarHBondContact O-N 3.41Å; L275-I278 WeakPolarHBondContact O-CD1 3.35Å; L275-I278 WeakPolarHBondContact O-CG1 3.23Å; L275-I278 PolarHBondContact O-N 3.29Å; L275-A392 HydrophobicContact CB-CB 3.51Å; L275-I395 HydrophobicContact CD1-CB 4.25Å; L275-I395 HydrophobicContact CD1-CG2 3.82Å; L275-I395 HydrophobicContact CD2-CD1 4.31Å
276	F	98.6	Very high	97.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.2	-19.7	170.9	-60.9	-47.7	0	0	0	112.7	I199 I203 F206 T272 M273 I278 Q385 A392 F393	I199-F276 HydrophobicContact CG2-CB 4.4Å; I203-F276 HydrophobicContact CG1-CD2 3.78Å; I203-F276 HydrophobicContact CG1-CE2 4.15Å; F206-F276 HydrophobicContact CB-CE2 4.05Å; F206-F276 HydrophobicContact CB-CZ 3.99Å; F206-F276 HydrophobicContact CG-CE2 4.31Å; F206-F276 HydrophobicContact CG-CZ 4.41Å; T272-F276 HydrophobicContact CG2-CE2 3.98Å; T272-F276 HydrophobicContact CG2-CZ 4.2Å; T272-F276 PolarHBondContact O-N 3.32Å; M273-F276 WeakPolarHBondContact O-CA 3.42Å; M273-F276 WeakPolarHBondContact O-CB 3.46Å; M273-F276 PolarHBondContact O-N 3.23Å; F276-I278 VanDerWaalsContact C-N 3.34Å; F276-Q385 PolarHBondContact O-NE2 2.96Å; F276-A392 HydrophobicContact CD1-CB 3.62Å; F276-A392 HydrophobicContact CE1-CB 3.73Å; F276-F393 HydrophobicContact CE1-CD1 4.43Å; F276-F393 HydrophobicContact CE1-CD2 4.05Å; F276-F393 HydrophobicContact CE1-CE1 4.24Å; F276-F393 AromaticContact CE1-CE2 3.8Å; F276-F393 HydrophobicContact CE1-CE2 3.8Å; F276-F393 HydrophobicContact CE1-CG 4.36Å; F276-F393 AromaticContact CE1-CZ 3.92Å; F276-F393 HydrophobicContact CE1-CZ 3.92Å; F276-F393 HydrophobicContact CZ-CD1 4.31Å; F276-F393 AromaticContact CZ-CE1 3.84Å; F276-F393 HydrophobicContact CZ-CE1 3.84Å; F276-F393 HydrophobicContact CZ-CE2 4.1Å; F276-F393 AromaticContact CZ-CZ 3.72Å; F276-F393 HydrophobicContact CZ-CZ 3.72Å
277	F	98.6	Very high	97.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	13.3	174.8	-86	-115.1	0	0	0	114.1	F177 C178 I182 I199 F260 M273 L274 L275 Q280 V281	F177-F277 HydrophobicContact CE1-CD1 4.19Å; C178-F277 HydrophobicContact CB-CE1 4.05Å; C178-F277 HydrophobicContact CB-CZ 4.16Å; I182-F277 HydrophobicContact CD1-CE1 4.26Å; I182-F277 HydrophobicContact CD1-CZ 4.32Å; I182-F277 HydrophobicContact CG1-CE1 4.16Å; I199-F277 HydrophobicContact CD1-CD2 4.15Å; I199-F277 HydrophobicContact CD1-CE2 4.05Å; I199-F277 HydrophobicContact CD1-CG 4.48Å; I199-F277 HydrophobicContact CD1-CZ 4.26Å; I199-F277 HydrophobicContact CG2-CD2 4.16Å; I199-F277 HydrophobicContact CG2-CE2 3.69Å; F260-F277 HydrophobicContact CB-CE2 4.1Å; F260-F277 HydrophobicContact CB-CZ 4Å; F260-F277 AromaticContact CD2-CE2 3.97Å; F260-F277 HydrophobicContact CD2-CE2 3.97Å; F260-F277 AromaticContact CD2-CZ 3.53Å; F260-F277 HydrophobicContact CD2-CZ 3.53Å; F260-F277 HydrophobicContact CE2-CZ 4.27Å; F260-F277 HydrophobicContact CG-CE2 4.06Å; F260-F277 AromaticContact CG-CZ 3.98Å; F260-F277 HydrophobicContact CG-CZ 3.98Å; M273-F277 HydrophobicContact CG-CD2 4.42Å; M273-F277 HydrophobicContact CG-CE2 4.25Å; M273-F277 WeakPolarHBondContact O-CD2 3.34Å; M273-F277 PolarHBondContact O-N 3.4Å; L274-F277 CarbonylContact O-C 3.57Å; L274-F277 WeakPolarHBondContact O-CB 3.22Å; L274-F277 PolarHBondContact O-N 2.85Å; L274-F277 VanDerWaalsContact O-N 3.17Å; L275-F277 PolarHBondContact O-N 3.41Å; F277-Q280 VanDerWaalsContact C-OE1 3.25Å; F277-Q280 VanDerWaalsContact CA-OE1 3.23Å; F277-Q280 HydrophobicContact CB-CB 4.39Å; F277-Q280 HydrophobicContact CD1-CB 3.89Å; F277-Q280 HydrophobicContact CD1-CG 4Å; F277-Q280 WeakPolarHBondContact O-CB 3.35Å; F277-Q280 PolarHBondContact O-N 2.89Å; F277-Q280 PolarHBondContact O-OE1 2.75Å; F277-V281 HydrophobicContact CB-CG2 4.33Å; F277-V281 WeakPolarHBondContact O-CG2 3.29Å; F277-V281 PolarHBondContact O-N 3.06Å
278	I	98.6	Very high	97.4	Very high	42 Å²	42	32.8 Å²	32.8	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-47.8	-50.2	-177.6	-81.2	161.4	0	0	0	112.9	L275 F276 Q280 V281 V282 L391	L275-I278 WeakPolarHBondContact O-CD1 3.35Å; L275-I278 WeakPolarHBondContact O-CG1 3.23Å; L275-I278 PolarHBondContact O-N 3.29Å; F276-I278 VanDerWaalsContact C-N 3.34Å; I278-Q280 VanDerWaalsContact C-N 3.33Å; I278-Q280 PolarHBondContact O-N 3.3Å; I278-V281 PolarHBondContact O-N 3.22Å; I278-V282 HydrophobicContact CG2-CG2 4.41Å; I278-V282 WeakPolarHBondContact O-CB 3.38Å; I278-V282 VanDerWaalsContact O-CG2 3.28Å; I278-V282 WeakPolarHBondContact O-CG2 3.13Å; I278-V282 PolarHBondContact O-N 2.79Å; I278-L391 HydrophobicContact CD1-CD2 4.19Å; I278-L391 HydrophobicContact CD1-CG 4.44Å
279	P	98.6	Very high	97.6	Very high	7 Å²	7	30.3 Å²	30.3	5%	0.045	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-38.2	179.2	-24.6	36.4	0	0	0	113.3	V282 N283 L361 I384	P279-V282 PolarHBondContact O-N 3.36Å; P279-N283 WeakPolarHBondContact O-CB 3.36Å; P279-N283 PolarHBondContact O-N 3.01Å; P279-L361 HydrophobicContact CB-CD2 4.08Å; P279-I384 HydrophobicContact CB-CG2 4.3Å; P279-I384 HydrophobicContact CG-CG2 4.14Å
280	Q	98.8	Very high	97.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.4	-43.4	178	-66.8	71.9	20.1	0	0	110.8	A181 L185 F277 I278 N283 F284	A181-Q280 HydrophobicContact CB-CB 3.97Å; L185-Q280 HydrophobicContact CD2-CG 4.25Å; F277-Q280 VanDerWaalsContact C-OE1 3.25Å; F277-Q280 VanDerWaalsContact CA-OE1 3.23Å; F277-Q280 HydrophobicContact CB-CB 4.39Å; F277-Q280 HydrophobicContact CD1-CB 3.89Å; F277-Q280 HydrophobicContact CD1-CG 4Å; F277-Q280 WeakPolarHBondContact O-CB 3.35Å; F277-Q280 PolarHBondContact O-N 2.89Å; F277-Q280 PolarHBondContact O-OE1 2.75Å; I278-Q280 VanDerWaalsContact C-N 3.33Å; I278-Q280 PolarHBondContact O-N 3.3Å; Q280-N283 PolarHBondContact O-N 2.86Å; Q280-F284 VanDerWaalsContact O-CB 3.28Å; Q280-F284 WeakPolarHBondContact O-CB 3.43Å; Q280-F284 PolarHBondContact O-N 3.39Å
281	V	98.6	Very high	97.7	Very high	43 Å²	43	32 Å²	32	26%	0.261	17%	0.165	S	C	.	.	H	α-helix	trans	-60.5	-47.2	174.3	172.5	0	0	0	0	110.3	F177 F277 I278 F284 I285	F177-V281 HydrophobicContact CE1-CG2 3.98Å; F177-V281 HydrophobicContact CZ-CB 4.35Å; F177-V281 HydrophobicContact CZ-CG2 3.53Å; F277-V281 HydrophobicContact CB-CG2 4.33Å; F277-V281 WeakPolarHBondContact O-CG2 3.29Å; F277-V281 PolarHBondContact O-N 3.06Å; I278-V281 PolarHBondContact O-N 3.22Å; V281-F284 PolarHBondContact O-N 3.45Å; V281-I285 HydrophobicContact CG1-CD1 3.73Å; V281-I285 HydrophobicContact CG1-CG1 4.42Å; V281-I285 VanDerWaalsContact O-CG1 3.32Å; V281-I285 WeakPolarHBondContact O-CG1 3.44Å; V281-I285 PolarHBondContact O-N 2.96Å
282	V	98.5	Very high	97.8	Very high	70 Å²	70	34.1 Å²	34.1	42%	0.424	17%	0.174	S	C	.	.	H	α-helix	trans	-61.4	-46.5	177.5	170	0	0	0	0	110.9	I278 P279 F284 I285 Y286 L361	I278-V282 HydrophobicContact CG2-CG2 4.41Å; I278-V282 WeakPolarHBondContact O-CB 3.38Å; I278-V282 VanDerWaalsContact O-CG2 3.28Å; I278-V282 WeakPolarHBondContact O-CG2 3.13Å; I278-V282 PolarHBondContact O-N 2.79Å; P279-V282 PolarHBondContact O-N 3.36Å; V282-F284 VanDerWaalsContact C-N 3.35Å; V282-F284 PolarHBondContact O-N 3.29Å; V282-I285 PolarHBondContact O-N 3.37Å; V282-Y286 VanDerWaalsContact O-CB 3.26Å; V282-Y286 WeakPolarHBondContact O-CB 3.36Å; V282-Y286 PolarHBondContact O-N 2.96Å; V282-L361 HydrophobicContact CG1-CD1 4.35Å
283	N	98.7	Very high	97.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-42.1	176.9	-178.7	63.4	0	0	0	112.2	I184 L185 P279 Q280 S287 T360 L361	I184-N283 PolarHBondContact O-ND2 3.39Å; L185-N283 HydrophobicContact CD1-CB 4.08Å; L185-N283 HydrophobicContact CD2-CB 4.27Å; P279-N283 WeakPolarHBondContact O-CB 3.36Å; P279-N283 PolarHBondContact O-N 3.01Å; Q280-N283 PolarHBondContact O-N 2.86Å; N283-S287 WeakPolarHBondContact O-CB 3.35Å; N283-S287 PolarHBondContact O-N 3.33Å; N283-S287 PolarHBondContact O-OG 3.5Å; N283-T360 WeakPolarHBondContact OD1-CA 3.48Å; N283-L361 HydrophobicContact CB-CB 3.89Å; N283-L361 PolarHBondContact OD1-N 3.06Å
284	F	98.3	Very high	97.7	Very high	62 Å²	62	42.3 Å²	42.3	27%	0.272	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-52.7	178.1	177.9	-102	0	0	0	111	F177 I184 Q280 V281 V282 Y286 S287 L288 L291	F177-F284 HydrophobicContact CD2-CD1 4.42Å; F177-F284 HydrophobicContact CD2-CG 4.49Å; F177-F284 HydrophobicContact CE2-CB 4.08Å; F177-F284 AromaticContact CE2-CD1 3.89Å; F177-F284 HydrophobicContact CE2-CD1 3.89Å; F177-F284 HydrophobicContact CE2-CD2 4.42Å; F177-F284 HydrophobicContact CE2-CE1 4.43Å; F177-F284 AromaticContact CE2-CG 3.88Å; F177-F284 HydrophobicContact CE2-CG 3.88Å; I184-F284 HydrophobicContact CD1-CB 4.1Å; I184-F284 HydrophobicContact CD1-CD2 3.75Å; I184-F284 HydrophobicContact CD1-CG 4.42Å; Q280-F284 VanDerWaalsContact O-CB 3.28Å; Q280-F284 WeakPolarHBondContact O-CB 3.43Å; Q280-F284 PolarHBondContact O-N 3.39Å; V281-F284 PolarHBondContact O-N 3.45Å; V282-F284 VanDerWaalsContact C-N 3.35Å; V282-F284 PolarHBondContact O-N 3.29Å; F284-Y286 PolarHBondContact O-N 3.45Å; F284-S287 CarbonylContact O-C 2.99Å; F284-S287 WeakPolarHBondContact O-CB 3.41Å; F284-S287 PolarHBondContact O-N 2.92Å; F284-S287 VanDerWaalsContact O-N 3.1Å; F284-L288 HydrophobicContact CD1-CD2 4.19Å; F284-L288 HydrophobicContact CD1-CG 4.5Å; F284-L288 HydrophobicContact CE1-CD1 4.49Å; F284-L288 HydrophobicContact CE1-CD2 3.64Å; F284-L288 HydrophobicContact CE1-CG 4.32Å; F284-L288 HydrophobicContact CE2-CD2 4.11Å; F284-L288 HydrophobicContact CZ-CD2 3.59Å; F284-L288 WeakPolarHBondContact O-CG 3.23Å; F284-L288 PolarHBondContact O-N 3.38Å; F284-L291 HydrophobicContact CD2-CD1 4.16Å; F284-L291 HydrophobicContact CE2-CD1 4.2Å
285	I	98.2	Very high	97.7	Very high	103 Å²	103	40.1 Å²	40.1	53%	0.528	20%	0.201	S	C	.	.	H	α-helix	trans	-59.1	-47.1	178.8	-67	170.7	0	0	0	110.7	V281 V282 S287 L288	V281-I285 HydrophobicContact CG1-CD1 3.73Å; V281-I285 HydrophobicContact CG1-CG1 4.42Å; V281-I285 VanDerWaalsContact O-CG1 3.32Å; V281-I285 WeakPolarHBondContact O-CG1 3.44Å; V281-I285 PolarHBondContact O-N 2.96Å; V282-I285 PolarHBondContact O-N 3.37Å; I285-S287 VanDerWaalsContact C-N 3.26Å; I285-S287 PolarHBondContact O-N 3.28Å; I285-L288 WeakPolarHBondContact O-CB 3.31Å; I285-L288 PolarHBondContact O-N 2.95Å
286	Y	98.3	Very high	97.6	Very high	32 Å²	32	39.8 Å²	39.8	13%	0.125	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-34.4	177.9	-177.1	-126.4	0	0	0	112.1	V282 F284 P289 V340 N357 M359 T360 L364	V282-Y286 VanDerWaalsContact O-CB 3.26Å; V282-Y286 WeakPolarHBondContact O-CB 3.36Å; V282-Y286 PolarHBondContact O-N 2.96Å; F284-Y286 PolarHBondContact O-N 3.45Å; Y286-P289 WeakPolarHBondContact O-CD 3.45Å; Y286-V340 HydrophobicContact CE2-CB 4.34Å; Y286-V340 HydrophobicContact CE2-CG2 4.22Å; Y286-V340 PolarHBondContact OH-O 2.87Å; Y286-N357 PolarHBondContact OH-ND2 2.86Å; Y286-M359 VanDerWaalsContact CD1-C 3.48Å; Y286-M359 HydrophobicContact CD1-CB 4.21Å; Y286-M359 VanDerWaalsContact CE1-C 3.41Å; Y286-M359 VanDerWaalsContact CE1-CA 3.41Å; Y286-M359 HydrophobicContact CE1-CB 3.99Å; Y286-M359 HydrophobicContact CE2-CB 4.34Å; Y286-M359 HydrophobicContact CE2-CG 4.36Å; Y286-M359 HydrophobicContact CG-CB 4.48Å; Y286-M359 WeakPolarHBondContact O-CB 3.39Å; Y286-T360 WeakPolarHBondContact CE1-O 3.2Å; Y286-L364 HydrophobicContact CE1-CB 4.14Å
287	S	98.2	Very high	97.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-75.6	-18.6	176.7	-72.1	0	0	0	0	114.8	N283 F284 I285 P289 Q290 L291 R301 M359	N283-S287 WeakPolarHBondContact O-CB 3.35Å; N283-S287 PolarHBondContact O-N 3.33Å; N283-S287 PolarHBondContact O-OG 3.5Å; F284-S287 CarbonylContact O-C 2.99Å; F284-S287 WeakPolarHBondContact O-CB 3.41Å; F284-S287 PolarHBondContact O-N 2.92Å; F284-S287 VanDerWaalsContact O-N 3.1Å; I285-S287 VanDerWaalsContact C-N 3.26Å; I285-S287 PolarHBondContact O-N 3.28Å; S287-P289 VanDerWaalsContact C-CD 3.43Å; S287-Q290 PolarHBondContact O-N 3.46Å; S287-L291 WeakPolarHBondContact O-CG 3.4Å; S287-L291 PolarHBondContact O-N 2.77Å; S287-R301 PolarHBondContact OG-NH1 2.99Å; S287-R301 VanDerWaalsContact OG-NH1 3.08Å; S287-R301 PolarHBondContact OG-NH2 2.61Å; S287-M359 WeakPolarHBondContact CA-O 3.27Å; S287-M359 PolarHBondContact OG-O 2.88Å
288	L	97.5	Very high	97.2	Very high	43 Å²	43	43.5 Å²	43.5	23%	0.225	23%	0.226	C	C	.	.	H	α-helix	trans	-51.7	-43.5	-171.4	-75.5	179.5	0	0	0	114.6	F284 I285 Q290 L291 F292	F284-L288 HydrophobicContact CD1-CD2 4.19Å; F284-L288 HydrophobicContact CD1-CG 4.5Å; F284-L288 HydrophobicContact CE1-CD1 4.49Å; F284-L288 HydrophobicContact CE1-CD2 3.64Å; F284-L288 HydrophobicContact CE1-CG 4.32Å; F284-L288 HydrophobicContact CE2-CD2 4.11Å; F284-L288 HydrophobicContact CZ-CD2 3.59Å; F284-L288 WeakPolarHBondContact O-CG 3.23Å; F284-L288 PolarHBondContact O-N 3.38Å; I285-L288 WeakPolarHBondContact O-CB 3.31Å; I285-L288 PolarHBondContact O-N 2.95Å; L288-Q290 PolarHBondContact O-N 3.43Å; L288-L291 PolarHBondContact O-N 3.33Å; L288-F292 HydrophobicContact CB-CD2 4.4Å; L288-F292 HydrophobicContact CB-CE2 4.4Å; L288-F292 HydrophobicContact CD2-CD2 4.3Å; L288-F292 HydrophobicContact CD2-CE1 4.44Å; L288-F292 HydrophobicContact CD2-CE2 3.65Å; L288-F292 HydrophobicContact CD2-CZ 3.73Å; L288-F292 HydrophobicContact CG-CE2 4.39Å; L288-F292 WeakPolarHBondContact O-CB 3.43Å; L288-F292 PolarHBondContact O-N 3.24Å
289	P	97.3	Very high	96.8	Very high	19 Å²	19	52 Å²	52	12%	0.123	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-35	179.3	-24.7	35.9	0	0	0	113	Y286 S287 I294 I295 I331 M359	Y286-P289 WeakPolarHBondContact O-CD 3.45Å; S287-P289 VanDerWaalsContact C-CD 3.43Å; P289-I294 WeakPolarHBondContact O-CB 3.35Å; P289-I294 PolarHBondContact O-N 2.95Å; P289-I295 HydrophobicContact CB-CD1 3.81Å; P289-I295 HydrophobicContact CB-CG1 4.24Å; P289-I295 PolarHBondContact O-N 3.38Å; P289-I331 HydrophobicContact CB-CG2 4.05Å; P289-I331 HydrophobicContact CG-CG2 3.78Å; P289-M359 HydrophobicContact CB-SD 3.87Å; P289-M359 HydrophobicContact CG-SD 3.98Å
290	Q	97.4	Very high	96.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-79.6	-43.3	175.1	-70.6	-171.6	-46.3	0	0	111.8	S287 L288 F292 H293 I295 C297 R301 N358 M359	S287-Q290 PolarHBondContact O-N 3.46Å; L288-Q290 PolarHBondContact O-N 3.43Å; Q290-F292 VanDerWaalsContact C-N 3.3Å; Q290-F292 PolarHBondContact O-N 2.82Å; Q290-H293 WeakPolarHBondContact O-CA 3.43Å; Q290-H293 PolarHBondContact O-N 3.39Å; Q290-I295 HydrophobicContact CG-CB 4.46Å; Q290-I295 HydrophobicContact CG-CG2 4.39Å; Q290-C297 HydrophobicContact CB-CB 3.96Å; Q290-C297 WeakPolarHBondContact O-CB 3.48Å; Q290-R301 VanDerWaalsContact OE1-NH1 3.09Å; Q290-N358 PolarHBondContact NE2-OD1 3.04Å; Q290-M359 HydrophobicContact CG-CB 4.24Å; Q290-M359 HydrophobicContact CG-CG 4.3Å; Q290-M359 HydrophobicContact CG-SD 4.13Å
291	L	95.6	Very high	96.3	Very high	52 Å²	52	58.3 Å²	58.3	27%	0.272	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-38.6	-179.8	-67.2	173.8	0	0	0	112.4	I184 F284 S287 L288 H293	I184-L291 HydrophobicContact CD1-CD1 3.95Å; F284-L291 HydrophobicContact CD2-CD1 4.16Å; F284-L291 HydrophobicContact CE2-CD1 4.2Å; S287-L291 WeakPolarHBondContact O-CG 3.4Å; S287-L291 PolarHBondContact O-N 2.77Å; L288-L291 PolarHBondContact O-N 3.33Å; L291-H293 PolarHBondContact O-N 3.37Å; L291-H293 PolarHBondContact O-ND1 3.04Å
292	F	95.4	Very high	96.1	Very high	138 Å²	138	57.9 Å²	57.9	61%	0.605	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	6.6	174.6	-62.4	-29.7	0	0	0	114	L288 Q290 I294	L288-F292 HydrophobicContact CB-CD2 4.4Å; L288-F292 HydrophobicContact CB-CE2 4.4Å; L288-F292 HydrophobicContact CD2-CD2 4.3Å; L288-F292 HydrophobicContact CD2-CE1 4.44Å; L288-F292 HydrophobicContact CD2-CE2 3.65Å; L288-F292 HydrophobicContact CD2-CZ 3.73Å; L288-F292 HydrophobicContact CG-CE2 4.39Å; L288-F292 WeakPolarHBondContact O-CB 3.43Å; L288-F292 PolarHBondContact O-N 3.24Å; Q290-F292 VanDerWaalsContact C-N 3.3Å; Q290-F292 PolarHBondContact O-N 2.82Å; F292-I294 HydrophobicContact CB-CD1 4.23Å; F292-I294 HydrophobicContact CB-CG1 4.1Å; F292-I294 PolarHBondContact O-N 2.94Å; F292-I294 VanDerWaalsContact O-N 3.09Å
293	H	95.1	Very high	96	Very high	137 Å²	137	54.6 Å²	54.6	63%	0.634	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	24.5	178.6	-60.9	67.4	0	0	0	113.7	Q290 L291 I295	Q290-H293 WeakPolarHBondContact O-CA 3.43Å; Q290-H293 PolarHBondContact O-N 3.39Å; L291-H293 PolarHBondContact O-N 3.37Å; L291-H293 PolarHBondContact O-ND1 3.04Å; H293-I295 VanDerWaalsContact C-N 3.27Å
294	I	96.5	Very high	95.9	Very high	45 Å²	45	62 Å²	62	23%	0.231	29%	0.287	C	S	.	.	S	Bend	trans	-68.3	-36.3	169.9	-56.7	172.1	0	0	0	109.2	P289 F292 L327 I331	P289-I294 WeakPolarHBondContact O-CB 3.35Å; P289-I294 PolarHBondContact O-N 2.95Å; F292-I294 HydrophobicContact CB-CD1 4.23Å; F292-I294 HydrophobicContact CB-CG1 4.1Å; F292-I294 PolarHBondContact O-N 2.94Å; F292-I294 VanDerWaalsContact O-N 3.09Å; I294-L327 HydrophobicContact CD1-CD2 4.2Å; I294-L327 HydrophobicContact CG2-CB 4.48Å; I294-L327 HydrophobicContact CG2-CD2 4.26Å; I294-L327 HydrophobicContact CG2-CG 4.14Å; I294-I331 HydrophobicContact CD1-CD1 4.36Å; I294-I331 HydrophobicContact CG2-CD1 3.99Å
295	I	96.2	Very high	95.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-114.8	138.4	167.2	-64.8	170.4	0	0	0	107.7	P289 Q290 H293 C297 F319 L324 I331 L332 M359	P289-I295 HydrophobicContact CB-CD1 3.81Å; P289-I295 HydrophobicContact CB-CG1 4.24Å; P289-I295 PolarHBondContact O-N 3.38Å; Q290-I295 HydrophobicContact CG-CB 4.46Å; Q290-I295 HydrophobicContact CG-CG2 4.39Å; H293-I295 VanDerWaalsContact C-N 3.27Å; I295-C297 PolarHBondContact O-N 3.22Å; I295-F319 HydrophobicContact CG2-CE1 4.03Å; I295-F319 HydrophobicContact CG2-CZ 3.97Å; I295-L324 HydrophobicContact CG1-CD1 4.21Å; I295-I331 HydrophobicContact CD1-CG2 4.05Å; I295-L332 HydrophobicContact CD1-CD2 3.58Å; I295-L332 HydrophobicContact CD1-CG 3.78Å; I295-L332 HydrophobicContact CG1-CD2 4.42Å; I295-L332 HydrophobicContact CG1-CG 4.35Å; I295-M359 HydrophobicContact CD1-CE 3.4Å; I295-M359 VanDerWaalsContact CD1-CE 3.4Å; I295-M359 HydrophobicContact CD1-SD 4.01Å
296	P	95.7	Very high	95.7	Very high	43 Å²	43	58.2 Å²	58.2	28%	0.279	27%	0.271	S	S	.	.			trans	-53	125.1	179.9	-31.3	39.2	0	0	0	113.4	S317 F319	P296-S317 PolarHBondContact O-OG 3.49Å; P296-F319 HydrophobicContact CB-CB 4.21Å; P296-F319 HydrophobicContact CB-CD1 3.82Å; P296-F319 HydrophobicContact CB-CE1 4.45Å; P296-F319 HydrophobicContact CB-CG 4.09Å; P296-F319 HydrophobicContact CG-CB 3.82Å; P296-F319 HydrophobicContact CG-CD1 3.74Å; P296-F319 HydrophobicContact CG-CD2 4.01Å; P296-F319 HydrophobicContact CG-CE1 4.3Å; P296-F319 HydrophobicContact CG-CG 3.58Å
297	C	95.9	Very high	95.4	Very high	36 Å²	36	61.1 Å²	61.1	24%	0.243	29%	0.293	C	S	.	.			trans	-107.3	113.6	-176.1	-171.6	0	0	0	0	110.2	Q290 I295	Q290-C297 HydrophobicContact CB-CB 3.96Å; Q290-C297 WeakPolarHBondContact O-CB 3.48Å; I295-C297 PolarHBondContact O-N 3.22Å
298	P	94.2	Very high	95.2	Very high	41 Å²	41	68.5 Å²	68.5	27%	0.266	33%	0.333	S	S	.	.			trans	-71.4	156	174.3	30.1	-32.2	0	0	0	110.4	H300 R301 N358	P298-H300 PolarHBondContact O-N 3.5Å; P298-R301 HydrophobicContact CG-CG 3.94Å; P298-N358 WeakPolarHBondContact CD-OD1 3.48Å; P298-N358 VanDerWaalsContact CG-OD1 3.23Å; P298-N358 WeakPolarHBondContact CG-OD1 3.45Å
299	R	89.8	Confident	95	Very high	222 Å²	222	69.6 Å²	69.6	84%	0.838	34%	0.342	S	S	*	.	S	Bend	trans	-55.7	-40.6	177.5	-177.1	176.9	-179.4	131.8	2	112.4
300	H	91.7	Very high	94.9	Very high	107 Å²	107	70.4 Å²	70.4	50%	0.495	35%	0.353	S	S	.	.			trans	-117.5	122.3	-179.8	-69	-64.3	0	0	0	109.7	P298 L302	P298-H300 PolarHBondContact O-N 3.5Å; H300-L302 HydrophobicContact CB-CD2 3.6Å; H300-L302 HydrophobicContact CB-CG 4.43Å
301	R	95.6	Very high	94.9	Very high	31 Å²	31	74.7 Å²	74.7	12%	0.117	37%	0.372	C	S	.	.			trans	-109.8	5.9	179.4	-63.4	-171	-65.9	150.4	6.7	113.3	S287 Q290 P298 S315 N358 M359 T360 N363	S287-R301 PolarHBondContact OG-NH1 2.99Å; S287-R301 VanDerWaalsContact OG-NH1 3.08Å; S287-R301 PolarHBondContact OG-NH2 2.61Å; Q290-R301 VanDerWaalsContact OE1-NH1 3.09Å; P298-R301 HydrophobicContact CG-CG 3.94Å; R301-S315 PolarHBondContact O-OG 2.61Å; R301-N358 HydrophobicContact CB-CB 4.16Å; R301-N358 HydrophobicContact CG-CB 4.41Å; R301-M359 PolarHBondContact NH1-O 3.2Å; R301-M359 VanDerWaalsContact NH1-O 3.14Å; R301-T360 HydrophobicContact CB-CG2 3.87Å; R301-N363 PolarHBondContact O-ND2 3.5Å
302	L	94.6	Very high	95	Very high	34 Å²	34	72.2 Å²	72.2	18%	0.178	36%	0.359	C	S	.	.	S	Bend	trans	-58.3	154.5	173.8	53.2	133.5	0	0	0	111.3	L44 N45 H300 S315	L44-L302 HydrophobicContact CB-CD1 3.6Å; L44-L302 HydrophobicContact CD1-CD1 3.98Å; L44-L302 HydrophobicContact CD1-CD2 3.8Å; L44-L302 HydrophobicContact CG-CD1 4.45Å; N45-L302 WeakPolarHBondContact OD1-CD1 3.43Å; H300-L302 HydrophobicContact CB-CD2 3.6Å; H300-L302 HydrophobicContact CB-CG 4.43Å; L302-S315 WeakPolarHBondContact O-CB 3.22Å; L302-S315 PolarHBondContact O-OG 3.4Å
303	P	96.9	Very high	95.1	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.013	34%	0.335	C	S	.	.			trans	-59.7	167.6	172.7	28.7	-38.9	0	0	0	112	N45 I188 L312 G313 I362 L366 L377	N45-P303 PolarHBondContact OD1-O 3.32Å; I188-P303 HydrophobicContact CG2-CG 3.82Å; P303-L312 HydrophobicContact CB-CB 4.09Å; P303-L312 HydrophobicContact CG-CB 4.27Å; P303-L312 HydrophobicContact CG-CD1 3.79Å; P303-L312 HydrophobicContact CG-CG 4.44Å; P303-G313 WeakPolarHBondContact CA-O 3.46Å; P303-G313 WeakPolarHBondContact CB-O 3.45Å; P303-I362 HydrophobicContact CG-CG2 4.06Å; P303-L366 HydrophobicContact CB-CD1 3.47Å; P303-L366 VanDerWaalsContact CB-CD1 3.47Å; P303-L366 HydrophobicContact CG-CD1 4.32Å; P303-L377 HydrophobicContact CG-CD2 4.43Å
304	R	94.9	Very high	95.3	Very high	154 Å²	154	61.3 Å²	61.3	58%	0.581	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.2	178.1	-72.4	-176	-177.5	176.5	4	110.7	L312 G313	R304-L312 WeakPolarHBondContact O-CA 3.35Å; R304-G313 PolarHBondContact N-O 3.48Å; R304-G313 PolarHBondContact O-N 3.1Å
305	L	96.6	Very high	95.3	Very high	48 Å²	48	59.3 Å²	59.3	25%	0.251	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	128.3	169.5	-179.2	71	0	0	0	110.2	N45 T47 L312	N45-L305 WeakPolarHBondContact O-CD2 3.25Å; T47-L305 HydrophobicContact CG2-CD2 3.9Å; L305-L312 HydrophobicContact CB-CD2 4.04Å; L305-L312 HydrophobicContact CD1-CD2 4.17Å
306	D	95.7	Very high	95.3	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.203	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	111.3	163.2	179.8	-16.9	0	0	0	108.2	D308 T309 G310 K311 Q371	D306-D308 PolarHBondContact O-N 3.36Å; D306-D308 PolarHBondContact OD1-N 2.89Å; D306-T309 WeakPolarHBondContact CB-OG1 3.43Å; D306-T309 VanDerWaalsContact CG-OG1 3.26Å; D306-T309 PolarHBondContact O-N 3.48Å; D306-T309 PolarHBondContact OD1-N 3.39Å; D306-T309 WeakPolarHBondContact OD2-CG2 3.18Å; D306-T309 PolarHBondContact OD2-OG1 2.99Å; D306-G310 WeakPolarHBondContact O-CA 3.24Å; D306-G310 PolarHBondContact O-N 3.31Å; D306-K311 PolarHBondContact N-O 3.2Å; D306-Q371 PolarHBondContact OD2-NE2 3.18Å; D306-Q371 PolarHBondContact OD2-OE1 3.08Å
307	P	92.4	Very high	95.3	Very high	93 Å²	93	59.1 Å²	59.1	60%	0.604	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-23.2	-175.4	28.4	-33.9	0	0	0	112.9
308	D	93.9	Very high	95.3	Very high	155 Å²	155	62.4 Å²	62.4	83%	0.829	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-36.8	-178.4	-61.9	-35.8	0	0	0	110.9	D306	D306-D308 PolarHBondContact O-N 3.36Å; D306-D308 PolarHBondContact OD1-N 2.89Å
309	T	94.6	Very high	95.3	Very high	67 Å²	67	61.3 Å²	61.3	41%	0.411	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-18.3	-179.3	67.2	0	0	0	0	113.9	D306 K311 Q371	D306-T309 WeakPolarHBondContact CB-OG1 3.43Å; D306-T309 VanDerWaalsContact CG-OG1 3.26Å; D306-T309 PolarHBondContact O-N 3.48Å; D306-T309 PolarHBondContact OD1-N 3.39Å; D306-T309 WeakPolarHBondContact OD2-CG2 3.18Å; D306-T309 PolarHBondContact OD2-OG1 2.99Å; T309-K311 PolarHBondContact O-N 2.85Å; T309-K311 PolarHBondContact OG1-N 2.98Å; T309-Q371 PolarHBondContact OG1-OE1 3.01Å
310	G	94.4	Very high	95.4	Very high	35 Å²	35	53.9 Å²	53.9	36%	0.361	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	17.6	-172.6	0	0	0	0	0	113.7	D306	D306-G310 WeakPolarHBondContact O-CA 3.24Å; D306-G310 PolarHBondContact O-N 3.31Å
311	K	97.6	Very high	95.4	Very high	90 Å²	90	53.5 Å²	53.5	39%	0.391	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	159.1	-177.4	-63.2	179	-174.9	175.8	0	111.5	D306 T309 Q371	D306-K311 PolarHBondContact N-O 3.2Å; T309-K311 PolarHBondContact O-N 2.85Å; T309-K311 PolarHBondContact OG1-N 2.98Å; K311-Q371 HydrophobicContact CB-CB 3.97Å; K311-Q371 HydrophobicContact CD-CB 4.18Å
312	L	98.3	Very high	95.1	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129	174.3	-62.3	-176.8	0	0	0	110.3	N45 I188 P303 R304 L305 L366 Q371 I372 E374 L377	N45-L312 HydrophobicContact CB-CD2 3.92Å; I188-L312 HydrophobicContact CG2-CD1 3.94Å; P303-L312 HydrophobicContact CB-CB 4.09Å; P303-L312 HydrophobicContact CG-CB 4.27Å; P303-L312 HydrophobicContact CG-CD1 3.79Å; P303-L312 HydrophobicContact CG-CG 4.44Å; R304-L312 WeakPolarHBondContact O-CA 3.35Å; L305-L312 HydrophobicContact CB-CD2 4.04Å; L305-L312 HydrophobicContact CD1-CD2 4.17Å; L312-L366 HydrophobicContact CB-CD1 4.49Å; L312-L366 WeakPolarHBondContact O-CD2 3.47Å; L312-Q371 VanDerWaalsContact O-CA 3.29Å; L312-Q371 WeakPolarHBondContact O-CA 3.4Å; L312-I372 WeakPolarHBondContact CB-O 3.49Å; L312-I372 PolarHBondContact N-O 3Å; L312-I372 PolarHBondContact O-N 2.89Å; L312-E374 HydrophobicContact CD1-CB 3.61Å; L312-E374 HydrophobicContact CD1-CG 3.69Å; L312-E374 HydrophobicContact CG-CB 4.14Å; L312-L377 HydrophobicContact CB-CD2 4.34Å; L312-L377 HydrophobicContact CD1-CD2 4Å
313	G	97.6	Very high	94.9	Very high	11 Å²	11	62.8 Å²	62.8	11%	0.113	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	172.2	170.4	0	0	0	0	0	112.1	P303 R304	P303-G313 WeakPolarHBondContact CA-O 3.46Å; P303-G313 WeakPolarHBondContact CB-O 3.45Å; R304-G313 PolarHBondContact N-O 3.48Å; R304-G313 PolarHBondContact O-N 3.1Å
314	M	97.6	Very high	94.7	Very high	35 Å²	35	63.8 Å²	63.8	17%	0.172	32%	0.321	C	S	.	.			trans	-59.2	144.7	176.4	-69.2	-178.3	-78.8	0	0	111.5	Y316 E342 N357 N363 L366 K367	M314-Y316 HydrophobicContact CB-CE2 3.81Å; M314-Y316 VanDerWaalsContact CE-OH 3.24Å; M314-Y316 WeakPolarHBondContact CE-OH 3.23Å; M314-E342 WeakPolarHBondContact CE-OE2 3.4Å; M314-N357 HydrophobicContact CB-CB 4.49Å; M314-N357 HydrophobicContact SD-CB 4.01Å; M314-N363 VanDerWaalsContact CA-OD1 3.28Å; M314-N363 WeakPolarHBondContact CA-OD1 3.41Å; M314-L366 HydrophobicContact CG-CB 3.8Å; M314-K367 HydrophobicContact CE-CB 4.39Å; M314-K367 HydrophobicContact CE-CG 4.43Å; M314-K367 VanDerWaalsContact SD-CA 3.54Å; M314-K367 HydrophobicContact SD-CB 3.52Å; M314-K367 VanDerWaalsContact SD-CB 3.52Å; M314-K367 HydrophobicContact SD-CG 3.91Å
315	S	97.1	Very high	94.7	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.021	31%	0.312	C	S	.	.			trans	-99.7	150.5	166.8	65.6	0	0	0	0	110.4	R301 L302 N357 N358 N363	R301-S315 PolarHBondContact O-OG 2.61Å; L302-S315 WeakPolarHBondContact O-CB 3.22Å; L302-S315 PolarHBondContact O-OG 3.4Å; S315-N357 CarbonylContact O-C 3.53Å; S315-N357 WeakPolarHBondContact O-CA 3.25Å; S315-N358 PolarHBondContact O-N 2.9Å; S315-N358 PolarHBondContact OG-ND2 3.48Å; S315-N363 PolarHBondContact N-OD1 3.11Å; S315-N363 PolarHBondContact OG-OD1 2.91Å
316	Y	96.8	Very high	94.6	Very high	29 Å²	29	65.5 Å²	65.5	11%	0.114	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	153.4	-174	-64	-102.1	0	0	0	111.6	M314 E342 R344 E355 C356 N357	M314-Y316 HydrophobicContact CB-CE2 3.81Å; M314-Y316 VanDerWaalsContact CE-OH 3.24Å; M314-Y316 WeakPolarHBondContact CE-OH 3.23Å; Y316-E342 HydrophobicContact CE1-CG 4.4Å; Y316-E342 PolarHBondContact OH-OE1 3.41Å; Y316-E342 PolarHBondContact OH-OE2 3.42Å; Y316-R344 PolarHBondContact OH-NH2 3.4Å; Y316-R344 VanDerWaalsContact OH-NH2 3.07Å; Y316-E355 HydrophobicContact CD1-CG 3.98Å; Y316-E355 HydrophobicContact CG-CG 4.1Å; Y316-C356 CarbonylContact C-O 3.5Å; Y316-C356 VanDerWaalsContact CA-O 3.25Å; Y316-C356 WeakPolarHBondContact CA-O 3.42Å; Y316-N357 HydrophobicContact CD1-CB 4.03Å; Y316-N357 HydrophobicContact CE1-CB 3.92Å
317	S	96	Very high	94.6	Very high	10 Å²	10	68.2 Å²	68.2	7%	0.07	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114.9	171.7	-173.2	0	0	0	0	108.6	P296 F319 E355 C356	P296-S317 PolarHBondContact O-OG 3.49Å; S317-F319 WeakPolarHBondContact O-CE1 3.46Å; S317-E355 WeakPolarHBondContact O-CA 3.33Å; S317-C356 PolarHBondContact N-O 3.01Å; S317-C356 PolarHBondContact O-N 2.89Å; S317-C356 VanDerWaalsContact O-N 3.07Å
318	K	94.7	Very high	94.7	Very high	105 Å²	105	63.8 Å²	63.8	46%	0.457	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.8	178.3	-176.4	179.7	178	-177.1	0	109.7	D348 F353 I354 E355	K318-D348 IonicContact NZ-OD2 2.69Å; K318-D348 PolarHBondContact NZ-OD2 3.03Å; K318-F353 HydrophobicContact CD-CD2 4.12Å; K318-F353 HydrophobicContact CD-CE2 4.38Å; K318-F353 VanDerWaalsContact CE-CD2 3.46Å; K318-F353 HydrophobicContact CG-CD2 3.96Å; K318-I354 WeakPolarHBondContact CA-O 3.2Å; K318-E355 HydrophobicContact CB-CB 4.24Å; K318-E355 HydrophobicContact CB-CG 4.25Å; K318-E355 HydrophobicContact CG-CB 4.36Å
319	F	94	Very high	94.8	Very high	18 Å²	18	59.3 Å²	59.3	8%	0.079	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	160.5	-179.5	46.4	-91.9	0	0	0	111.4	I295 P296 S317 L324 L332 F353 I354	I295-F319 HydrophobicContact CG2-CE1 4.03Å; I295-F319 HydrophobicContact CG2-CZ 3.97Å; P296-F319 HydrophobicContact CB-CB 4.21Å; P296-F319 HydrophobicContact CB-CD1 3.82Å; P296-F319 HydrophobicContact CB-CE1 4.45Å; P296-F319 HydrophobicContact CB-CG 4.09Å; P296-F319 HydrophobicContact CG-CB 3.82Å; P296-F319 HydrophobicContact CG-CD1 3.74Å; P296-F319 HydrophobicContact CG-CD2 4.01Å; P296-F319 HydrophobicContact CG-CE1 4.3Å; P296-F319 HydrophobicContact CG-CG 3.58Å; S317-F319 WeakPolarHBondContact O-CE1 3.46Å; F319-L324 HydrophobicContact CE2-CD1 4Å; F319-L324 HydrophobicContact CE2-CD2 4.31Å; F319-L332 HydrophobicContact CE2-CD1 4.39Å; F319-L332 HydrophobicContact CZ-CD1 4.17Å; F319-F353 WeakPolarHBondContact O-CA 3.49Å; F319-I354 HydrophobicContact CD2-CB 4.4Å; F319-I354 HydrophobicContact CE2-CB 3.92Å; F319-I354 HydrophobicContact CE2-CG2 4.11Å; F319-I354 HydrophobicContact CZ-CB 4.36Å; F319-I354 HydrophobicContact CZ-CG2 4.11Å; F319-I354 PolarHBondContact N-O 3.37Å; F319-I354 PolarHBondContact O-N 3.47Å
320	K	92.7	Very high	94.9	Very high	65 Å²	65	60.7 Å²	60.7	28%	0.283	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.3	177.9	-56.7	-174.8	176.7	-172.4	0	109.1	K322 D323 D350	K320-K322 HydrophobicContact CB-CG 4.04Å; K320-K322 PolarHBondContact O-N 2.78Å; K320-D323 WeakPolarHBondContact CB-OD2 3.25Å; K320-D323 PolarHBondContact O-N 3.49Å; K320-D350 IonicContact NZ-OD1 2.62Å; K320-D350 PolarHBondContact NZ-OD1 3.45Å; K320-D350 IonicContact NZ-OD2 2.71Å; K320-D350 PolarHBondContact NZ-OD2 2.88Å
321	K	90.9	Very high	95	Very high	99 Å²	99	61.2 Å²	61.2	43%	0.43	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-57.4	-33.9	-179.6	179	175.6	170.9	-168	0	112.6	D323 L324 D352 I354	K321-D323 PolarHBondContact O-N 2.87Å; K321-L324 WeakPolarHBondContact O-CB 3.24Å; K321-L324 PolarHBondContact O-N 2.82Å; K321-D352 HydrophobicContact CB-CB 3.92Å; K321-D352 WeakPolarHBondContact CB-O 3.44Å; K321-D352 HydrophobicContact CD-CB 3.91Å; K321-D352 PolarHBondContact N-O 2.84Å; K321-D352 IonicContact NZ-OD2 3.94Å; K321-D352 PolarHBondContact NZ-OD2 3.27Å; K321-I354 HydrophobicContact CB-CD1 4.09Å; K321-I354 HydrophobicContact CB-CG1 4.15Å; K321-I354 HydrophobicContact CD-CD1 4.37Å; K321-I354 HydrophobicContact CG-CD1 3.87Å; K321-I354 HydrophobicContact CG-CG1 4.39Å
322	K	90.4	Very high	94.9	Very high	156 Å²	156	57 Å²	57	68%	0.678	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-66.4	-21.9	179.3	71.2	-175.5	-174.5	-178.8	0	114.2	K320 L324	K320-K322 HydrophobicContact CB-CG 4.04Å; K320-K322 PolarHBondContact O-N 2.78Å; K322-L324 VanDerWaalsContact C-N 3.26Å
323	D	88.8	Confident	94.8	Very high	105 Å²	105	61.6 Å²	61.6	56%	0.561	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-84.1	-6.1	-178.7	-56.9	-23.5	0	0	0	111.6	K320 K321	K320-D323 WeakPolarHBondContact CB-OD2 3.25Å; K320-D323 PolarHBondContact O-N 3.49Å; K321-D323 PolarHBondContact O-N 2.87Å
324	L	93.3	Very high	94.8	Very high	23 Å²	23	64.4 Å²	64.4	12%	0.12	32%	0.318	C	S	.	.	S	Bend	trans	-91.8	129.5	-176.8	-165	71	0	0	0	111.4	I295 F319 K321 K322 L329 L332 I354	I295-L324 HydrophobicContact CG1-CD1 4.21Å; F319-L324 HydrophobicContact CE2-CD1 4Å; F319-L324 HydrophobicContact CE2-CD2 4.31Å; K321-L324 WeakPolarHBondContact O-CB 3.24Å; K321-L324 PolarHBondContact O-N 2.82Å; K322-L324 VanDerWaalsContact C-N 3.26Å; L324-L329 HydrophobicContact CD2-CB 3.98Å; L324-L329 HydrophobicContact CD2-CD1 4.15Å; L324-L332 HydrophobicContact CD2-CD1 3.39Å; L324-L332 HydrophobicContact CD2-CG 4.36Å; L324-I354 HydrophobicContact CD2-CD1 4.5Å
325	S	94.8	Very high	94.7	Very high	56 Å²	56	63.3 Å²	63.3	39%	0.392	31%	0.314	S	S	.	.			trans	-65.4	158.6	172.7	67.3	0	0	0	0	112	L327 G328 L329	S325-L327 PolarHBondContact O-N 3.23Å; S325-G328 PolarHBondContact O-N 2.88Å; S325-G328 VanDerWaalsContact O-N 3.07Å; S325-G328 PolarHBondContact OG-N 3.36Å; S325-L329 PolarHBondContact O-N 3.49Å
326	Q	95.4	Very high	94.7	Very high	182 Å²	182	66 Å²	66	85%	0.85	33%	0.326	S	S	*	.	H	α-helix	trans	-58.1	-39	174.6	-68.1	179	-6.9	0	0	112	L329 L330	Q326-L329 PolarHBondContact O-N 2.89Å; Q326-L330 PolarHBondContact O-N 3.27Å
327	L	95.5	Very high	94.7	Very high	95 Å²	95	71.4 Å²	71.4	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-44.9	173.9	-180	62	0	0	0	111.4	I294 S325 L329 L330 I331	I294-L327 HydrophobicContact CD1-CD2 4.2Å; I294-L327 HydrophobicContact CG2-CB 4.48Å; I294-L327 HydrophobicContact CG2-CD2 4.26Å; I294-L327 HydrophobicContact CG2-CG 4.14Å; S325-L327 PolarHBondContact O-N 3.23Å; L327-L329 VanDerWaalsContact C-N 3.31Å; L327-L329 PolarHBondContact O-N 3.37Å; L327-L330 PolarHBondContact O-N 3.25Å; L327-I331 HydrophobicContact CD1-CD1 4.18Å; L327-I331 HydrophobicContact CD1-CG1 4.33Å; L327-I331 HydrophobicContact CG-CD1 3.99Å; L327-I331 VanDerWaalsContact O-CG1 3.3Å; L327-I331 WeakPolarHBondContact O-CG1 3.5Å; L327-I331 PolarHBondContact O-N 3.31Å
328	G	95.4	Very high	94.7	Very high	0 Å²	0	76.6 Å²	76.6	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-60	-40.7	175.8	0	0	0	0	0	112.6	S325 I331 L332	S325-G328 PolarHBondContact O-N 2.88Å; S325-G328 VanDerWaalsContact O-N 3.07Å; S325-G328 PolarHBondContact OG-N 3.36Å; G328-I331 PolarHBondContact O-N 2.85Å; G328-L332 WeakPolarHBondContact O-CG 3.21Å; G328-L332 PolarHBondContact O-N 3.26Å
329	L	95	Very high	94.7	Very high	60 Å²	60	80.8 Å²	80.8	31%	0.314	40%	0.395	S	S	.	.	H	α-helix	trans	-64.7	-44.3	176.2	-173.8	65.8	0	0	0	111.9	L324 S325 Q326 L327 L332 Q333 I354	L324-L329 HydrophobicContact CD2-CB 3.98Å; L324-L329 HydrophobicContact CD2-CD1 4.15Å; S325-L329 PolarHBondContact O-N 3.49Å; Q326-L329 PolarHBondContact O-N 2.89Å; L327-L329 VanDerWaalsContact C-N 3.31Å; L327-L329 PolarHBondContact O-N 3.37Å; L329-L332 PolarHBondContact O-N 2.97Å; L329-Q333 WeakPolarHBondContact O-CG 3.37Å; L329-Q333 PolarHBondContact O-N 2.87Å; L329-I354 HydrophobicContact CD1-CD1 4.49Å
330	L	96.6	Very high	94.8	Very high	97 Å²	97	81.9 Å²	81.9	51%	0.508	40%	0.404	S	S	.	.	H	α-helix	trans	-60.7	-46.9	175.9	177.9	64.5	0	0	0	111.2	Q326 L327 L332 Q333 V334	Q326-L330 PolarHBondContact O-N 3.27Å; L327-L330 PolarHBondContact O-N 3.25Å; L330-L332 VanDerWaalsContact C-N 3.33Å; L330-L332 PolarHBondContact O-N 2.97Å; L330-Q333 PolarHBondContact O-N 3.32Å; L330-V334 HydrophobicContact CD1-CG2 4.15Å; L330-V334 HydrophobicContact CG-CG2 4.47Å; L330-V334 WeakPolarHBondContact O-CG2 3.24Å; L330-V334 PolarHBondContact O-N 3.47Å
331	I	96.6	Very high	95	Very high	45 Å²	45	79 Å²	79	23%	0.231	39%	0.391	C	S	.	.	H	α-helix	trans	-59.4	-45.3	177.5	-68.8	171.5	0	0	0	110.5	P289 I294 I295 L327 G328 Q333 V334 A335	P289-I331 HydrophobicContact CB-CG2 4.05Å; P289-I331 HydrophobicContact CG-CG2 3.78Å; I294-I331 HydrophobicContact CD1-CD1 4.36Å; I294-I331 HydrophobicContact CG2-CD1 3.99Å; I295-I331 HydrophobicContact CD1-CG2 4.05Å; L327-I331 HydrophobicContact CD1-CD1 4.18Å; L327-I331 HydrophobicContact CD1-CG1 4.33Å; L327-I331 HydrophobicContact CG-CD1 3.99Å; L327-I331 VanDerWaalsContact O-CG1 3.3Å; L327-I331 WeakPolarHBondContact O-CG1 3.5Å; L327-I331 PolarHBondContact O-N 3.31Å; G328-I331 PolarHBondContact O-N 2.85Å; I331-Q333 PolarHBondContact O-N 3.2Å; I331-V334 PolarHBondContact O-N 2.92Å; I331-A335 VanDerWaalsContact O-CB 3.24Å; I331-A335 WeakPolarHBondContact O-CB 3.43Å; I331-A335 PolarHBondContact O-N 2.97Å
332	L	95.7	Very high	95.3	Very high	2 Å²	2	77 Å²	77	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-58.5	-47.8	176.2	-76.6	180	0	0	0	111.8	I295 F319 L324 G328 L329 L330 A335 E336 L341 I354 C356 M359	I295-L332 HydrophobicContact CD1-CD2 3.58Å; I295-L332 HydrophobicContact CD1-CG 3.78Å; I295-L332 HydrophobicContact CG1-CD2 4.42Å; I295-L332 HydrophobicContact CG1-CG 4.35Å; F319-L332 HydrophobicContact CE2-CD1 4.39Å; F319-L332 HydrophobicContact CZ-CD1 4.17Å; L324-L332 HydrophobicContact CD2-CD1 3.39Å; L324-L332 HydrophobicContact CD2-CG 4.36Å; G328-L332 WeakPolarHBondContact O-CG 3.21Å; G328-L332 PolarHBondContact O-N 3.26Å; L329-L332 PolarHBondContact O-N 2.97Å; L330-L332 VanDerWaalsContact C-N 3.33Å; L330-L332 PolarHBondContact O-N 2.97Å; L332-A335 PolarHBondContact O-N 3.41Å; L332-E336 VanDerWaalsContact O-CB 3.27Å; L332-E336 WeakPolarHBondContact O-CB 3.41Å; L332-E336 PolarHBondContact O-N 3.2Å; L332-L341 HydrophobicContact CD2-CD2 3.29Å; L332-I354 HydrophobicContact CD1-CG2 4.19Å; L332-C356 HydrophobicContact CD2-CB 4.15Å; L332-M359 HydrophobicContact CD2-CE 4.11Å
333	Q	95.7	Very high	95.5	Very high	98 Å²	98	70.4 Å²	70.4	46%	0.458	36%	0.356	S	S	.	.	H	α-helix	trans	-63.1	-43.2	-179.3	-74.4	174.9	-26.7	0	0	112.2	L329 L330 I331 L337	L329-Q333 WeakPolarHBondContact O-CG 3.37Å; L329-Q333 PolarHBondContact O-N 2.87Å; L330-Q333 PolarHBondContact O-N 3.32Å; I331-Q333 PolarHBondContact O-N 3.2Å; Q333-L337 VanDerWaalsContact O-CB 3.29Å; Q333-L337 WeakPolarHBondContact O-CB 3.28Å; Q333-L337 PolarHBondContact O-N 3.25Å
334	V	96.9	Very high	95.8	Very high	70 Å²	70	70.9 Å²	70.9	42%	0.424	35%	0.35	S	S	.	.	H	α-helix	trans	-65.2	-44.7	176.5	172.6	0	0	0	0	110.6	L330 I331 E336 L337 L338	L330-V334 HydrophobicContact CD1-CG2 4.15Å; L330-V334 HydrophobicContact CG-CG2 4.47Å; L330-V334 WeakPolarHBondContact O-CG2 3.24Å; L330-V334 PolarHBondContact O-N 3.47Å; I331-V334 PolarHBondContact O-N 2.92Å; V334-E336 VanDerWaalsContact C-N 3.35Å; V334-E336 PolarHBondContact O-N 3.5Å; V334-L337 PolarHBondContact O-N 3.11Å; V334-L338 HydrophobicContact CG1-CD1 4.03Å; V334-L338 HydrophobicContact CG1-CG 4.46Å; V334-L338 WeakPolarHBondContact O-CB 3.39Å; V334-L338 VanDerWaalsContact O-CG 3.31Å; V334-L338 WeakPolarHBondContact O-CG 3.36Å; V334-L338 PolarHBondContact O-N 3.42Å
335	A	96.6	Very high	95.9	Very high	11 Å²	11	76.1 Å²	76.1	9%	0.091	37%	0.368	C	S	.	.	H	α-helix	trans	-65.8	-36.5	179.4	0	0	0	0	0	112.7	I331 L332 R339 V340 L341	I331-A335 VanDerWaalsContact O-CB 3.24Å; I331-A335 WeakPolarHBondContact O-CB 3.43Å; I331-A335 PolarHBondContact O-N 2.97Å; L332-A335 PolarHBondContact O-N 3.41Å; A335-R339 PolarHBondContact O-N 3.16Å; A335-V340 HydrophobicContact CB-CG2 3.99Å; A335-V340 VanDerWaalsContact O-CG2 3.25Å; A335-V340 WeakPolarHBondContact O-CG2 3.28Å; A335-V340 PolarHBondContact O-N 3.21Å; A335-L341 HydrophobicContact CB-CB 3.8Å; A335-L341 HydrophobicContact CB-CD2 4.1Å; A335-L341 PolarHBondContact O-N 2.88Å
336	E	96.4	Very high	95.6	Very high	60 Å²	60	74.7 Å²	74.7	28%	0.28	36%	0.363	S	S	.	.	H	α-helix	trans	-67.2	-43.7	172.8	-174.9	-179.7	-158.2	0	0	111.4	L332 V334 L338 R339 V343 R345	L332-E336 VanDerWaalsContact O-CB 3.27Å; L332-E336 WeakPolarHBondContact O-CB 3.41Å; L332-E336 PolarHBondContact O-N 3.2Å; V334-E336 VanDerWaalsContact C-N 3.35Å; V334-E336 PolarHBondContact O-N 3.5Å; E336-L338 VanDerWaalsContact C-N 3.33Å; E336-L338 PolarHBondContact O-N 3.28Å; E336-R339 WeakPolarHBondContact O-CA 3.45Å; E336-R339 PolarHBondContact O-N 3.02Å; E336-V343 HydrophobicContact CB-CG2 4.18Å; E336-V343 HydrophobicContact CG-CG2 4.31Å; E336-R345 IonicContact OE1-CZ 3.67Å; E336-R345 IonicContact OE1-NH1 2.78Å; E336-R345 PolarHBondContact OE1-NH1 2.98Å; E336-R345 IonicContact OE1-NH2 3.66Å; E336-R345 IonicContact OE2-CZ 3.43Å; E336-R345 IonicContact OE2-NH1 3.3Å; E336-R345 PolarHBondContact OE2-NH1 3.38Å; E336-R345 IonicContact OE2-NH2 2.66Å; E336-R345 PolarHBondContact OE2-NH2 3.26Å
337	L	97	Very high	95.2	Very high	143 Å²	143	73.5 Å²	73.5	75%	0.749	36%	0.357	S	S	*	.	H	α-helix	trans	-60	-42.5	175.8	179.3	65.6	0	0	0	111.9	Q333 V334 R339	Q333-L337 VanDerWaalsContact O-CB 3.29Å; Q333-L337 WeakPolarHBondContact O-CB 3.28Å; Q333-L337 PolarHBondContact O-N 3.25Å; V334-L337 PolarHBondContact O-N 3.11Å; L337-R339 PolarHBondContact O-N 2.82Å
338	L	96.5	Very high	94.4	Very high	119 Å²	119	73.2 Å²	73.2	62%	0.623	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-1.6	174.3	-67	176.1	0	0	0	113.2	V334 E336 V340	V334-L338 HydrophobicContact CG1-CD1 4.03Å; V334-L338 HydrophobicContact CG1-CG 4.46Å; V334-L338 WeakPolarHBondContact O-CB 3.39Å; V334-L338 VanDerWaalsContact O-CG 3.31Å; V334-L338 WeakPolarHBondContact O-CG 3.36Å; V334-L338 PolarHBondContact O-N 3.42Å; E336-L338 VanDerWaalsContact C-N 3.33Å; E336-L338 PolarHBondContact O-N 3.28Å; L338-V340 HydrophobicContact CB-CG1 4.42Å; L338-V340 HydrophobicContact CB-CG2 4.18Å; L338-V340 PolarHBondContact O-N 3.29Å; L338-V340 VanDerWaalsContact O-N 3.14Å
339	R	95.5	Very high	93.3	Very high	192 Å²	192	77.7 Å²	77.7	73%	0.725	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	24.1	-177.9	-56.4	-176	175.5	-172.5	-1.3	113.9	A335 E336 L337 K367	A335-R339 PolarHBondContact O-N 3.16Å; E336-R339 WeakPolarHBondContact O-CA 3.45Å; E336-R339 PolarHBondContact O-N 3.02Å; L337-R339 PolarHBondContact O-N 2.82Å; R339-K367 VanDerWaalsContact O-CE 3.25Å; R339-K367 WeakPolarHBondContact O-CE 3.14Å; R339-K367 PolarHBondContact O-NZ 3.46Å
340	V	95.9	Very high	92	Very high	41 Å²	41	80.4 Å²	80.4	25%	0.248	42%	0.417	C	S	.	.	S	Bend	trans	-93.2	-7.4	174	-61.4	0	0	0	0	112.2	Y286 A335 L338 L364	Y286-V340 HydrophobicContact CE2-CB 4.34Å; Y286-V340 HydrophobicContact CE2-CG2 4.22Å; Y286-V340 PolarHBondContact OH-O 2.87Å; A335-V340 HydrophobicContact CB-CG2 3.99Å; A335-V340 VanDerWaalsContact O-CG2 3.25Å; A335-V340 WeakPolarHBondContact O-CG2 3.28Å; A335-V340 PolarHBondContact O-N 3.21Å; L338-V340 HydrophobicContact CB-CG1 4.42Å; L338-V340 HydrophobicContact CB-CG2 4.18Å; L338-V340 PolarHBondContact O-N 3.29Å; L338-V340 VanDerWaalsContact O-N 3.14Å; V340-L364 HydrophobicContact CB-CD1 4.15Å; V340-L364 WeakPolarHBondContact O-CD1 3.33Å
341	L	96.4	Very high	91.3	Very high	5 Å²	5	77.4 Å²	77.4	3%	0.026	41%	0.409	C	S	.	.			trans	-132.8	134.6	177.9	-164.8	75	0	0	0	110.5	L332 A335 V343 C356 N357 M359	L332-L341 HydrophobicContact CD2-CD2 3.29Å; A335-L341 HydrophobicContact CB-CB 3.8Å; A335-L341 HydrophobicContact CB-CD2 4.1Å; A335-L341 PolarHBondContact O-N 2.88Å; L341-V343 HydrophobicContact CD2-CG2 3.63Å; L341-V343 HydrophobicContact CG-CG2 3.96Å; L341-C356 HydrophobicContact CD1-CB 4.31Å; L341-C356 HydrophobicContact CD2-CB 4.01Å; L341-C356 HydrophobicContact CG-CB 4.21Å; L341-N357 WeakPolarHBondContact CA-OD1 3.24Å; L341-N357 WeakPolarHBondContact CD1-O 3.48Å; L341-N357 WeakPolarHBondContact CD1-OD1 3.48Å; L341-M359 HydrophobicContact CD1-CE 3.7Å; L341-M359 HydrophobicContact CD1-CG 3.86Å; L341-M359 HydrophobicContact CD2-CE 3.56Å; L341-M359 HydrophobicContact CG-CE 4.27Å
342	E	96.3	Very high	91	Very high	56 Å²	56	78.9 Å²	78.9	26%	0.262	42%	0.418	S	S	.	.			trans	-93.4	125.4	165.8	-175.3	178	135.2	0	0	108.8	M314 Y316 R344 C356 N357	M314-E342 WeakPolarHBondContact CE-OE2 3.4Å; Y316-E342 HydrophobicContact CE1-CG 4.4Å; Y316-E342 PolarHBondContact OH-OE1 3.41Å; Y316-E342 PolarHBondContact OH-OE2 3.42Å; E342-R344 IonicContact OE1-CZ 3.26Å; E342-R344 VanDerWaalsContact OE1-CZ 3.26Å; E342-R344 IonicContact OE1-NE 2.9Å; E342-R344 PolarHBondContact OE1-NE 2.78Å; E342-R344 IonicContact OE1-NH2 2.79Å; E342-R344 PolarHBondContact OE1-NH2 3.48Å; E342-C356 VanDerWaalsContact O-CA 3.27Å; E342-C356 WeakPolarHBondContact O-CA 3.36Å; E342-N357 PolarHBondContact N-OD1 3.28Å; E342-N357 PolarHBondContact O-N 2.97Å; E342-N357 VanDerWaalsContact O-N 3.1Å
343	V	96.1	Very high	90.9	Very high	18 Å²	18	80.7 Å²	80.7	11%	0.109	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.3	-179.6	-174.8	0	0	0	0	109	E336 L341 R345 I354 E355 C356	E336-V343 HydrophobicContact CB-CG2 4.18Å; E336-V343 HydrophobicContact CG-CG2 4.31Å; L341-V343 HydrophobicContact CD2-CG2 3.63Å; L341-V343 HydrophobicContact CG-CG2 3.96Å; V343-R345 HydrophobicContact CG1-CG 4.35Å; V343-I354 HydrophobicContact CG1-CG2 3.66Å; V343-E355 CarbonylContact C-O 3.52Å; V343-E355 WeakPolarHBondContact CA-O 3.48Å; V343-C356 HydrophobicContact CG2-CB 4.19Å
344	R	94.8	Very high	90.9	Very high	115 Å²	115	76.2 Å²	76.2	43%	0.434	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.4	174.6	-60.1	175.3	-175.8	-176.6	-2.3	108.1	Y316 E342 E355	Y316-R344 PolarHBondContact OH-NH2 3.4Å; Y316-R344 VanDerWaalsContact OH-NH2 3.07Å; E342-R344 IonicContact OE1-CZ 3.26Å; E342-R344 VanDerWaalsContact OE1-CZ 3.26Å; E342-R344 IonicContact OE1-NE 2.9Å; E342-R344 PolarHBondContact OE1-NE 2.78Å; E342-R344 IonicContact OE1-NH2 2.79Å; E342-R344 PolarHBondContact OE1-NH2 3.48Å; R344-E355 HydrophobicContact CB-CB 4.3Å; R344-E355 PolarHBondContact N-O 3.45Å; R344-E355 PolarHBondContact O-N 3.28Å
345	R	94	Very high	90.8	Very high	133 Å²	133	74.8 Å²	74.8	50%	0.502	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.1	179	-62.6	174	179.8	86.2	0.1	107.6	E336 V343	E336-R345 IonicContact OE1-CZ 3.67Å; E336-R345 IonicContact OE1-NH1 2.78Å; E336-R345 PolarHBondContact OE1-NH1 2.98Å; E336-R345 IonicContact OE1-NH2 3.66Å; E336-R345 IonicContact OE2-CZ 3.43Å; E336-R345 IonicContact OE2-NH1 3.3Å; E336-R345 PolarHBondContact OE2-NH1 3.38Å; E336-R345 IonicContact OE2-NH2 2.66Å; E336-R345 PolarHBondContact OE2-NH2 3.26Å; V343-R345 HydrophobicContact CG1-CG 4.35Å
346	G	89.3	Confident	90.8	Very high	27 Å²	27	74.3 Å²	74.3	28%	0.278	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	178.1	179	0	0	0	0	0	111.5	F353	G346-F353 PolarHBondContact N-O 3.49Å; G346-F353 VanDerWaalsContact O-CD1 3.3Å; G346-F353 WeakPolarHBondContact O-CD1 3.49Å; G346-F353 PolarHBondContact O-N 2.95Å
347	Q	87.6	Confident	90.8	Very high	157 Å²	157	71.4 Å²	71.4	73%	0.734	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120	125.5	176.7	-153.6	171.3	4.6	0	0	107.4
348	D	77.9	Confident	90.8	Very high	89 Å²	89	64.7 Å²	64.7	48%	0.476	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	160.1	169	-133	-30.5	0	0	0	106.8	K318 D350 G351 F353	K318-D348 IonicContact NZ-OD2 2.69Å; K318-D348 PolarHBondContact NZ-OD2 3.03Å; D348-D350 PolarHBondContact O-N 2.88Å; D348-G351 PolarHBondContact N-O 3.29Å; D348-G351 VanDerWaalsContact N-O 3.07Å; D348-G351 PolarHBondContact O-N 3.11Å; D348-F353 HydrophobicContact CB-CD1 3.86Å; D348-F353 HydrophobicContact CB-CE1 4.17Å
349	G	71.9	Confident	90.9	Very high	94 Å²	94	59.2 Å²	59.2	97%	0.969	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-9.9	-174.7	0	0	0	0	0	116.3
350	D	68.4	Low	91.1	Very high	117 Å²	117	50.5 Å²	50.5	63%	0.626	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	15.4	-179.4	-157.4	4.3	0	0	0	113.4	K320 D348	K320-D350 IonicContact NZ-OD1 2.62Å; K320-D350 PolarHBondContact NZ-OD1 3.45Å; K320-D350 IonicContact NZ-OD2 2.71Å; K320-D350 PolarHBondContact NZ-OD2 2.88Å; D348-D350 PolarHBondContact O-N 2.88Å
351	G	82.1	Confident	91.2	Very high	33 Å²	33	49.2 Å²	49.2	34%	0.34	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	120.2	-174.5	171.6	0	0	0	0	0	116.3	D348 F353	D348-G351 PolarHBondContact N-O 3.29Å; D348-G351 VanDerWaalsContact N-O 3.07Å; D348-G351 PolarHBondContact O-N 3.11Å; G351-F353 PolarHBondContact O-N 2.91Å
352	D	91.1	Very high	91.3	Very high	77 Å²	77	49.2 Å²	49.2	41%	0.412	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	126.9	174.6	-75.5	1.1	0	0	0	110.9	K321	K321-D352 HydrophobicContact CB-CB 3.92Å; K321-D352 WeakPolarHBondContact CB-O 3.44Å; K321-D352 HydrophobicContact CD-CB 3.91Å; K321-D352 PolarHBondContact N-O 2.84Å; K321-D352 IonicContact NZ-OD2 3.94Å; K321-D352 PolarHBondContact NZ-OD2 3.27Å
353	F	93.2	Very high	91.4	Very high	39 Å²	39	46.6 Å²	46.6	17%	0.171	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	153.3	171.5	74.7	-93.4	0	0	0	112	K318 F319 G346 D348 G351 E355	K318-F353 HydrophobicContact CD-CD2 4.12Å; K318-F353 HydrophobicContact CD-CE2 4.38Å; K318-F353 VanDerWaalsContact CE-CD2 3.46Å; K318-F353 HydrophobicContact CG-CD2 3.96Å; F319-F353 WeakPolarHBondContact O-CA 3.49Å; G346-F353 PolarHBondContact N-O 3.49Å; G346-F353 VanDerWaalsContact O-CD1 3.3Å; G346-F353 WeakPolarHBondContact O-CD1 3.49Å; G346-F353 PolarHBondContact O-N 2.95Å; D348-F353 HydrophobicContact CB-CD1 3.86Å; D348-F353 HydrophobicContact CB-CE1 4.17Å; G351-F353 PolarHBondContact O-N 2.91Å; F353-E355 HydrophobicContact CD2-CB 4.43Å; F353-E355 HydrophobicContact CE2-CB 4.4Å
354	I	94.6	Very high	91.5	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.1	170.2	-61.7	176.9	0	0	0	107.1	K318 F319 K321 L324 L329 L332 V343	K318-I354 WeakPolarHBondContact CA-O 3.2Å; F319-I354 HydrophobicContact CD2-CB 4.4Å; F319-I354 HydrophobicContact CE2-CB 3.92Å; F319-I354 HydrophobicContact CE2-CG2 4.11Å; F319-I354 HydrophobicContact CZ-CB 4.36Å; F319-I354 HydrophobicContact CZ-CG2 4.11Å; F319-I354 PolarHBondContact N-O 3.37Å; F319-I354 PolarHBondContact O-N 3.47Å; K321-I354 HydrophobicContact CB-CD1 4.09Å; K321-I354 HydrophobicContact CB-CG1 4.15Å; K321-I354 HydrophobicContact CD-CD1 4.37Å; K321-I354 HydrophobicContact CG-CD1 3.87Å; K321-I354 HydrophobicContact CG-CG1 4.39Å; L324-I354 HydrophobicContact CD2-CD1 4.5Å; L329-I354 HydrophobicContact CD1-CD1 4.49Å; L332-I354 HydrophobicContact CD1-CG2 4.19Å; V343-I354 HydrophobicContact CG1-CG2 3.66Å
355	E	95.4	Very high	91.6	Very high	41 Å²	41	41.9 Å²	41.9	19%	0.192	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.9	171.6	179.1	177	-126.6	0	0	108.4	Y316 S317 K318 V343 R344 F353	Y316-E355 HydrophobicContact CD1-CG 3.98Å; Y316-E355 HydrophobicContact CG-CG 4.1Å; S317-E355 WeakPolarHBondContact O-CA 3.33Å; K318-E355 HydrophobicContact CB-CB 4.24Å; K318-E355 HydrophobicContact CB-CG 4.25Å; K318-E355 HydrophobicContact CG-CB 4.36Å; V343-E355 CarbonylContact C-O 3.52Å; V343-E355 WeakPolarHBondContact CA-O 3.48Å; R344-E355 HydrophobicContact CB-CB 4.3Å; R344-E355 PolarHBondContact N-O 3.45Å; R344-E355 PolarHBondContact O-N 3.28Å; F353-E355 HydrophobicContact CD2-CB 4.43Å; F353-E355 HydrophobicContact CE2-CB 4.4Å
356	C	96.4	Very high	91.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.3	175.9	65.7	0	0	0	0	111.3	Y316 S317 L332 L341 E342 V343	Y316-C356 CarbonylContact C-O 3.5Å; Y316-C356 VanDerWaalsContact CA-O 3.25Å; Y316-C356 WeakPolarHBondContact CA-O 3.42Å; S317-C356 PolarHBondContact N-O 3.01Å; S317-C356 PolarHBondContact O-N 2.89Å; S317-C356 VanDerWaalsContact O-N 3.07Å; L332-C356 HydrophobicContact CD2-CB 4.15Å; L341-C356 HydrophobicContact CD1-CB 4.31Å; L341-C356 HydrophobicContact CD2-CB 4.01Å; L341-C356 HydrophobicContact CG-CB 4.21Å; E342-C356 VanDerWaalsContact O-CA 3.27Å; E342-C356 WeakPolarHBondContact O-CA 3.36Å; V343-C356 HydrophobicContact CG2-CB 4.19Å
357	N	96.6	Very high	92.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	148.9	173.9	73.4	-89.5	0	0	0	110.2	Y286 M314 S315 Y316 L341 E342 M359	Y286-N357 PolarHBondContact OH-ND2 2.86Å; M314-N357 HydrophobicContact CB-CB 4.49Å; M314-N357 HydrophobicContact SD-CB 4.01Å; S315-N357 CarbonylContact O-C 3.53Å; S315-N357 WeakPolarHBondContact O-CA 3.25Å; Y316-N357 HydrophobicContact CD1-CB 4.03Å; Y316-N357 HydrophobicContact CE1-CB 3.92Å; L341-N357 WeakPolarHBondContact CA-OD1 3.24Å; L341-N357 WeakPolarHBondContact CD1-O 3.48Å; L341-N357 WeakPolarHBondContact CD1-OD1 3.48Å; E342-N357 PolarHBondContact N-OD1 3.28Å; E342-N357 PolarHBondContact O-N 2.97Å; E342-N357 VanDerWaalsContact O-N 3.1Å; N357-M359 PolarHBondContact O-N 3.31Å
358	N	97.9	Very high	92.7	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.011	21%	0.208	C	C	.	.			trans	-63.6	134.2	177.9	-83.2	-51.6	0	0	0	110.8	Q290 P298 R301 S315 T360 N363	Q290-N358 PolarHBondContact NE2-OD1 3.04Å; P298-N358 WeakPolarHBondContact CD-OD1 3.48Å; P298-N358 VanDerWaalsContact CG-OD1 3.23Å; P298-N358 WeakPolarHBondContact CG-OD1 3.45Å; R301-N358 HydrophobicContact CB-CB 4.16Å; R301-N358 HydrophobicContact CG-CB 4.41Å; S315-N358 PolarHBondContact O-N 2.9Å; S315-N358 PolarHBondContact OG-ND2 3.48Å; N358-T360 VanDerWaalsContact C-N 3.33Å; N358-T360 PolarHBondContact O-N 3.29Å; N358-N363 VanDerWaalsContact O-CB 3.22Å; N358-N363 WeakPolarHBondContact O-CB 3.13Å
359	M	98.1	Very high	93.6	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.015	21%	0.214	C	C	.	.			trans	-82.6	79	-174.5	-62.8	177.5	164.6	0	0	110.1	Y286 S287 P289 Q290 I295 R301 L332 L341 N357	Y286-M359 VanDerWaalsContact CD1-C 3.48Å; Y286-M359 HydrophobicContact CD1-CB 4.21Å; Y286-M359 VanDerWaalsContact CE1-C 3.41Å; Y286-M359 VanDerWaalsContact CE1-CA 3.41Å; Y286-M359 HydrophobicContact CE1-CB 3.99Å; Y286-M359 HydrophobicContact CE2-CB 4.34Å; Y286-M359 HydrophobicContact CE2-CG 4.36Å; Y286-M359 HydrophobicContact CG-CB 4.48Å; Y286-M359 WeakPolarHBondContact O-CB 3.39Å; S287-M359 WeakPolarHBondContact CA-O 3.27Å; S287-M359 PolarHBondContact OG-O 2.88Å; P289-M359 HydrophobicContact CB-SD 3.87Å; P289-M359 HydrophobicContact CG-SD 3.98Å; Q290-M359 HydrophobicContact CG-CB 4.24Å; Q290-M359 HydrophobicContact CG-CG 4.3Å; Q290-M359 HydrophobicContact CG-SD 4.13Å; I295-M359 HydrophobicContact CD1-CE 3.4Å; I295-M359 VanDerWaalsContact CD1-CE 3.4Å; I295-M359 HydrophobicContact CD1-SD 4.01Å; R301-M359 PolarHBondContact NH1-O 3.2Å; R301-M359 VanDerWaalsContact NH1-O 3.14Å; L332-M359 HydrophobicContact CD2-CE 4.11Å; L341-M359 HydrophobicContact CD1-CE 3.7Å; L341-M359 HydrophobicContact CD1-CG 3.86Å; L341-M359 HydrophobicContact CD2-CE 3.56Å; L341-M359 HydrophobicContact CG-CE 4.27Å; N357-M359 PolarHBondContact O-N 3.31Å
360	T	98.3	Very high	94.8	Very high	9 Å²	9	35 Å²	35	6%	0.055	19%	0.186	C	C	.	.	S	Bend	trans	-138.5	151.7	174.4	61.6	0	0	0	0	109.5	N283 Y286 R301 N358 I362 N363 L364	N283-T360 WeakPolarHBondContact OD1-CA 3.48Å; Y286-T360 WeakPolarHBondContact CE1-O 3.2Å; R301-T360 HydrophobicContact CB-CG2 3.87Å; N358-T360 VanDerWaalsContact C-N 3.33Å; N358-T360 PolarHBondContact O-N 3.29Å; T360-I362 PolarHBondContact O-N 3.43Å; T360-N363 PolarHBondContact O-N 3.5Å; T360-N363 VanDerWaalsContact O-N 3.16Å; T360-N363 WeakPolarHBondContact OG1-CB 3.45Å; T360-N363 PolarHBondContact OG1-N 3.46Å; T360-N363 PolarHBondContact OG1-ND2 3.25Å; T360-L364 PolarHBondContact O-N 2.81Å
361	L	98.4	Very high	96.2	Very high	15 Å²	15	33.7 Å²	33.7	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-60.2	-34.5	179.8	-175.7	59.9	0	0	0	111.9	L185 P279 V282 N283 L364 V365 M381	L185-L361 HydrophobicContact CD1-CB 4.1Å; P279-L361 HydrophobicContact CB-CD2 4.08Å; V282-L361 HydrophobicContact CG1-CD1 4.35Å; N283-L361 HydrophobicContact CB-CB 3.89Å; N283-L361 PolarHBondContact OD1-N 3.06Å; L361-L364 HydrophobicContact CD1-CD2 4.18Å; L361-L364 WeakPolarHBondContact O-CB 3.37Å; L361-L364 PolarHBondContact O-N 3.25Å; L361-V365 WeakPolarHBondContact O-CG2 3.2Å; L361-V365 PolarHBondContact O-N 3.3Å; L361-M381 HydrophobicContact CB-CE 4.25Å; L361-M381 HydrophobicContact CD2-CE 3.79Å; L361-M381 HydrophobicContact CG-CE 3.82Å; L361-M381 HydrophobicContact CG-SD 4.44Å
362	I	98.4	Very high	96.9	Very high	5 Å²	5	33 Å²	33	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-48.3	175.7	-61.7	174	0	0	0	110.9	L185 I188 P303 T360 L364 V365 L366 L377 M381	L185-I362 HydrophobicContact CD1-CD1 4.38Å; L185-I362 HydrophobicContact CD1-CG1 4.09Å; I188-I362 HydrophobicContact CD1-CD1 4.25Å; I188-I362 HydrophobicContact CD1-CG2 4.49Å; I188-I362 HydrophobicContact CG1-CD1 4.29Å; I188-I362 HydrophobicContact CG2-CG2 4.43Å; P303-I362 HydrophobicContact CG-CG2 4.06Å; T360-I362 PolarHBondContact O-N 3.43Å; I362-L364 VanDerWaalsContact C-N 3.31Å; I362-L364 PolarHBondContact O-N 3.04Å; I362-V365 PolarHBondContact O-N 3.42Å; I362-L366 WeakPolarHBondContact O-CG 3.37Å; I362-L366 PolarHBondContact O-N 2.8Å; I362-L366 VanDerWaalsContact O-N 3.13Å; I362-L377 HydrophobicContact CG2-CD2 3.76Å; I362-L377 HydrophobicContact CG2-CG 4.37Å; I362-M381 HydrophobicContact CG1-CE 3.97Å; I362-M381 HydrophobicContact CG1-SD 4.27Å
363	N	98.4	Very high	97.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.2	-33.5	176.5	-80.9	-81.3	0	0	0	112.1	R301 M314 S315 N358 T360 L366 K367	R301-N363 PolarHBondContact O-ND2 3.5Å; M314-N363 VanDerWaalsContact CA-OD1 3.28Å; M314-N363 WeakPolarHBondContact CA-OD1 3.41Å; S315-N363 PolarHBondContact N-OD1 3.11Å; S315-N363 PolarHBondContact OG-OD1 2.91Å; N358-N363 VanDerWaalsContact O-CB 3.22Å; N358-N363 WeakPolarHBondContact O-CB 3.13Å; T360-N363 PolarHBondContact O-N 3.5Å; T360-N363 VanDerWaalsContact O-N 3.16Å; T360-N363 WeakPolarHBondContact OG1-CB 3.45Å; T360-N363 PolarHBondContact OG1-N 3.46Å; T360-N363 PolarHBondContact OG1-ND2 3.25Å; N363-L366 PolarHBondContact O-N 3.47Å; N363-K367 WeakPolarHBondContact O-CB 3.47Å; N363-K367 PolarHBondContact O-N 3.28Å
364	L	98.2	Very high	97.5	Very high	25 Å²	25	30.6 Å²	30.6	13%	0.131	15%	0.151	C	C	.	.	H	α-helix	trans	-63.6	-40.8	175.2	-172.8	62.6	0	0	0	111.7	Y286 V340 T360 L361 I362 K367 F368	Y286-L364 HydrophobicContact CE1-CB 4.14Å; V340-L364 HydrophobicContact CB-CD1 4.15Å; V340-L364 WeakPolarHBondContact O-CD1 3.33Å; T360-L364 PolarHBondContact O-N 2.81Å; L361-L364 HydrophobicContact CD1-CD2 4.18Å; L361-L364 WeakPolarHBondContact O-CB 3.37Å; L361-L364 PolarHBondContact O-N 3.25Å; I362-L364 VanDerWaalsContact C-N 3.31Å; I362-L364 PolarHBondContact O-N 3.04Å; L364-K367 HydrophobicContact CD1-CD 4.4Å; L364-K367 WeakPolarHBondContact O-CB 3.32Å; L364-K367 PolarHBondContact O-N 2.89Å; L364-F368 HydrophobicContact CD1-CD2 4.2Å; L364-F368 HydrophobicContact CD1-CE2 3.56Å; L364-F368 HydrophobicContact CD1-CZ 4.35Å; L364-F368 HydrophobicContact CG-CD2 4.19Å; L364-F368 HydrophobicContact CG-CE2 3.82Å; L364-F368 WeakPolarHBondContact O-CD2 3.14Å; L364-F368 PolarHBondContact O-N 3.39Å
365	V	98.3	Very high	97.7	Very high	9 Å²	9	36.3 Å²	36.3	6%	0.055	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-47	173.2	170.1	0	0	0	0	110.5	L361 I362 K367 F368 F369 I372 L377 I380 M381 I384	L361-V365 WeakPolarHBondContact O-CG2 3.2Å; L361-V365 PolarHBondContact O-N 3.3Å; I362-V365 PolarHBondContact O-N 3.42Å; V365-K367 PolarHBondContact O-N 2.84Å; V365-F368 PolarHBondContact O-N 3.39Å; V365-F368 VanDerWaalsContact O-N 3.09Å; V365-F369 HydrophobicContact CG1-CD2 3.93Å; V365-F369 WeakPolarHBondContact O-CD2 3.39Å; V365-F369 PolarHBondContact O-N 3.03Å; V365-I372 HydrophobicContact CG1-CD1 4.4Å; V365-L377 HydrophobicContact CB-CD1 4.29Å; V365-L377 HydrophobicContact CG1-CD1 3.72Å; V365-I380 HydrophobicContact CG1-CG2 3.83Å; V365-M381 HydrophobicContact CB-SD 4.39Å; V365-M381 HydrophobicContact CG2-SD 3.73Å; V365-I384 HydrophobicContact CG2-CD1 3.67Å
366	L	98.2	Very high	97.8	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-30.3	176.6	-66.9	173.2	0	0	0	113	P303 L312 M314 I362 N363 F368 G370 I372 L377	P303-L366 HydrophobicContact CB-CD1 3.47Å; P303-L366 VanDerWaalsContact CB-CD1 3.47Å; P303-L366 HydrophobicContact CG-CD1 4.32Å; L312-L366 HydrophobicContact CB-CD1 4.49Å; L312-L366 WeakPolarHBondContact O-CD2 3.47Å; M314-L366 HydrophobicContact CG-CB 3.8Å; I362-L366 WeakPolarHBondContact O-CG 3.37Å; I362-L366 PolarHBondContact O-N 2.8Å; I362-L366 VanDerWaalsContact O-N 3.13Å; N363-L366 PolarHBondContact O-N 3.47Å; L366-F368 VanDerWaalsContact C-N 3.34Å; L366-F368 PolarHBondContact O-N 3.44Å; L366-G370 VanDerWaalsContact CD2-O 3.28Å; L366-G370 WeakPolarHBondContact CD2-O 3.35Å; L366-G370 CarbonylContact O-C 3.51Å; L366-G370 WeakPolarHBondContact O-CA 3.45Å; L366-G370 PolarHBondContact O-N 3.34Å; L366-I372 HydrophobicContact CD2-CB 4.01Å; L366-I372 HydrophobicContact CD2-CD1 4.15Å; L366-I372 HydrophobicContact CD2-CG1 3.94Å; L366-L377 HydrophobicContact CD1-CD2 3.98Å; L366-L377 HydrophobicContact CD2-CD1 3.9Å; L366-L377 HydrophobicContact CD2-CD2 3.94Å; L366-L377 HydrophobicContact CG-CD1 4.09Å; L366-L377 HydrophobicContact CG-CD2 4.08Å
367	K	97.5	Very high	97.9	Very high	52 Å²	52	37.6 Å²	37.6	23%	0.226	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-40.5	173	-171.2	-174.3	172.9	-67.1	0	112.2	M314 R339 N363 L364 V365	M314-K367 HydrophobicContact CE-CB 4.39Å; M314-K367 HydrophobicContact CE-CG 4.43Å; M314-K367 VanDerWaalsContact SD-CA 3.54Å; M314-K367 HydrophobicContact SD-CB 3.52Å; M314-K367 VanDerWaalsContact SD-CB 3.52Å; M314-K367 HydrophobicContact SD-CG 3.91Å; R339-K367 VanDerWaalsContact O-CE 3.25Å; R339-K367 WeakPolarHBondContact O-CE 3.14Å; R339-K367 PolarHBondContact O-NZ 3.46Å; N363-K367 WeakPolarHBondContact O-CB 3.47Å; N363-K367 PolarHBondContact O-N 3.28Å; L364-K367 HydrophobicContact CD1-CD 4.4Å; L364-K367 WeakPolarHBondContact O-CB 3.32Å; L364-K367 PolarHBondContact O-N 2.89Å; V365-K367 PolarHBondContact O-N 2.84Å
368	F	97	Very high	98	Very high	125 Å²	125	37.6 Å²	37.6	55%	0.548	18%	0.181	S	C	.	.	H	α-helix	trans	-85.4	-32.5	-177.3	-72.6	-64.1	0	0	0	113.6	L364 V365 L366	L364-F368 HydrophobicContact CD1-CD2 4.2Å; L364-F368 HydrophobicContact CD1-CE2 3.56Å; L364-F368 HydrophobicContact CD1-CZ 4.35Å; L364-F368 HydrophobicContact CG-CD2 4.19Å; L364-F368 HydrophobicContact CG-CE2 3.82Å; L364-F368 WeakPolarHBondContact O-CD2 3.14Å; L364-F368 PolarHBondContact O-N 3.39Å; V365-F368 PolarHBondContact O-N 3.39Å; V365-F368 VanDerWaalsContact O-N 3.09Å; L366-F368 VanDerWaalsContact C-N 3.34Å; L366-F368 PolarHBondContact O-N 3.44Å
369	F	97.1	Very high	98.1	Very high	141 Å²	141	40.1 Å²	40.1	62%	0.618	20%	0.196	S	C	*	.	H	α-helix	trans	-107.5	-4.5	-173.5	-71.6	-84.8	0	0	0	113.9	V365 I372	V365-F369 HydrophobicContact CG1-CD2 3.93Å; V365-F369 WeakPolarHBondContact O-CD2 3.39Å; V365-F369 PolarHBondContact O-N 3.03Å; F369-I372 HydrophobicContact CB-CD1 3.59Å; F369-I372 HydrophobicContact CB-CG1 4.34Å; F369-I372 HydrophobicContact CG-CD1 4.43Å
370	G	96.8	Very high	98.1	Very high	37 Å²	37	42.1 Å²	42.1	38%	0.381	21%	0.206	S	C	.	.			trans	75.9	-155.3	-176.9	0	0	0	0	0	112.9	L366	L366-G370 VanDerWaalsContact CD2-O 3.28Å; L366-G370 WeakPolarHBondContact CD2-O 3.35Å; L366-G370 CarbonylContact O-C 3.51Å; L366-G370 WeakPolarHBondContact O-CA 3.45Å; L366-G370 PolarHBondContact O-N 3.34Å
371	Q	97.5	Very high	98.1	Very high	88 Å²	88	42 Å²	42	41%	0.411	21%	0.205	S	C	.	.	S	Bend	trans	-72.8	128.4	179.1	-70.7	-175.9	-12.3	0	0	111.7	D306 T309 K311 L312	D306-Q371 PolarHBondContact OD2-NE2 3.18Å; D306-Q371 PolarHBondContact OD2-OE1 3.08Å; T309-Q371 PolarHBondContact OG1-OE1 3.01Å; K311-Q371 HydrophobicContact CB-CB 3.97Å; K311-Q371 HydrophobicContact CD-CB 4.18Å; L312-Q371 VanDerWaalsContact O-CA 3.29Å; L312-Q371 WeakPolarHBondContact O-CA 3.4Å
372	I	98	Very high	98.2	Very high	18 Å²	18	41.9 Å²	41.9	9%	0.092	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-129.7	139.6	-177	-52.2	178	0	0	0	109.9	L312 V365 L366 F369 N376 L377 I380	L312-I372 WeakPolarHBondContact CB-O 3.49Å; L312-I372 PolarHBondContact N-O 3Å; L312-I372 PolarHBondContact O-N 2.89Å; V365-I372 HydrophobicContact CG1-CD1 4.4Å; L366-I372 HydrophobicContact CD2-CB 4.01Å; L366-I372 HydrophobicContact CD2-CD1 4.15Å; L366-I372 HydrophobicContact CD2-CG1 3.94Å; F369-I372 HydrophobicContact CB-CD1 3.59Å; F369-I372 HydrophobicContact CB-CG1 4.34Å; F369-I372 HydrophobicContact CG-CD1 4.43Å; I372-N376 HydrophobicContact CG2-CB 3.7Å; I372-L377 HydrophobicContact CB-CB 4.32Å; I372-L377 HydrophobicContact CD1-CD1 4.23Å; I372-L377 HydrophobicContact CG2-CB 4.1Å; I372-I380 HydrophobicContact CD1-CD1 3.69Å; I372-I380 HydrophobicContact CG2-CD1 4.37Å
373	H	98.2	Very high	98.2	Very high	59 Å²	59	45.9 Å²	45.9	27%	0.273	23%	0.225	S	C	.	.			trans	-61.2	137.6	171.1	-178.1	-84.1	0	0	0	111	Y242 R375 N376 L377	Y242-H373 AromaticContact CE1-CE1 3.56Å; Y242-H373 AromaticContact CE2-CE1 3.96Å; Y242-H373 AromaticContact CZ-CE1 3.35Å; Y242-H373 AromaticContact CZ-NE2 3.77Å; Y242-H373 PolarHBondContact OH-CE1 3.33Å; Y242-H373 VanDerWaalsContact OH-CE1 3.31Å; Y242-H373 PolarHBondContact OH-NE2 3.08Å; H373-R375 PolarHBondContact ND1-N 3.02Å; H373-R375 PolarHBondContact O-N 2.98Å; H373-N376 WeakPolarHBondContact O-CA 3.29Å; H373-N376 PolarHBondContact O-N 3.08Å; H373-L377 PolarHBondContact O-N 2.97Å
374	E	98.4	Very high	98.2	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-49	-50.3	-171.7	-175.5	177	-155.2	0	0	113.7	N45 I188 N189 Y242 L312 N376 L377 T378	N45-E374 PolarHBondContact ND2-OE1 3.04Å; I188-E374 WeakPolarHBondContact CA-OE1 3.25Å; I188-E374 HydrophobicContact CB-CG 4.12Å; N189-E374 PolarHBondContact N-OE1 3.48Å; N189-E374 PolarHBondContact ND2-OE1 3.2Å; N189-E374 VanDerWaalsContact ND2-OE1 3.17Å; N189-E374 PolarHBondContact ND2-OE2 3.04Å; Y242-E374 HydrophobicContact CD2-CB 4.05Å; Y242-E374 HydrophobicContact CD2-CG 4.05Å; Y242-E374 VanDerWaalsContact CD2-OE2 3.3Å; Y242-E374 WeakPolarHBondContact CD2-OE2 3.31Å; Y242-E374 HydrophobicContact CE2-CB 3.94Å; Y242-E374 HydrophobicContact CE2-CG 4.34Å; Y242-E374 WeakPolarHBondContact CE2-OE2 3.47Å; L312-E374 HydrophobicContact CD1-CB 3.61Å; L312-E374 HydrophobicContact CD1-CG 3.69Å; L312-E374 HydrophobicContact CG-CB 4.14Å; E374-N376 VanDerWaalsContact C-N 3.27Å; E374-N376 PolarHBondContact O-N 3.34Å; E374-L377 WeakPolarHBondContact O-CB 3.44Å; E374-L377 PolarHBondContact O-N 3.4Å; E374-L377 VanDerWaalsContact O-N 3.09Å; E374-T378 PolarHBondContact O-N 3.01Å; E374-T378 PolarHBondContact O-OG1 3.31Å
375	R	98.4	Very high	98.2	Very high	123 Å²	123	46.8 Å²	46.8	46%	0.464	23%	0.23	S	C	.	.	H	α-helix	trans	-50.7	-46.5	175.7	-172.3	-174.7	70.3	-177	0.7	112.9	W241 Y242 H373 T378 V379	W241-R375 HydrophobicContact CZ2-CG 4.07Å; Y242-R375 HydrophobicContact CD1-CB 3.72Å; Y242-R375 HydrophobicContact CD1-CG 4.14Å; Y242-R375 HydrophobicContact CD2-CB 4.39Å; Y242-R375 HydrophobicContact CE1-CB 4.31Å; Y242-R375 HydrophobicContact CG-CB 3.79Å; Y242-R375 HydrophobicContact CG-CG 4.32Å; H373-R375 PolarHBondContact ND1-N 3.02Å; H373-R375 PolarHBondContact O-N 2.98Å; R375-T378 PolarHBondContact O-N 3.46Å; R375-V379 WeakPolarHBondContact O-CG2 3.3Å; R375-V379 PolarHBondContact O-N 3.49Å
376	N	98.6	Very high	98.2	Very high	69 Å²	69	49.4 Å²	49.4	37%	0.369	25%	0.246	S	C	.	.	H	α-helix	trans	-73.6	-34.2	-176.3	-63.8	-3.2	0	0	0	110.6	I372 H373 E374 V379 I380	I372-N376 HydrophobicContact CG2-CB 3.7Å; H373-N376 WeakPolarHBondContact O-CA 3.29Å; H373-N376 PolarHBondContact O-N 3.08Å; E374-N376 VanDerWaalsContact C-N 3.27Å; E374-N376 PolarHBondContact O-N 3.34Å; N376-V379 PolarHBondContact O-N 3.2Å; N376-I380 VanDerWaalsContact O-CG1 3.27Å; N376-I380 WeakPolarHBondContact O-CG1 3.35Å; N376-I380 PolarHBondContact O-N 2.71Å
377	L	98.7	Very high	98.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-46.4	172.6	-177.9	61	0	0	0	110.9	I188 P303 L312 I362 V365 L366 I372 H373 E374 V379 I380 M381	I188-L377 HydrophobicContact CD1-CB 4.44Å; I188-L377 HydrophobicContact CD1-CD2 4.14Å; I188-L377 HydrophobicContact CD1-CG 3.88Å; I188-L377 HydrophobicContact CG2-CD2 4.33Å; P303-L377 HydrophobicContact CG-CD2 4.43Å; L312-L377 HydrophobicContact CB-CD2 4.34Å; L312-L377 HydrophobicContact CD1-CD2 4Å; I362-L377 HydrophobicContact CG2-CD2 3.76Å; I362-L377 HydrophobicContact CG2-CG 4.37Å; V365-L377 HydrophobicContact CB-CD1 4.29Å; V365-L377 HydrophobicContact CG1-CD1 3.72Å; L366-L377 HydrophobicContact CD1-CD2 3.98Å; L366-L377 HydrophobicContact CD2-CD1 3.9Å; L366-L377 HydrophobicContact CD2-CD2 3.94Å; L366-L377 HydrophobicContact CG-CD1 4.09Å; L366-L377 HydrophobicContact CG-CD2 4.08Å; I372-L377 HydrophobicContact CB-CB 4.32Å; I372-L377 HydrophobicContact CD1-CD1 4.23Å; I372-L377 HydrophobicContact CG2-CB 4.1Å; H373-L377 PolarHBondContact O-N 2.97Å; E374-L377 WeakPolarHBondContact O-CB 3.44Å; E374-L377 PolarHBondContact O-N 3.4Å; E374-L377 VanDerWaalsContact O-N 3.09Å; L377-V379 PolarHBondContact O-N 3.3Å; L377-I380 PolarHBondContact O-N 2.59Å; L377-M381 VanDerWaalsContact O-CG 3.28Å; L377-M381 WeakPolarHBondContact O-CG 3.38Å; L377-M381 PolarHBondContact O-N 3.26Å
378	T	98.7	Very high	98.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.8	-46.2	173.9	-53.9	0	0	0	0	111	I188 N189 I191 W241 E374 R375 I380 M381 L382	I188-T378 WeakPolarHBondContact CD1-OG1 3.44Å; N189-T378 VanDerWaalsContact O-CG2 3.31Å; N189-T378 WeakPolarHBondContact O-CG2 3.19Å; N189-T378 PolarHBondContact O-OG1 2.86Å; I191-T378 HydrophobicContact CB-CG2 4.48Å; W241-T378 HydrophobicContact CH2-CG2 4.22Å; W241-T378 HydrophobicContact CZ3-CG2 3.65Å; E374-T378 PolarHBondContact O-N 3.01Å; E374-T378 PolarHBondContact O-OG1 3.31Å; R375-T378 PolarHBondContact O-N 3.46Å; T378-I380 VanDerWaalsContact C-N 3.35Å; T378-I380 PolarHBondContact O-N 3.03Å; T378-M381 WeakPolarHBondContact O-CB 3.29Å; T378-M381 PolarHBondContact O-N 3.35Å; T378-L382 HydrophobicContact CG2-CD1 4.1Å; T378-L382 HydrophobicContact CG2-CG 4.33Å; T378-L382 WeakPolarHBondContact O-CG 3.37Å; T378-L382 PolarHBondContact O-N 2.95Å
379	V	98.8	Very high	98.3	Very high	55 Å²	55	46.7 Å²	46.7	33%	0.333	24%	0.239	S	C	.	.	H	α-helix	trans	-57.3	-45.9	176.2	170.6	0	0	0	0	111.7	W241 R375 N376 L377 M381 L382 I383	W241-V379 HydrophobicContact CH2-CG2 3.68Å; W241-V379 HydrophobicContact CZ2-CG2 3.96Å; R375-V379 WeakPolarHBondContact O-CG2 3.3Å; R375-V379 PolarHBondContact O-N 3.49Å; N376-V379 PolarHBondContact O-N 3.2Å; L377-V379 PolarHBondContact O-N 3.3Å; V379-M381 VanDerWaalsContact C-N 3.32Å; V379-M381 PolarHBondContact O-N 2.96Å; V379-L382 PolarHBondContact O-N 3.41Å; V379-I383 HydrophobicContact CG1-CD1 3.82Å; V379-I383 HydrophobicContact CG1-CG1 4.39Å; V379-I383 VanDerWaalsContact O-CG1 3.32Å; V379-I383 WeakPolarHBondContact O-CG1 3.37Å; V379-I383 PolarHBondContact O-N 3.23Å
380	I	98.8	Very high	98.4	Very high	44 Å²	44	43 Å²	43	23%	0.226	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-44.5	177.5	-70	163.7	0	0	0	110.6	V365 I372 N376 L377 T378 L382 I383 I384	V365-I380 HydrophobicContact CG1-CG2 3.83Å; I372-I380 HydrophobicContact CD1-CD1 3.69Å; I372-I380 HydrophobicContact CG2-CD1 4.37Å; N376-I380 VanDerWaalsContact O-CG1 3.27Å; N376-I380 WeakPolarHBondContact O-CG1 3.35Å; N376-I380 PolarHBondContact O-N 2.71Å; L377-I380 PolarHBondContact O-N 2.59Å; T378-I380 VanDerWaalsContact C-N 3.35Å; T378-I380 PolarHBondContact O-N 3.03Å; I380-L382 VanDerWaalsContact C-N 3.34Å; I380-L382 PolarHBondContact O-N 3.31Å; I380-I383 PolarHBondContact O-N 3.08Å; I380-I384 HydrophobicContact CG2-CD1 4.15Å; I380-I384 WeakPolarHBondContact O-CG1 3.47Å; I380-I384 PolarHBondContact O-N 3.05Å
381	M	98.7	Very high	98.4	Very high	7 Å²	7	45.7 Å²	45.7	3%	0.034	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-38.9	177.5	-67.3	-63.2	-59.1	0	0	112.4	L185 I188 I191 L361 I362 V365 L377 T378 V379 I384 Q385	L185-M381 HydrophobicContact CD1-CE 3.79Å; I188-M381 HydrophobicContact CD1-CG 4.31Å; I191-M381 HydrophobicContact CD1-CB 3.5Å; I191-M381 VanDerWaalsContact CD1-CB 3.5Å; I191-M381 HydrophobicContact CD1-CG 4.3Å; L361-M381 HydrophobicContact CB-CE 4.25Å; L361-M381 HydrophobicContact CD2-CE 3.79Å; L361-M381 HydrophobicContact CG-CE 3.82Å; L361-M381 HydrophobicContact CG-SD 4.44Å; I362-M381 HydrophobicContact CG1-CE 3.97Å; I362-M381 HydrophobicContact CG1-SD 4.27Å; V365-M381 HydrophobicContact CB-SD 4.39Å; V365-M381 HydrophobicContact CG2-SD 3.73Å; L377-M381 VanDerWaalsContact O-CG 3.28Å; L377-M381 WeakPolarHBondContact O-CG 3.38Å; L377-M381 PolarHBondContact O-N 3.26Å; T378-M381 WeakPolarHBondContact O-CB 3.29Å; T378-M381 PolarHBondContact O-N 3.35Å; V379-M381 VanDerWaalsContact C-N 3.32Å; V379-M381 PolarHBondContact O-N 2.96Å; M381-I384 WeakPolarHBondContact O-CB 3.47Å; M381-I384 PolarHBondContact O-N 3.13Å; M381-I384 HydrophobicContact SD-CD1 4.25Å; M381-Q385 PolarHBondContact O-N 2.62Å
382	L	98.8	Very high	98.4	Very high	12 Å²	12	41.5 Å²	41.5	6%	0.063	22%	0.22	C	C	.	.	H	α-helix	trans	-69.9	-35	174.9	-62.7	175.2	0	0	0	112	I191 F198 F237 W241 T378 V379 I380 I384 Q385 V386	I191-L382 HydrophobicContact CD1-CD2 4.32Å; F198-L382 HydrophobicContact CD2-CB 4.32Å; F198-L382 HydrophobicContact CD2-CD2 3.98Å; F198-L382 HydrophobicContact CE2-CB 4.02Å; F198-L382 HydrophobicContact CE2-CD1 4.13Å; F198-L382 HydrophobicContact CE2-CD2 4.22Å; F198-L382 HydrophobicContact CE2-CG 4.34Å; F237-L382 HydrophobicContact CE2-CD1 4.33Å; F237-L382 HydrophobicContact CZ-CD1 4.23Å; W241-L382 HydrophobicContact CH2-CD1 4.22Å; W241-L382 HydrophobicContact CZ3-CD1 3.77Å; T378-L382 HydrophobicContact CG2-CD1 4.1Å; T378-L382 HydrophobicContact CG2-CG 4.33Å; T378-L382 WeakPolarHBondContact O-CG 3.37Å; T378-L382 PolarHBondContact O-N 2.95Å; V379-L382 PolarHBondContact O-N 3.41Å; I380-L382 VanDerWaalsContact C-N 3.34Å; I380-L382 PolarHBondContact O-N 3.31Å; L382-I384 VanDerWaalsContact C-N 3.33Å; L382-Q385 WeakPolarHBondContact O-CB 3.31Å; L382-Q385 PolarHBondContact O-N 2.94Å; L382-Q385 VanDerWaalsContact O-N 3.15Å; L382-V386 WeakPolarHBondContact O-CG2 3.43Å; L382-V386 PolarHBondContact O-N 2.84Å
383	I	98.8	Very high	98.4	Very high	90 Å²	90	42.5 Å²	42.5	46%	0.462	22%	0.224	S	C	.	.	H	α-helix	trans	-62.6	-41.9	170.8	-68.7	166.6	0	0	0	110.3	V379 I380 Q385 V386 M387	V379-I383 HydrophobicContact CG1-CD1 3.82Å; V379-I383 HydrophobicContact CG1-CG1 4.39Å; V379-I383 VanDerWaalsContact O-CG1 3.32Å; V379-I383 WeakPolarHBondContact O-CG1 3.37Å; V379-I383 PolarHBondContact O-N 3.23Å; I380-I383 PolarHBondContact O-N 3.08Å; I383-Q385 VanDerWaalsContact C-N 3.26Å; I383-Q385 PolarHBondContact O-N 3.04Å; I383-V386 PolarHBondContact O-N 3.28Å; I383-M387 HydrophobicContact CG2-CE 4.1Å; I383-M387 HydrophobicContact CG2-CG 4.33Å; I383-M387 HydrophobicContact CG2-SD 4.31Å; I383-M387 WeakPolarHBondContact O-CG 3.5Å; I383-M387 PolarHBondContact O-N 3.16Å
384	I	98.7	Very high	98.3	Very high	41 Å²	41	40.8 Å²	40.8	21%	0.21	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-39.6	173	-68.3	166.5	0	0	0	110.8	P279 V365 I380 M381 L382 M387 G388	P279-I384 HydrophobicContact CB-CG2 4.3Å; P279-I384 HydrophobicContact CG-CG2 4.14Å; V365-I384 HydrophobicContact CG2-CD1 3.67Å; I380-I384 HydrophobicContact CG2-CD1 4.15Å; I380-I384 WeakPolarHBondContact O-CG1 3.47Å; I380-I384 PolarHBondContact O-N 3.05Å; M381-I384 WeakPolarHBondContact O-CB 3.47Å; M381-I384 PolarHBondContact O-N 3.13Å; M381-I384 HydrophobicContact SD-CD1 4.25Å; L382-I384 VanDerWaalsContact C-N 3.33Å; I384-M387 HydrophobicContact CB-CE 4.4Å; I384-M387 HydrophobicContact CG1-CE 3.94Å; I384-M387 PolarHBondContact O-N 3.2Å; I384-G388 PolarHBondContact O-N 3.48Å
385	Q	98.8	Very high	98.1	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-44.2	174.7	-174.2	61	51.6	0	0	113.2	F198 I199 F276 M381 L382 I383 G388 S389	F198-Q385 HydrophobicContact CB-CG 3.83Å; I199-Q385 HydrophobicContact CG1-CG 4.46Å; I199-Q385 VanDerWaalsContact CG1-NE2 3.3Å; F276-Q385 PolarHBondContact O-NE2 2.96Å; M381-Q385 PolarHBondContact O-N 2.62Å; L382-Q385 WeakPolarHBondContact O-CB 3.31Å; L382-Q385 PolarHBondContact O-N 2.94Å; L382-Q385 VanDerWaalsContact O-N 3.15Å; I383-Q385 VanDerWaalsContact C-N 3.26Å; I383-Q385 PolarHBondContact O-N 3.04Å; Q385-G388 PolarHBondContact O-N 3.22Å; Q385-S389 PolarHBondContact O-N 3.19Å; Q385-S389 PolarHBondContact O-OG 2.94Å
386	V	98.6	Very high	97.9	Very high	65 Å²	65	40 Å²	40	39%	0.394	22%	0.221	S	C	.	.	H	α-helix	trans	-64.4	-44.2	176.2	173.8	0	0	0	0	110.8	F198 L382 I383 G388 S389 A390	F198-V386 HydrophobicContact CD1-CG2 3.38Å; F198-V386 HydrophobicContact CE1-CG2 3.48Å; F198-V386 VanDerWaalsContact CE1-CG2 3.48Å; F198-V386 HydrophobicContact CG-CG2 4.07Å; F198-V386 HydrophobicContact CZ-CG2 4.25Å; L382-V386 WeakPolarHBondContact O-CG2 3.43Å; L382-V386 PolarHBondContact O-N 2.84Å; I383-V386 PolarHBondContact O-N 3.28Å; V386-G388 VanDerWaalsContact C-N 3.35Å; V386-G388 PolarHBondContact O-N 3.01Å; V386-S389 WeakPolarHBondContact O-CB 3.33Å; V386-S389 PolarHBondContact O-N 3.24Å; V386-S389 VanDerWaalsContact O-N 3.15Å; V386-A390 PolarHBondContact O-N 2.9Å
387	M	98.6	Very high	97.6	Very high	112 Å²	112	40.9 Å²	40.9	55%	0.552	22%	0.22	S	C	*	.	H	α-helix	trans	-62.2	-41.4	175.9	-70.2	-171.3	-59.1	0	0	111.9	I383 I384 S389 A390 L391	I383-M387 HydrophobicContact CG2-CE 4.1Å; I383-M387 HydrophobicContact CG2-CG 4.33Å; I383-M387 HydrophobicContact CG2-SD 4.31Å; I383-M387 WeakPolarHBondContact O-CG 3.5Å; I383-M387 PolarHBondContact O-N 3.16Å; I384-M387 HydrophobicContact CB-CE 4.4Å; I384-M387 HydrophobicContact CG1-CE 3.94Å; I384-M387 PolarHBondContact O-N 3.2Å; M387-S389 VanDerWaalsContact C-N 3.29Å; M387-S389 PolarHBondContact O-N 3.19Å; M387-A390 PolarHBondContact O-N 3.31Å; M387-L391 WeakPolarHBondContact O-CB 3.46Å; M387-L391 PolarHBondContact O-N 3.37Å
388	G	98.4	Very high	97.3	Very high	6 Å²	6	48 Å²	48	6%	0.062	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-40.2	173.2	0	0	0	0	0	112.1	I384 Q385 V386 L391 A392	I384-G388 PolarHBondContact O-N 3.48Å; Q385-G388 PolarHBondContact O-N 3.22Å; V386-G388 VanDerWaalsContact C-N 3.35Å; V386-G388 PolarHBondContact O-N 3.01Å; G388-L391 PolarHBondContact O-N 3.45Å; G388-A392 WeakPolarHBondContact O-CB 3.19Å; G388-A392 PolarHBondContact O-N 3.39Å
389	S	98.1	Very high	96.9	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.028	27%	0.271	C	S	.	.	H	α-helix	trans	-68.7	-41	176.2	-56.4	0	0	0	0	112.7	S202 Q385 V386 M387 L391 A392 F393	S202-S389 WeakPolarHBondContact OG-CB 3.49Å; S202-S389 PolarHBondContact OG-OG 3.3Å; Q385-S389 PolarHBondContact O-N 3.19Å; Q385-S389 PolarHBondContact O-OG 2.94Å; V386-S389 WeakPolarHBondContact O-CB 3.33Å; V386-S389 PolarHBondContact O-N 3.24Å; V386-S389 VanDerWaalsContact O-N 3.15Å; M387-S389 VanDerWaalsContact C-N 3.29Å; M387-S389 PolarHBondContact O-N 3.19Å; S389-L391 VanDerWaalsContact C-N 3.33Å; S389-L391 PolarHBondContact O-N 3.23Å; S389-A392 WeakPolarHBondContact O-CB 3.39Å; S389-A392 PolarHBondContact O-N 2.94Å; S389-F393 WeakPolarHBondContact O-CD2 3.48Å; S389-F393 PolarHBondContact O-N 3.01Å
390	A	98.2	Very high	96.4	Very high	63 Å²	63	49.9 Å²	49.9	52%	0.521	26%	0.261	S	S	.	.	H	α-helix	trans	-62.5	-41.3	174.4	0	0	0	0	0	111.5	V386 M387 F393 G394	V386-A390 PolarHBondContact O-N 2.9Å; M387-A390 PolarHBondContact O-N 3.31Å; A390-F393 PolarHBondContact O-N 3.41Å; A390-G394 PolarHBondContact O-N 2.98Å
391	L	97.7	Very high	95.8	Very high	93 Å²	93	56.1 Å²	56.1	49%	0.487	28%	0.282	S	S	.	.	H	α-helix	trans	-62.1	-42.9	172.6	177.9	60.5	0	0	0	111.3	I278 M387 G388 S389 F393 G394 I395	I278-L391 HydrophobicContact CD1-CD2 4.19Å; I278-L391 HydrophobicContact CD1-CG 4.44Å; M387-L391 WeakPolarHBondContact O-CB 3.46Å; M387-L391 PolarHBondContact O-N 3.37Å; G388-L391 PolarHBondContact O-N 3.45Å; S389-L391 VanDerWaalsContact C-N 3.33Å; S389-L391 PolarHBondContact O-N 3.23Å; L391-F393 PolarHBondContact O-N 2.86Å; L391-G394 PolarHBondContact O-N 3.36Å; L391-I395 HydrophobicContact CD1-CD1 4.13Å; L391-I395 HydrophobicContact CD1-CG1 4.24Å; L391-I395 HydrophobicContact CG-CD1 3.93Å; L391-I395 HydrophobicContact CG-CG1 4.47Å; L391-I395 VanDerWaalsContact O-CG1 3.28Å; L391-I395 WeakPolarHBondContact O-CG1 3.39Å; L391-I395 PolarHBondContact O-N 3.44Å
392	A	97.2	Very high	95.1	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.9	-44.9	175.8	0	0	0	0	0	112.1	L275 F276 G388 S389 I395 R396	L275-A392 HydrophobicContact CB-CB 3.51Å; F276-A392 HydrophobicContact CD1-CB 3.62Å; F276-A392 HydrophobicContact CE1-CB 3.73Å; G388-A392 WeakPolarHBondContact O-CB 3.19Å; G388-A392 PolarHBondContact O-N 3.39Å; S389-A392 WeakPolarHBondContact O-CB 3.39Å; S389-A392 PolarHBondContact O-N 2.94Å; A392-I395 PolarHBondContact O-N 3.41Å; A392-R396 WeakPolarHBondContact O-CB 3.5Å; A392-R396 PolarHBondContact O-N 2.97Å
393	F	97.6	Very high	94.5	Very high	40 Å²	40	64.7 Å²	64.7	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	-62.8	-43.7	174	-79.1	-59.2	0	0	0	112.5	S202 V205 F206 L209 F276 S389 A390 L391 I395 R396 Y397	S202-F393 WeakPolarHBondContact O-CZ 3.34Å; V205-F393 HydrophobicContact CB-CZ 4.07Å; V205-F393 HydrophobicContact CG1-CE1 4.44Å; V205-F393 HydrophobicContact CG1-CE2 4.38Å; V205-F393 HydrophobicContact CG1-CZ 3.8Å; F206-F393 HydrophobicContact CB-CE1 3.83Å; F206-F393 HydrophobicContact CB-CZ 4.1Å; F206-F393 HydrophobicContact CD2-CE1 4.4Å; L209-F393 HydrophobicContact CD1-CE1 4.28Å; F276-F393 HydrophobicContact CE1-CD1 4.43Å; F276-F393 HydrophobicContact CE1-CD2 4.05Å; F276-F393 HydrophobicContact CE1-CE1 4.24Å; F276-F393 AromaticContact CE1-CE2 3.8Å; F276-F393 HydrophobicContact CE1-CE2 3.8Å; F276-F393 HydrophobicContact CE1-CG 4.36Å; F276-F393 AromaticContact CE1-CZ 3.92Å; F276-F393 HydrophobicContact CE1-CZ 3.92Å; F276-F393 HydrophobicContact CZ-CD1 4.31Å; F276-F393 AromaticContact CZ-CE1 3.84Å; F276-F393 HydrophobicContact CZ-CE1 3.84Å; F276-F393 HydrophobicContact CZ-CE2 4.1Å; F276-F393 AromaticContact CZ-CZ 3.72Å; F276-F393 HydrophobicContact CZ-CZ 3.72Å; S389-F393 WeakPolarHBondContact O-CD2 3.48Å; S389-F393 PolarHBondContact O-N 3.01Å; A390-F393 PolarHBondContact O-N 3.41Å; L391-F393 PolarHBondContact O-N 2.86Å; F393-I395 VanDerWaalsContact C-N 3.3Å; F393-I395 PolarHBondContact O-N 2.82Å; F393-R396 PolarHBondContact O-N 3.47Å; F393-Y397 HydrophobicContact CB-CD2 4.48Å; F393-Y397 HydrophobicContact CD1-CD2 4.01Å; F393-Y397 AromaticContact CD1-CE2 3.59Å; F393-Y397 HydrophobicContact CD1-CE2 3.59Å; F393-Y397 HydrophobicContact CE1-CE2 4.08Å; F393-Y397 PolarHBondContact O-N 3.23Å
394	G	96.6	Very high	93.9	Very high	23 Å²	23	62.7 Å²	62.7	24%	0.237	31%	0.31	C	S	.	.	H	α-helix	trans	-59.7	-41.2	174.3	0	0	0	0	0	112.3	A390 L391 H398 L399	A390-G394 PolarHBondContact O-N 2.98Å; L391-G394 PolarHBondContact O-N 3.36Å; G394-H398 WeakPolarHBondContact O-CB 3.33Å; G394-H398 PolarHBondContact O-N 3.28Å; G394-L399 PolarHBondContact O-N 3.43Å
395	I	94.1	Very high	92.9	Very high	39 Å²	39	65.4 Å²	65.4	20%	0.2	33%	0.326	C	S	.	.	I	π-helix	trans	-63.5	-49.3	174.8	-68.5	165	0	0	0	110.4	L275 L391 A392 F393 L399 V400	L275-I395 HydrophobicContact CD1-CB 4.25Å; L275-I395 HydrophobicContact CD1-CG2 3.82Å; L275-I395 HydrophobicContact CD2-CD1 4.31Å; L391-I395 HydrophobicContact CD1-CD1 4.13Å; L391-I395 HydrophobicContact CD1-CG1 4.24Å; L391-I395 HydrophobicContact CG-CD1 3.93Å; L391-I395 HydrophobicContact CG-CG1 4.47Å; L391-I395 VanDerWaalsContact O-CG1 3.28Å; L391-I395 WeakPolarHBondContact O-CG1 3.39Å; L391-I395 PolarHBondContact O-N 3.44Å; A392-I395 PolarHBondContact O-N 3.41Å; F393-I395 VanDerWaalsContact C-N 3.3Å; F393-I395 PolarHBondContact O-N 2.82Å; I395-L399 HydrophobicContact CG1-CD1 4.1Å; I395-L399 CarbonylContact O-C 3.58Å; I395-L399 WeakPolarHBondContact O-CA 3.39Å; I395-L399 PolarHBondContact O-N 2.97Å; I395-L399 VanDerWaalsContact O-N 3.12Å; I395-V400 PolarHBondContact O-N 3.13Å
396	R	93.3	Very high	91.5	Very high	76 Å²	76	71.2 Å²	71.2	29%	0.287	36%	0.361	S	S	.	.	I	π-helix	trans	-64.2	-45.6	-176.9	173.2	58.5	-179.1	179.2	-1.1	112.9	F206 E210 T272 A392 F393 V400	F206-R396 HydrophobicContact CE2-CG 4.22Å; E210-R396 IonicContact OE1-NE 2.86Å; E210-R396 IonicContact OE1-NH2 3.2Å; E210-R396 IonicContact OE2-NH2 2.64Å; E210-R396 PolarHBondContact OE2-NH2 2.93Å; T272-R396 HydrophobicContact CG2-CG 4.49Å; A392-R396 WeakPolarHBondContact O-CB 3.5Å; A392-R396 PolarHBondContact O-N 2.97Å; F393-R396 PolarHBondContact O-N 3.47Å; R396-V400 VanDerWaalsContact O-CB 3.28Å; R396-V400 WeakPolarHBondContact O-CB 3.47Å; R396-V400 VanDerWaalsContact O-CG1 3.23Å; R396-V400 WeakPolarHBondContact O-CG1 3.35Å
397	Y	92.8	Very high	91.1	Very high	86 Å²	86	71.6 Å²	71.6	34%	0.337	36%	0.359	S	S	.	.	I	π-helix	trans	-95.8	-18.9	-171.4	-69.1	-61.1	0	0	0	114.6	L209 E210 F393	L209-Y397 WeakPolarHBondContact CB-OH 3.39Å; L209-Y397 HydrophobicContact CD1-CE2 3.79Å; E210-Y397 WeakPolarHBondContact OE1-CE1 3.37Å; E210-Y397 VanDerWaalsContact OE1-CZ 3.27Å; E210-Y397 PolarHBondContact OE1-OH 3.23Å; F393-Y397 HydrophobicContact CB-CD2 4.48Å; F393-Y397 HydrophobicContact CD1-CD2 4.01Å; F393-Y397 AromaticContact CD1-CE2 3.59Å; F393-Y397 HydrophobicContact CD1-CE2 3.59Å; F393-Y397 HydrophobicContact CE1-CE2 4.08Å; F393-Y397 PolarHBondContact O-N 3.23Å
398	H	92.2	Very high	90.7	Very high	149 Å²	149	69.4 Å²	69.4	69%	0.69	35%	0.349	S	S	*	.	I	π-helix	trans	-120.3	-39.7	-179.3	-58.3	-55.7	0	0	0	113.7	G394	G394-H398 WeakPolarHBondContact O-CB 3.33Å; G394-H398 PolarHBondContact O-N 3.28Å
399	L	89.8	Confident	90.3	Very high	74 Å²	74	72.9 Å²	72.9	39%	0.387	37%	0.365	S	S	.	.	I	π-helix	trans	-96.8	-6.3	-173.7	-51.9	177.8	0	0	0	113.9	G394 I395 R401 L402 F403	G394-L399 PolarHBondContact O-N 3.43Å; I395-L399 HydrophobicContact CG1-CD1 4.1Å; I395-L399 CarbonylContact O-C 3.58Å; I395-L399 WeakPolarHBondContact O-CA 3.39Å; I395-L399 PolarHBondContact O-N 2.97Å; I395-L399 VanDerWaalsContact O-N 3.12Å; L399-R401 PolarHBondContact O-N 2.94Å; L399-R401 VanDerWaalsContact O-N 3.12Å; L399-L402 HydrophobicContact CB-CD1 4.19Å; L399-L402 HydrophobicContact CD2-CD1 3.95Å; L399-L402 VanDerWaalsContact O-CB 3.26Å; L399-L402 WeakPolarHBondContact O-CB 3.34Å; L399-L402 PolarHBondContact O-N 2.94Å; L399-F403 WeakPolarHBondContact O-CD2 3.42Å
400	V	87.9	Confident	89.8	Confident	21 Å²	21	77 Å²	77	13%	0.127	39%	0.385	C	S	.	.	H	α-helix	trans	-57.5	-32.6	-178	72.8	0	0	0	0	112	I395 R396 L402 F403 Y404 V406	I395-V400 PolarHBondContact O-N 3.13Å; R396-V400 VanDerWaalsContact O-CB 3.28Å; R396-V400 WeakPolarHBondContact O-CB 3.47Å; R396-V400 VanDerWaalsContact O-CG1 3.23Å; R396-V400 WeakPolarHBondContact O-CG1 3.35Å; V400-L402 PolarHBondContact O-N 3.09Å; V400-F403 CarbonylContact O-C 3.53Å; V400-F403 PolarHBondContact O-N 2.85Å; V400-Y404 HydrophobicContact CG2-CD2 3.91Å; V400-Y404 PolarHBondContact O-N 2.96Å; V400-V406 HydrophobicContact CG1-CB 4.13Å; V400-V406 HydrophobicContact CG1-CG1 4.37Å; V400-V406 HydrophobicContact CG1-CG2 4.09Å; V400-V406 HydrophobicContact CG2-CG2 3.94Å
401	R	86.4	Confident	89.3	Confident	176 Å²	176	77.9 Å²	77.9	66%	0.664	38%	0.377	S	S	*	.	H	α-helix	trans	-63.4	-22.1	176.2	-69.2	-176.6	175	160.8	5.5	114.1	K151 L399 F403 Y404 V406	K151-R401 PolarHBondContact NZ-O 3.07Å; L399-R401 PolarHBondContact O-N 2.94Å; L399-R401 VanDerWaalsContact O-N 3.12Å; R401-F403 VanDerWaalsContact C-N 3.26Å; R401-Y404 CarbonylContact C-O 3.47Å; R401-Y404 WeakPolarHBondContact CA-O 3.42Å; R401-V406 PolarHBondContact NE-O 3.41Å
402	L	85.3	Confident	88.8	Confident	112 Å²	112	76.9 Å²	76.9	59%	0.586	37%	0.369	S	S	*	.	H	α-helix	trans	-72.1	-24.4	172.9	-61	178.4	0	0	0	111.9	K151 L399 V400	K151-L402 WeakPolarHBondContact CD-O 3.46Å; L399-L402 HydrophobicContact CB-CD1 4.19Å; L399-L402 HydrophobicContact CD2-CD1 3.95Å; L399-L402 VanDerWaalsContact O-CB 3.26Å; L399-L402 WeakPolarHBondContact O-CB 3.34Å; L399-L402 PolarHBondContact O-N 2.94Å; V400-L402 PolarHBondContact O-N 3.09Å
403	F	85	Confident	88.2	Confident	87 Å²	87	82.4 Å²	82.4	38%	0.382	40%	0.396	S	S	.	.	H	α-helix	trans	-110	-28.4	-174.9	-62.3	-79.2	0	0	0	113.1	P150 K151 L399 V400 R401	P150-F403 CarbonylContact C-O 3.57Å; P150-F403 VanDerWaalsContact CA-O 3.26Å; P150-F403 WeakPolarHBondContact CA-O 3.31Å; P150-F403 HydrophobicContact CB-CB 4.47Å; K151-F403 WeakPolarHBondContact CG-O 3.15Å; K151-F403 PolarHBondContact N-O 3.18Å; L399-F403 WeakPolarHBondContact O-CD2 3.42Å; V400-F403 CarbonylContact O-C 3.53Å; V400-F403 PolarHBondContact O-N 2.85Å; R401-F403 VanDerWaalsContact C-N 3.26Å
404	Y	86.8	Confident	87.4	Confident	47 Å²	47	85.6 Å²	85.6	18%	0.184	41%	0.413	C	S	.	.	S	Bend	trans	-137.1	160.3	-174.1	-63.4	-69.5	0	0	0	110.5	V148 P150 K151 K271 V400 R401 V406	V148-Y404 HydrophobicContact CB-CD1 4.34Å; V148-Y404 HydrophobicContact CB-CE1 4.13Å; V148-Y404 HydrophobicContact CG1-CD1 3.68Å; V148-Y404 HydrophobicContact CG1-CE1 3.87Å; V148-Y404 WeakPolarHBondContact O-CE1 3.22Å; P150-Y404 HydrophobicContact CB-CE1 4.44Å; P150-Y404 HydrophobicContact CG-CE1 4.32Å; K151-Y404 WeakPolarHBondContact CE-O 3.07Å; K151-Y404 PolarHBondContact NZ-O 3.4Å; K271-Y404 PolarHBondContact NZ-OH 2.06Å; K271-Y404 VanDerWaalsContact NZ-OH 3.14Å; V400-Y404 HydrophobicContact CG2-CD2 3.91Å; V400-Y404 PolarHBondContact O-N 2.96Å; R401-Y404 CarbonylContact C-O 3.47Å; R401-Y404 WeakPolarHBondContact CA-O 3.42Å; Y404-V406 PolarHBondContact O-N 3.27Å
405	D	78.2	Confident	86.7	Confident	99 Å²	99	90.8 Å²	90.8	53%	0.529	43%	0.427	S	S	.	.			trans	-90.7	102	169.9	-57.1	-51.9	0	0	0	106.4	K151 R154	K151-D405 WeakPolarHBondContact CE-OD1 3.23Å; K151-D405 IonicContact NZ-OD1 3.4Å; K151-D405 PolarHBondContact NZ-OD1 3.32Å; R154-D405 IonicContact CZ-OD2 2.63Å; R154-D405 IonicContact NH1-OD1 3.14Å; R154-D405 IonicContact NH1-OD2 3.93Å; R154-D405 PolarHBondContact NH1-OD2 3.17Å; R154-D405 IonicContact NH2-OD2 3.76Å; R154-D405 PolarHBondContact NH2-OD2 2.85Å
406	V	68.3	Low	86	Confident	124 Å²	124	95.5 Å²	95.5	75%	0.752	45%	0.448	S	S	*	.			trans	-131.2	0	-175	-168.8	0	0	0	0	109.8	V400 R401 Y404	V400-V406 HydrophobicContact CG1-CB 4.13Å; V400-V406 HydrophobicContact CG1-CG1 4.37Å; V400-V406 HydrophobicContact CG1-CG2 4.09Å; V400-V406 HydrophobicContact CG2-CG2 3.94Å; R401-V406 PolarHBondContact NE-O 3.41Å; Y404-V406 PolarHBondContact O-N 3.27Å

Retrieved 406 of 406 residues in 1179.5 ms (Link to these results)

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