A0A096N5E0_PAPAN Loading...

Ceramide synthase 1

AlphaFold DB (A0A2K5V8P6), UniProt , Accession A0A096N5E0, Species PAPAN (Papio anubis, Olive baboon), Gene CERS1, Length 350 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	36.3	Very low	38.9	Very low	243 Å²	243	126.5 Å²	126.5	100%	1.197	83%	0.828	S	S	*	*				0	97.6	0	-77.2	167.8	72.7	0	0	107.5
2	A	34.4	Very low	40.5	Very low	106 Å²	106	119.8 Å²	119.8	88%	0.876	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.6	116.4	171.2	0	0	0	0	0	107.2	A4	A2-A4 PolarHBondContact O-N 3.35Å
3	A	33.1	Very low	42.1	Very low	97 Å²	97	118 Å²	118	80%	0.802	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-66	124.3	172.8	0	0	0	0	0	108.3	E5	A3-E5 PolarHBondContact O-N 3.35Å
4	A	36.8	Very low	44	Very low	100 Å²	100	114.4 Å²	114.4	83%	0.826	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-66.4	119.5	169.6	0	0	0	0	0	108.1	A2	A2-A4 PolarHBondContact O-N 3.35Å
5	E	34.7	Very low	46.2	Very low	178 Å²	178	113.9 Å²	113.9	83%	0.832	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-61.5	139.6	168.8	-72.5	-173.2	151	0	0	109.6	A3 V7	A3-E5 PolarHBondContact O-N 3.35Å; E5-V7 PolarHBondContact O-N 2.94Å
6	P	37.5	Very low	48.5	Very low	123 Å²	123	111.7 Å²	111.7	80%	0.799	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-66.4	120.2	172.7	27.6	-30.1	0	0	0	108.4	A8	P6-A8 PolarHBondContact O-N 3.04Å
7	V	39.9	Very low	51	Low	143 Å²	143	105.6 Å²	105.6	87%	0.867	69%	0.686	S	S	*	*			trans	-60.5	106.5	169.4	177.5	0	0	0	0	107.1	E5 G9	E5-V7 PolarHBondContact O-N 2.94Å; V7-G9 PolarHBondContact O-N 2.89Å; V7-G9 VanDerWaalsContact O-N 3.09Å
8	A	38.9	Very low	53.4	Low	90 Å²	90	102.9 Å²	102.9	74%	0.744	67%	0.67	S	S	*	*			trans	-57.2	115.6	173.3	0	0	0	0	0	108.7	P6	P6-A8 PolarHBondContact O-N 3.04Å
9	G	43	Very low	55.5	Low	52 Å²	52	102.8 Å²	102.8	54%	0.536	66%	0.655	S	S	.	*			trans	-58.1	149.4	168.1	0	0	0	0	0	110	V7 T11	V7-G9 PolarHBondContact O-N 2.89Å; V7-G9 VanDerWaalsContact O-N 3.09Å; G9-T11 PolarHBondContact O-N 2.84Å
10	P	45.9	Very low	57.4	Low	109 Å²	109	101.3 Å²	101.3	71%	0.708	65%	0.652	S	S	*	*			trans	-58.4	126.1	-176	23.9	-31.4	0	0	0	110.6	G12	P10-G12 PolarHBondContact O-N 2.97Å
11	T	47.2	Very low	59.1	Low	151 Å²	151	99.4 Å²	99.4	93%	0.926	64%	0.635	S	S	*	*	S	Bend	trans	-73.6	92.5	172.8	49.7	0	0	0	0	109.1	G9	G9-T11 PolarHBondContact O-N 2.84Å
12	G	57.9	Low	61.8	Low	45 Å²	45	88.6 Å²	88.6	46%	0.464	58%	0.582	S	S	.	*	S	Bend	trans	109.8	158.2	176	0	0	0	0	0	113.9	P10 E14	P10-G12 PolarHBondContact O-N 2.97Å; G12-E14 PolarHBondContact O-N 2.8Å
13	P	61.7	Low	64.6	Low	97 Å²	97	88.4 Å²	88.4	63%	0.63	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-58.3	131.3	179	22	-30.8	0	0	0	110.5	D130	P13-D130 HydrophobicContact CB-CB 4.44Å
14	E	68.6	Low	67.5	Low	67 Å²	67	92.2 Å²	92.2	31%	0.313	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-61.5	129.2	179	-163.7	-175.7	175.9	0	0	108.5	G12 R25 Y265	G12-E14 PolarHBondContact O-N 2.8Å; E14-R25 IonicContact OE1-NH1 2.9Å; E14-R25 PolarHBondContact OE1-NH1 3.24Å; E14-Y265 PolarHBondContact OE1-OH 3.28Å; E14-Y265 VanDerWaalsContact OE1-OH 3.07Å
15	P	77.7	Confident	70.2	Confident	107 Å²	107	91.1 Å²	91.1	70%	0.695	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-59.9	144.2	179.9	24.2	-33.8	0	0	0	110.5
16	M	82.9	Confident	72.9	Confident	79 Å²	79	83 Å²	83	39%	0.389	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-55.5	130.7	-179.5	-168.3	177.4	-59.5	0	0	110.3	L261 K262	M16-L261 HydrophobicContact CG-CB 3.88Å; M16-L261 HydrophobicContact CG-CD1 4.38Å; M16-L261 HydrophobicContact SD-CB 3.97Å; M16-L261 HydrophobicContact SD-CD1 4.12Å; M16-K262 HydrophobicContact CE-CD 4.5Å; M16-K262 HydrophobicContact CE-CG 4.16Å
17	P	91.1	Very high	75.4	Confident	9 Å²	9	85.6 Å²	85.6	6%	0.058	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-71.1	159	-175.2	33.3	-41.6	0	0	0	111.5	Q21 L261 Y265	P17-Q21 VanDerWaalsContact CA-OE1 3.3Å; P17-Q21 HydrophobicContact CB-CB 4.06Å; P17-L261 WeakPolarHBondContact CD-O 3.19Å; P17-L261 HydrophobicContact CG-CB 4.36Å; P17-L261 HydrophobicContact CG-CD2 4.35Å; P17-L261 WeakPolarHBondContact CG-O 3.43Å; P17-L261 WeakPolarHBondContact O-CD2 3.11Å; P17-Y265 HydrophobicContact CB-CD1 4.38Å; P17-Y265 HydrophobicContact CB-CD2 3.95Å; P17-Y265 HydrophobicContact CB-CE1 4.37Å; P17-Y265 HydrophobicContact CB-CE2 3.94Å; P17-Y265 HydrophobicContact CB-CG 4.18Å; P17-Y265 HydrophobicContact CG-CD1 3.71Å; P17-Y265 HydrophobicContact CG-CD2 3.73Å; P17-Y265 HydrophobicContact CG-CE1 4.14Å; P17-Y265 HydrophobicContact CG-CE2 4.17Å; P17-Y265 HydrophobicContact CG-CG 3.48Å; P17-Y265 VanDerWaalsContact CG-CG 3.48Å
18	S	93.5	Very high	77.9	Confident	56 Å²	56	80.5 Å²	80.5	39%	0.392	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-79.4	161.4	160.8	71.5	0	0	0	0	111.4	A20 Q21 L22	S18-A20 PolarHBondContact O-N 2.82Å; S18-Q21 WeakPolarHBondContact O-CB 3.41Å; S18-Q21 PolarHBondContact O-N 3.07Å; S18-Q21 WeakPolarHBondContact OG-CG 3.28Å; S18-Q21 PolarHBondContact OG-N 3.35Å; S18-L22 PolarHBondContact O-N 3.31Å
19	Y	93.2	Very high	80.4	Confident	101 Å²	101	77.2 Å²	77.2	40%	0.396	44%	0.444	S	S	.	.	H	α-helix	trans	-56.5	-37	172.9	-74.3	-79.5	0	0	0	112.8	Q21 L22 V23 L256 Y257 P260 L261	Y19-Q21 VanDerWaalsContact C-N 3.32Å; Y19-Q21 PolarHBondContact O-N 3.32Å; Y19-L22 HydrophobicContact CD1-CD2 4.45Å; Y19-L22 PolarHBondContact O-N 2.94Å; Y19-V23 WeakPolarHBondContact O-CG2 3.15Å; Y19-V23 PolarHBondContact O-N 3.37Å; Y19-L256 VanDerWaalsContact OH-C 3.28Å; Y19-L256 PolarHBondContact OH-O 2.53Å; Y19-Y257 HydrophobicContact CE2-CD2 4.17Å; Y19-Y257 WeakPolarHBondContact OH-CA 3.25Å; Y19-P260 HydrophobicContact CE1-CB 3.96Å; Y19-P260 HydrophobicContact CE1-CG 4.34Å; Y19-L261 HydrophobicContact CD1-CD2 4.1Å; Y19-L261 HydrophobicContact CD2-CD2 4.47Å; Y19-L261 HydrophobicContact CE1-CD2 4.29Å; Y19-L261 HydrophobicContact CG-CD2 4.21Å
20	A	93.5	Very high	82.7	Confident	72 Å²	72	75.9 Å²	75.9	60%	0.595	43%	0.427	S	S	*	.	H	α-helix	trans	-63.4	-40.2	177.1	0	0	0	0	0	111.4	S18 R24	S18-A20 PolarHBondContact O-N 2.82Å; A20-R24 WeakPolarHBondContact O-CB 3.41Å; A20-R24 PolarHBondContact O-N 3.4Å
21	Q	92.9	Very high	84.8	Confident	63 Å²	63	73.5 Å²	73.5	29%	0.294	41%	0.408	S	S	.	.	H	α-helix	trans	-66.7	-44.6	173.8	-72.9	170.1	-36.4	0	0	111.5	P17 S18 Y19 V23 R24 R25	P17-Q21 VanDerWaalsContact CA-OE1 3.3Å; P17-Q21 HydrophobicContact CB-CB 4.06Å; S18-Q21 WeakPolarHBondContact O-CB 3.41Å; S18-Q21 PolarHBondContact O-N 3.07Å; S18-Q21 WeakPolarHBondContact OG-CG 3.28Å; S18-Q21 PolarHBondContact OG-N 3.35Å; Y19-Q21 VanDerWaalsContact C-N 3.32Å; Y19-Q21 PolarHBondContact O-N 3.32Å; Q21-V23 PolarHBondContact O-N 3.46Å; Q21-R24 PolarHBondContact O-N 2.9Å; Q21-R25 WeakPolarHBondContact O-CB 3.39Å; Q21-R25 WeakPolarHBondContact O-CG 3.45Å; Q21-R25 PolarHBondContact O-N 2.98Å
22	L	93	Very high	86.8	Confident	16 Å²	16	69.2 Å²	69.2	8%	0.084	39%	0.388	C	S	.	.	H	α-helix	trans	-55	-53.2	175.4	168.3	63.5	0	0	0	111.3	S18 Y19 G26 P260 L261 L264 Y265	S18-L22 PolarHBondContact O-N 3.31Å; Y19-L22 HydrophobicContact CD1-CD2 4.45Å; Y19-L22 PolarHBondContact O-N 2.94Å; L22-G26 WeakPolarHBondContact O-CA 3.41Å; L22-G26 PolarHBondContact O-N 3.12Å; L22-P260 HydrophobicContact CD2-CB 3.76Å; L22-L261 HydrophobicContact CD2-CD2 4.35Å; L22-L264 HydrophobicContact CD1-CB 4.1Å; L22-L264 HydrophobicContact CD2-CB 4.42Å; L22-Y265 HydrophobicContact CB-CD2 4.48Å; L22-Y265 VanDerWaalsContact CD1-CA 3.49Å; L22-Y265 HydrophobicContact CD1-CD2 4.12Å
23	V	93.2	Very high	88.2	Confident	102 Å²	102	68.4 Å²	68.4	62%	0.618	38%	0.378	S	S	*	.	H	α-helix	trans	-63.3	-50.8	-178.5	172.2	0	0	0	0	110.3	Y19 Q21 W27	Y19-V23 WeakPolarHBondContact O-CG2 3.15Å; Y19-V23 PolarHBondContact O-N 3.37Å; Q21-V23 PolarHBondContact O-N 3.46Å; V23-W27 WeakPolarHBondContact O-CB 3.31Å; V23-W27 PolarHBondContact O-N 3.19Å
24	R	94.9	Very high	89.4	Confident	176 Å²	176	66.3 Å²	66.3	66%	0.664	37%	0.368	S	S	*	.	H	α-helix	trans	-63.8	-48.3	-177.1	-175.2	178.7	64.6	-174.8	-0.2	112.4	A20 Q21 G28	A20-R24 WeakPolarHBondContact O-CB 3.41Å; A20-R24 PolarHBondContact O-N 3.4Å; Q21-R24 PolarHBondContact O-N 2.9Å; R24-G28 PolarHBondContact O-N 2.83Å
25	R	92.9	Very high	90.3	Very high	78 Å²	78	72.8 Å²	72.8	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-73.8	-44.6	-177.5	-68.5	-177.3	171.9	-178.5	-1.4	111.4	E14 Q21 G28 S29 Y265 H269	E14-R25 IonicContact OE1-NH1 2.9Å; E14-R25 PolarHBondContact OE1-NH1 3.24Å; Q21-R25 WeakPolarHBondContact O-CB 3.39Å; Q21-R25 WeakPolarHBondContact O-CG 3.45Å; Q21-R25 PolarHBondContact O-N 2.98Å; R25-G28 PolarHBondContact O-N 3.08Å; R25-S29 WeakPolarHBondContact O-CB 3.31Å; R25-S29 PolarHBondContact O-N 3.12Å; R25-S29 PolarHBondContact O-OG 3.4Å; R25-Y265 HydrophobicContact CB-CE2 4.42Å; R25-Y265 PolarHBondContact NH1-OH 3.49Å; R25-H269 HydrophobicContact CB-CB 4.44Å
26	G	90.9	Very high	90.5	Very high	7 Å²	7	70.2 Å²	70.2	7%	0.072	38%	0.383	C	S	.	.	H	α-helix	trans	-62.7	-44.9	177.9	0	0	0	0	0	112.3	L22 S29 A30	L22-G26 WeakPolarHBondContact O-CA 3.41Å; L22-G26 PolarHBondContact O-N 3.12Å; G26-S29 PolarHBondContact O-N 2.81Å; G26-A30 WeakPolarHBondContact O-CB 3.31Å; G26-A30 PolarHBondContact O-N 3.36Å
27	W	90.9	Very high	90.2	Very high	178 Å²	178	69.4 Å²	69.4	67%	0.674	38%	0.384	S	S	*	.	H	α-helix	trans	-64.2	-43	174.3	-175.3	-103.8	0	0	0	112.1	V23 A30 L31	V23-W27 WeakPolarHBondContact O-CB 3.31Å; V23-W27 PolarHBondContact O-N 3.19Å; W27-A30 PolarHBondContact O-N 2.91Å; W27-L31 HydrophobicContact CD2-CG 4.47Å; W27-L31 HydrophobicContact CG-CD1 4.44Å; W27-L31 HydrophobicContact CZ2-CD1 4.44Å; W27-L31 HydrophobicContact CZ2-CD2 4.23Å; W27-L31 HydrophobicContact CZ2-CG 4.37Å; W27-L31 WeakPolarHBondContact O-CB 3.42Å; W27-L31 WeakPolarHBondContact O-CG 3.48Å; W27-L31 PolarHBondContact O-N 3.42Å
28	G	92.1	Very high	89.3	Confident	36 Å²	36	75.7 Å²	75.7	37%	0.371	42%	0.423	S	S	.	.	H	α-helix	trans	-59.6	-46.5	175.9	0	0	0	0	0	112.8	R24 R25 L31 A32	R24-G28 PolarHBondContact O-N 2.83Å; R25-G28 PolarHBondContact O-N 3.08Å; G28-L31 PolarHBondContact O-N 2.77Å; G28-A32 WeakPolarHBondContact O-CB 3.37Å; G28-A32 PolarHBondContact O-N 3.21Å
29	S	91.2	Very high	88.1	Confident	20 Å²	20	78 Å²	78	14%	0.14	43%	0.431	C	S	.	.	H	α-helix	trans	-61.7	-46.8	175.6	-75.6	0	0	0	0	112.1	R25 G26 L31 A32 A33 C268 H269	R25-S29 WeakPolarHBondContact O-CB 3.31Å; R25-S29 PolarHBondContact O-N 3.12Å; R25-S29 PolarHBondContact O-OG 3.4Å; G26-S29 PolarHBondContact O-N 2.81Å; S29-L31 PolarHBondContact O-N 3.23Å; S29-A32 PolarHBondContact O-N 3.28Å; S29-A33 WeakPolarHBondContact O-CB 3.49Å; S29-A33 PolarHBondContact O-N 2.83Å; S29-C268 VanDerWaalsContact CB-O 3.26Å; S29-C268 WeakPolarHBondContact CB-O 3.28Å; S29-H269 PolarHBondContact OG-ND1 3.18Å
30	A	90.6	Very high	87.1	Confident	24 Å²	24	78.1 Å²	78.1	20%	0.198	45%	0.445	C	S	.	.	H	α-helix	trans	-62.3	-42.3	177.4	0	0	0	0	0	112.5	G26 W27 A34 Y281 F282	G26-A30 WeakPolarHBondContact O-CB 3.31Å; G26-A30 PolarHBondContact O-N 3.36Å; W27-A30 PolarHBondContact O-N 2.91Å; A30-A34 VanDerWaalsContact O-CB 3.28Å; A30-A34 WeakPolarHBondContact O-CB 3.43Å; A30-A34 PolarHBondContact O-N 3.1Å; A30-Y281 HydrophobicContact CB-CE1 4.4Å; A30-F282 HydrophobicContact CB-CE1 4.41Å
31	L	91.6	Very high	86.3	Confident	59 Å²	59	76.9 Å²	76.9	31%	0.309	44%	0.44	S	S	.	.	H	α-helix	trans	-65.7	-41.1	175.9	-79.7	-178.6	0	0	0	112.5	W27 G28 S29 A34 R35	W27-L31 HydrophobicContact CD2-CG 4.47Å; W27-L31 HydrophobicContact CG-CD1 4.44Å; W27-L31 HydrophobicContact CZ2-CD1 4.44Å; W27-L31 HydrophobicContact CZ2-CD2 4.23Å; W27-L31 HydrophobicContact CZ2-CG 4.37Å; W27-L31 WeakPolarHBondContact O-CB 3.42Å; W27-L31 WeakPolarHBondContact O-CG 3.48Å; W27-L31 PolarHBondContact O-N 3.42Å; G28-L31 PolarHBondContact O-N 2.77Å; S29-L31 PolarHBondContact O-N 3.23Å; L31-A34 PolarHBondContact O-N 3.3Å; L31-R35 WeakPolarHBondContact O-CB 3.4Å; L31-R35 VanDerWaalsContact O-CG 3.3Å; L31-R35 WeakPolarHBondContact O-CG 3.48Å; L31-R35 PolarHBondContact O-N 3.01Å
32	A	89.4	Confident	85.3	Confident	61 Å²	61	84.3 Å²	84.3	50%	0.504	47%	0.465	S	S	.	.	H	α-helix	trans	-62.7	-47.2	177.1	0	0	0	0	0	111	G28 S29 A34 R35 G36	G28-A32 WeakPolarHBondContact O-CB 3.37Å; G28-A32 PolarHBondContact O-N 3.21Å; S29-A32 PolarHBondContact O-N 3.28Å; A32-A34 VanDerWaalsContact C-N 3.32Å; A32-A34 PolarHBondContact O-N 3.06Å; A32-R35 PolarHBondContact O-N 3.27Å; A32-G36 PolarHBondContact O-N 2.99Å
33	A	87.3	Confident	84.6	Confident	29 Å²	29	85.7 Å²	85.7	24%	0.24	48%	0.483	C	S	.	.	H	α-helix	trans	-60.7	-40.3	174.9	0	0	0	0	0	112	S29 G36 C37 L272 F282	S29-A33 WeakPolarHBondContact O-CB 3.49Å; S29-A33 PolarHBondContact O-N 2.83Å; A33-G36 PolarHBondContact O-N 3.47Å; A33-C37 PolarHBondContact O-N 3.18Å; A33-L272 HydrophobicContact CB-CD1 3.94Å; A33-F282 HydrophobicContact CB-CE2 4.24Å; A33-F282 HydrophobicContact CB-CZ 3.76Å
34	A	87.1	Confident	84	Confident	52 Å²	52	84.6 Å²	84.6	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-67.3	-39.3	178.8	0	0	0	0	0	112.1	A30 L31 A32 C37 F282	A30-A34 VanDerWaalsContact O-CB 3.28Å; A30-A34 WeakPolarHBondContact O-CB 3.43Å; A30-A34 PolarHBondContact O-N 3.1Å; L31-A34 PolarHBondContact O-N 3.3Å; A32-A34 VanDerWaalsContact C-N 3.32Å; A32-A34 PolarHBondContact O-N 3.06Å; A34-C37 WeakPolarHBondContact O-CB 3.43Å; A34-C37 PolarHBondContact O-N 2.84Å; A34-F282 HydrophobicContact CB-CE1 4.44Å; A34-F282 HydrophobicContact CB-CZ 4.01Å
35	R	87.6	Confident	83.3	Confident	203 Å²	203	78 Å²	78	77%	0.766	46%	0.456	S	S	*	.	H	α-helix	trans	-71.2	-32.2	176.8	-73.2	174.2	-178.3	165.9	0.5	113.1	L31 A32 C37	L31-R35 WeakPolarHBondContact O-CB 3.4Å; L31-R35 VanDerWaalsContact O-CG 3.3Å; L31-R35 WeakPolarHBondContact O-CG 3.48Å; L31-R35 PolarHBondContact O-N 3.01Å; A32-R35 PolarHBondContact O-N 3.27Å; R35-C37 PolarHBondContact O-N 2.93Å
36	G	80.8	Confident	82.8	Confident	54 Å²	54	83.2 Å²	83.2	56%	0.557	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-8.4	176	0	0	0	0	0	114.1	A32 A33 T38	A32-G36 PolarHBondContact O-N 2.99Å; A33-G36 PolarHBondContact O-N 3.47Å; G36-T38 PolarHBondContact O-N 3.06Å; G36-T38 VanDerWaalsContact O-N 3.08Å
37	C	77.3	Confident	82.5	Confident	61 Å²	61	89.4 Å²	89.4	41%	0.412	50%	0.497	S	S	.	.			trans	-79.6	93.8	-176.7	-161.5	0	0	0	0	110.8	A33 A34 R35	A33-C37 PolarHBondContact O-N 3.18Å; A34-C37 WeakPolarHBondContact O-CB 3.43Å; A34-C37 PolarHBondContact O-N 2.84Å; R35-C37 PolarHBondContact O-N 2.93Å
38	T	71.5	Confident	82	Confident	141 Å²	141	81.4 Å²	81.4	87%	0.865	47%	0.47	S	S	*	.	S	Bend	trans	-85.8	-22.2	-179.4	51.2	0	0	0	0	113.6	G36	G36-T38 PolarHBondContact O-N 3.06Å; G36-T38 VanDerWaalsContact O-N 3.08Å
39	D	69.3	Low	81.7	Confident	106 Å²	106	84 Å²	84	57%	0.567	48%	0.475	S	S	*	.	S	Bend	trans	-132.2	94.1	-178.5	-152.9	15	0	0	0	108.9	L44	D39-L44 WeakPolarHBondContact O-CD2 3.42Å
40	C	70.4	Confident	81.2	Confident	102 Å²	102	87.1 Å²	87.1	69%	0.689	50%	0.502	S	S	*	.			trans	-119.4	136.8	-178.7	54.1	0	0	0	0	111
41	G	76.6	Confident	80.9	Confident	47 Å²	47	91.7 Å²	91.7	49%	0.485	52%	0.519	S	S	.	.	S	Bend	trans	159.3	176.4	176.9	0	0	0	0	0	115.1	G43 L44 A45	G41-G43 VanDerWaalsContact C-N 3.32Å; G41-G43 PolarHBondContact O-N 3Å; G41-L44 PolarHBondContact O-N 3.32Å; G41-A45 PolarHBondContact O-N 3.17Å; G41-A45 VanDerWaalsContact O-N 3.09Å
42	W	73.8	Confident	80.5	Confident	219 Å²	219	90.9 Å²	90.9	83%	0.83	51%	0.514	S	S	*	.	H	α-helix	trans	-62.3	-35.1	-176.6	-172.6	-111.6	0	0	0	113.5	A45 R46	W42-A45 PolarHBondContact O-N 2.87Å; W42-R46 WeakPolarHBondContact O-CB 3.46Å; W42-R46 PolarHBondContact O-N 2.81Å
43	G	77.8	Confident	80.4	Confident	44 Å²	44	89.6 Å²	89.6	45%	0.454	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-44.3	177.8	0	0	0	0	0	112.8	G41 R46 R47	G41-G43 VanDerWaalsContact C-N 3.32Å; G41-G43 PolarHBondContact O-N 3Å; G43-R46 PolarHBondContact O-N 2.64Å; G43-R47 WeakPolarHBondContact O-CG 3.5Å; G43-R47 PolarHBondContact O-N 3.24Å; G43-R47 VanDerWaalsContact O-N 3.08Å
44	L	80.2	Confident	80.3	Confident	80 Å²	80	91.2 Å²	91.2	42%	0.419	51%	0.505	S	S	.	.	H	α-helix	trans	-66.4	-43.5	174.9	-177.4	65.9	0	0	0	111.2	D39 G41 R46 R47 G48	D39-L44 WeakPolarHBondContact O-CD2 3.42Å; G41-L44 PolarHBondContact O-N 3.32Å; L44-R46 VanDerWaalsContact C-N 3.28Å; L44-R46 PolarHBondContact O-N 3.04Å; L44-R47 PolarHBondContact O-N 3.37Å; L44-G48 PolarHBondContact O-N 2.82Å
45	A	81.3	Confident	80.3	Confident	37 Å²	37	91.3 Å²	91.3	31%	0.306	50%	0.498	S	S	.	.	H	α-helix	trans	-58.1	-41.4	176.8	0	0	0	0	0	111.9	G41 W42 L49 F280	G41-A45 PolarHBondContact O-N 3.17Å; G41-A45 VanDerWaalsContact O-N 3.09Å; W42-A45 PolarHBondContact O-N 2.87Å; A45-L49 WeakPolarHBondContact O-CB 3.3Å; A45-L49 PolarHBondContact O-N 3.01Å; A45-F280 WeakPolarHBondContact O-CZ 3.36Å
46	R	82.1	Confident	80.2	Confident	187 Å²	187	83.7 Å²	83.7	71%	0.706	48%	0.479	S	S	*	.	H	α-helix	trans	-67.1	-42.1	177.1	-175.4	178.1	169	-175.4	-3.3	112.6	W42 G43 L44 L49 A50	W42-R46 WeakPolarHBondContact O-CB 3.46Å; W42-R46 PolarHBondContact O-N 2.81Å; G43-R46 PolarHBondContact O-N 2.64Å; L44-R46 VanDerWaalsContact C-N 3.28Å; L44-R46 PolarHBondContact O-N 3.04Å; R46-L49 PolarHBondContact O-N 3.37Å; R46-A50 PolarHBondContact O-N 2.83Å; R46-A50 VanDerWaalsContact O-N 3.09Å
47	R	83	Confident	80.6	Confident	137 Å²	137	86 Å²	86	52%	0.517	48%	0.484	S	S	.	.	H	α-helix	trans	-64.4	-49.2	175.3	-73	-171.6	-63.8	-125.7	2.6	111.3	G43 L44 L49 A50 E51	G43-R47 WeakPolarHBondContact O-CG 3.5Å; G43-R47 PolarHBondContact O-N 3.24Å; G43-R47 VanDerWaalsContact O-N 3.08Å; L44-R47 PolarHBondContact O-N 3.37Å; R47-L49 PolarHBondContact O-N 3.24Å; R47-A50 WeakPolarHBondContact O-CA 3.25Å; R47-A50 WeakPolarHBondContact O-CB 3.05Å; R47-A50 PolarHBondContact O-N 2.8Å; R47-E51 WeakPolarHBondContact O-CG 3.4Å; R47-E51 PolarHBondContact O-N 3.43Å
48	G	81.6	Confident	81.3	Confident	10 Å²	10	87 Å²	87	10%	0.103	49%	0.489	C	S	.	.	H	α-helix	trans	-59.6	-34.6	176.2	0	0	0	0	0	112.6	L44 E51 H52	L44-G48 PolarHBondContact O-N 2.82Å; G48-E51 PolarHBondContact O-N 3.49Å; G48-H52 VanDerWaalsContact O-CB 3.3Å; G48-H52 WeakPolarHBondContact O-CB 3.31Å; G48-H52 PolarHBondContact O-CD2 2.79Å; G48-H52 VanDerWaalsContact O-CD2 3.28Å; G48-H52 PolarHBondContact O-N 2.99Å
49	L	84.5	Confident	82.2	Confident	90 Å²	90	83.1 Å²	83.1	47%	0.471	46%	0.462	S	S	.	.	H	α-helix	trans	-66.2	-44.5	173.5	-166.4	74.4	0	0	0	110.8	A45 R46 R47 E51 A53 F196 F280	A45-L49 WeakPolarHBondContact O-CB 3.3Å; A45-L49 PolarHBondContact O-N 3.01Å; R46-L49 PolarHBondContact O-N 3.37Å; R47-L49 PolarHBondContact O-N 3.24Å; L49-E51 VanDerWaalsContact C-N 3.3Å; L49-E51 PolarHBondContact O-N 3.27Å; L49-A53 HydrophobicContact CD1-CB 3.81Å; L49-A53 HydrophobicContact CG-CB 4.02Å; L49-A53 WeakPolarHBondContact O-CA 3.32Å; L49-A53 WeakPolarHBondContact O-CB 3.34Å; L49-A53 PolarHBondContact O-N 3.46Å; L49-F196 HydrophobicContact CD1-CE1 3.98Å; L49-F196 HydrophobicContact CD1-CZ 3.97Å; L49-F280 HydrophobicContact CB-CZ 3.89Å; L49-F280 HydrophobicContact CD1-CE2 4.37Å; L49-F280 HydrophobicContact CD1-CZ 4.02Å
50	A	82	Confident	83.2	Confident	86 Å²	86	82.2 Å²	82.2	71%	0.711	46%	0.456	S	S	*	.	H	α-helix	trans	-65.3	-33.9	177.9	0	0	0	0	0	112.9	R46 R47	R46-A50 PolarHBondContact O-N 2.83Å; R46-A50 VanDerWaalsContact O-N 3.09Å; R47-A50 WeakPolarHBondContact O-CA 3.25Å; R47-A50 WeakPolarHBondContact O-CB 3.05Å; R47-A50 PolarHBondContact O-N 2.8Å
51	E	83.4	Confident	84.4	Confident	121 Å²	121	82.3 Å²	82.3	57%	0.565	45%	0.449	S	S	*	.	H	α-helix	trans	-81.9	-37.9	-177.9	-72.5	168.9	-167	0	0	113	R47 G48 L49 H54	R47-E51 WeakPolarHBondContact O-CG 3.4Å; R47-E51 PolarHBondContact O-N 3.43Å; G48-E51 PolarHBondContact O-N 3.49Å; L49-E51 VanDerWaalsContact C-N 3.3Å; L49-E51 PolarHBondContact O-N 3.27Å; E51-H54 PolarHBondContact O-NE2 3.48Å
52	H	84	Confident	85.3	Confident	42 Å²	42	84.4 Å²	84.4	19%	0.194	45%	0.449	C	S	.	.	H	α-helix	trans	-111.1	-16.4	-171.2	-60.7	-70.2	0	0	0	114.9	G48 H54 F196 P279	G48-H52 VanDerWaalsContact O-CB 3.3Å; G48-H52 WeakPolarHBondContact O-CB 3.31Å; G48-H52 PolarHBondContact O-CD2 2.79Å; G48-H52 VanDerWaalsContact O-CD2 3.28Å; G48-H52 PolarHBondContact O-N 2.99Å; H52-H54 PolarHBondContact O-CD2 3.15Å; H52-H54 PolarHBondContact O-N 3.3Å; H52-F196 HydrophobicContact CB-CD1 4.39Å; H52-P279 HydrophobicContact CB-CB 4.05Å; H52-P279 HydrophobicContact CB-CG 4.08Å
53	A	87.2	Confident	86.3	Confident	33 Å²	33	75.6 Å²	75.6	27%	0.273	42%	0.418	S	S	.	.			trans	-83.5	98.6	178.1	0	0	0	0	0	110.1	L49 L55 A195 F196	L49-A53 HydrophobicContact CD1-CB 3.81Å; L49-A53 HydrophobicContact CG-CB 4.02Å; L49-A53 WeakPolarHBondContact O-CA 3.32Å; L49-A53 WeakPolarHBondContact O-CB 3.34Å; L49-A53 PolarHBondContact O-N 3.46Å; A53-L55 PolarHBondContact O-N 3.33Å; A53-A195 HydrophobicContact CB-CB 4.2Å; A53-F196 HydrophobicContact CB-CE1 4.02Å
54	H	85.7	Confident	87.2	Confident	63 Å²	63	75.9 Å²	75.9	29%	0.292	42%	0.416	S	S	.	.			trans	-98.2	89.6	176.3	-58.6	-82.3	0	0	0	109.9	E51 H52 G141 A195 R197	E51-H54 PolarHBondContact O-NE2 3.48Å; H52-H54 PolarHBondContact O-CD2 3.15Å; H52-H54 PolarHBondContact O-N 3.3Å; H54-G141 WeakPolarHBondContact CD2-CA 3.41Å; H54-G141 PolarHBondContact CD2-N 3.36Å; H54-G141 VanDerWaalsContact CD2-N 3.29Å; H54-G141 VanDerWaalsContact NE2-CA 3.27Å; H54-G141 WeakPolarHBondContact NE2-CA 3.35Å; H54-G141 PolarHBondContact NE2-N 2.92Å; H54-G141 VanDerWaalsContact NE2-N 3.14Å; H54-A195 PolarHBondContact N-O 2.87Å; H54-R197 VanDerWaalsContact CB-NH2 3.3Å; H54-R197 PolarHBondContact O-NH1 3.01Å; H54-R197 VanDerWaalsContact O-NH1 3.16Å
55	L	85.6	Confident	88	Confident	55 Å²	55	76.6 Å²	76.6	29%	0.288	42%	0.419	S	S	.	.			trans	-133.7	116.9	176.1	-166	69.7	0	0	0	109.6	A53 E59 L60 V191 Y194	A53-L55 PolarHBondContact O-N 3.33Å; L55-E59 HydrophobicContact CD1-CB 4.4Å; L55-L60 HydrophobicContact CD2-CD1 3.97Å; L55-L60 HydrophobicContact CD2-CD2 3.46Å; L55-L60 VanDerWaalsContact CD2-CD2 3.46Å; L55-L60 HydrophobicContact CD2-CG 3.63Å; L55-L60 HydrophobicContact CG-CD2 4.33Å; L55-L60 HydrophobicContact CG-CG 4.06Å; L55-V191 HydrophobicContact CD2-CG1 3.92Å; L55-Y194 HydrophobicContact CD1-CD1 3.72Å; L55-Y194 HydrophobicContact CD1-CE1 4.19Å
56	A	86.7	Confident	88.8	Confident	42 Å²	42	75.9 Å²	75.9	35%	0.347	42%	0.416	S	S	.	.			trans	-81.5	140.2	-178.5	0	0	0	0	0	110.2	P58 E59 L60	A56-P58 VanDerWaalsContact C-N 3.28Å; A56-E59 HydrophobicContact CB-CG 4.08Å; A56-E59 PolarHBondContact N-OE2 2.86Å; A56-E59 WeakPolarHBondContact O-CB 3.41Å; A56-E59 PolarHBondContact O-N 3.3Å; A56-L60 PolarHBondContact O-N 3.46Å
57	P	88.9	Confident	89.5	Confident	102 Å²	102	67.6 Å²	67.6	66%	0.662	39%	0.388	S	S	*	.	H	α-helix	trans	-52.2	-36.8	175.9	-25.8	33.1	0	0	0	115	E59 L60 L61	P57-E59 VanDerWaalsContact C-N 3.28Å; P57-E59 PolarHBondContact O-N 3.09Å; P57-L60 PolarHBondContact O-N 3.26Å; P57-L61 PolarHBondContact O-N 3.36Å
58	P	91.8	Very high	90.2	Very high	82 Å²	82	66.7 Å²	66.7	53%	0.532	39%	0.392	S	S	.	.	H	α-helix	trans	-60.4	-33.7	173	-25.6	36.2	0	0	0	113.9	A56 L61 L62	A56-P58 VanDerWaalsContact C-N 3.28Å; P58-L61 PolarHBondContact O-N 2.96Å; P58-L62 WeakPolarHBondContact O-CB 3.47Å; P58-L62 VanDerWaalsContact O-CG 3.25Å; P58-L62 WeakPolarHBondContact O-CG 3.27Å; P58-L62 PolarHBondContact O-N 3.46Å
59	E	90.9	Very high	91	Very high	61 Å²	61	68 Å²	68	29%	0.285	41%	0.406	S	S	.	.	H	α-helix	trans	-68.9	-40.7	178.9	-61.6	172.2	139.4	0	0	111	L55 A56 P57 L62 L63 Y194	L55-E59 HydrophobicContact CD1-CB 4.4Å; A56-E59 HydrophobicContact CB-CG 4.08Å; A56-E59 PolarHBondContact N-OE2 2.86Å; A56-E59 WeakPolarHBondContact O-CB 3.41Å; A56-E59 PolarHBondContact O-N 3.3Å; P57-E59 VanDerWaalsContact C-N 3.28Å; P57-E59 PolarHBondContact O-N 3.09Å; E59-L62 PolarHBondContact O-N 3.32Å; E59-L63 WeakPolarHBondContact O-CB 3.43Å; E59-L63 PolarHBondContact O-N 3.33Å; E59-Y194 PolarHBondContact OE1-OH 3.37Å; E59-Y194 VanDerWaalsContact OE1-OH 3.11Å
60	L	90.6	Very high	91.6	Very high	86 Å²	86	66.4 Å²	66.4	45%	0.45	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-42.5	172.5	-76	174.8	0	0	0	111.9	L55 A56 P57 L63 A64	L55-L60 HydrophobicContact CD2-CD1 3.97Å; L55-L60 HydrophobicContact CD2-CD2 3.46Å; L55-L60 VanDerWaalsContact CD2-CD2 3.46Å; L55-L60 HydrophobicContact CD2-CG 3.63Å; L55-L60 HydrophobicContact CG-CD2 4.33Å; L55-L60 HydrophobicContact CG-CG 4.06Å; A56-L60 PolarHBondContact O-N 3.46Å; P57-L60 PolarHBondContact O-N 3.26Å; L60-L63 PolarHBondContact O-N 3Å; L60-A64 PolarHBondContact O-N 2.82Å
61	L	94.4	Very high	92.4	Very high	105 Å²	105	63.4 Å²	63.4	55%	0.55	37%	0.367	S	S	.	.	H	α-helix	trans	-62.4	-44.9	175.7	179.3	61.8	0	0	0	111.1	P57 P58 L63 A64 L65	P57-L61 PolarHBondContact O-N 3.36Å; P58-L61 PolarHBondContact O-N 2.96Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 3.39Å; L61-A64 PolarHBondContact O-N 2.78Å; L61-L65 HydrophobicContact CD1-CD1 4.09Å; L61-L65 HydrophobicContact CD1-CG 4.04Å; L61-L65 HydrophobicContact CG-CD1 3.91Å; L61-L65 HydrophobicContact CG-CG 4.28Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 VanDerWaalsContact O-CG 3.29Å; L61-L65 WeakPolarHBondContact O-CG 3.28Å; L61-L65 PolarHBondContact O-N 3.12Å
62	L	95.4	Very high	93	Very high	91 Å²	91	60.6 Å²	60.6	48%	0.476	36%	0.364	S	S	.	.	H	α-helix	trans	-61.1	-40.3	176.1	-74.3	172.1	0	0	0	111.9	P58 E59 G66 L153	P58-L62 WeakPolarHBondContact O-CB 3.47Å; P58-L62 VanDerWaalsContact O-CG 3.25Å; P58-L62 WeakPolarHBondContact O-CG 3.27Å; P58-L62 PolarHBondContact O-N 3.46Å; E59-L62 PolarHBondContact O-N 3.32Å; L62-G66 PolarHBondContact O-N 3.13Å; L62-L153 HydrophobicContact CB-CD1 3.92Å; L62-L153 HydrophobicContact CB-CD2 4.47Å
63	L	95.6	Very high	93.7	Very high	34 Å²	34	62.9 Å²	62.9	18%	0.178	38%	0.377	C	S	.	.	H	α-helix	trans	-62.3	-45.5	176	-170	152.3	0	0	0	111.2	E59 L60 L61 G66 A67 L153 S157 V191	E59-L63 WeakPolarHBondContact O-CB 3.43Å; E59-L63 PolarHBondContact O-N 3.33Å; L60-L63 PolarHBondContact O-N 3Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 3.39Å; L63-G66 PolarHBondContact O-N 2.85Å; L63-A67 PolarHBondContact O-N 2.72Å; L63-L153 HydrophobicContact CB-CD1 4.42Å; L63-S157 WeakPolarHBondContact O-CB 3.45Å; L63-V191 HydrophobicContact CD1-CG2 4.29Å
64	A	95.5	Very high	94.2	Very high	49 Å²	49	61.9 Å²	61.9	41%	0.405	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-46.6	178.1	0	0	0	0	0	112.4	L60 L61 G66 A67 L68	L60-A64 PolarHBondContact O-N 2.82Å; L61-A64 PolarHBondContact O-N 2.78Å; A64-G66 VanDerWaalsContact C-N 3.3Å; A64-G66 PolarHBondContact O-N 2.66Å; A64-A67 PolarHBondContact O-N 3.36Å; A64-L68 WeakPolarHBondContact O-CG 3.3Å; A64-L68 PolarHBondContact O-N 2.96Å; A64-L68 VanDerWaalsContact O-N 3.09Å
65	L	97.5	Very high	94.7	Very high	95 Å²	95	61.7 Å²	61.7	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-62	-39.7	175.4	-70.1	177	0	0	0	111.3	L61 L68 G69	L61-L65 HydrophobicContact CD1-CD1 4.09Å; L61-L65 HydrophobicContact CD1-CG 4.04Å; L61-L65 HydrophobicContact CG-CD1 3.91Å; L61-L65 HydrophobicContact CG-CG 4.28Å; L61-L65 WeakPolarHBondContact O-CB 3.42Å; L61-L65 VanDerWaalsContact O-CG 3.29Å; L61-L65 WeakPolarHBondContact O-CG 3.28Å; L61-L65 PolarHBondContact O-N 3.12Å; L65-L68 PolarHBondContact O-N 3.1Å; L65-G69 PolarHBondContact O-N 3.34Å
66	G	97.5	Very high	95.3	Very high	22 Å²	22	60.8 Å²	60.8	23%	0.227	37%	0.373	C	S	.	.	H	α-helix	trans	-59.8	-44.4	173.4	0	0	0	0	0	111.9	L62 L63 A64 L68 G69 W70	L62-G66 PolarHBondContact O-N 3.13Å; L63-G66 PolarHBondContact O-N 2.85Å; A64-G66 VanDerWaalsContact C-N 3.3Å; A64-G66 PolarHBondContact O-N 2.66Å; G66-L68 PolarHBondContact O-N 3.06Å; G66-G69 CarbonylContact O-C 3.52Å; G66-G69 WeakPolarHBondContact O-CA 3.44Å; G66-G69 PolarHBondContact O-N 3.2Å; G66-G69 VanDerWaalsContact O-N 3.12Å; G66-W70 PolarHBondContact O-N 2.9Å
67	A	97.5	Very high	95.8	Very high	14 Å²	14	59.6 Å²	59.6	12%	0.116	36%	0.363	C	S	.	.	H	α-helix	trans	-62.9	-41.1	178.5	0	0	0	0	0	112.3	L63 A64 T71 S157	L63-A67 PolarHBondContact O-N 2.72Å; A64-A67 PolarHBondContact O-N 3.36Å; A67-T71 PolarHBondContact O-N 3.42Å; A67-T71 VanDerWaalsContact O-N 3.11Å; A67-T71 PolarHBondContact O-OG1 3.38Å; A67-S157 VanDerWaalsContact CA-O 3.3Å; A67-S157 WeakPolarHBondContact CA-O 3.28Å; A67-S157 VanDerWaalsContact CB-O 3.3Å; A67-S157 WeakPolarHBondContact CB-O 3.49Å
68	L	97.6	Very high	96.2	Very high	118 Å²	118	55.7 Å²	55.7	62%	0.618	34%	0.337	S	S	*	.	H	α-helix	trans	-64.5	-42.3	172.1	-64.9	176.6	0	0	0	111.2	A64 L65 G66 T71 A72	A64-L68 WeakPolarHBondContact O-CG 3.3Å; A64-L68 PolarHBondContact O-N 2.96Å; A64-L68 VanDerWaalsContact O-N 3.09Å; L65-L68 PolarHBondContact O-N 3.1Å; G66-L68 PolarHBondContact O-N 3.06Å; L68-T71 WeakPolarHBondContact O-CB 3.49Å; L68-T71 PolarHBondContact O-N 3.44Å; L68-T71 VanDerWaalsContact O-N 3.17Å; L68-A72 PolarHBondContact O-N 3.44Å
69	G	97.9	Very high	96.4	Very high	38 Å²	38	54.5 Å²	54.5	39%	0.392	34%	0.335	S	S	.	.	H	α-helix	trans	-56.9	-48.5	175	0	0	0	0	0	112.6	L65 G66 T71 A72 L73	L65-G69 PolarHBondContact O-N 3.34Å; G66-G69 CarbonylContact O-C 3.52Å; G66-G69 WeakPolarHBondContact O-CA 3.44Å; G66-G69 PolarHBondContact O-N 3.2Å; G66-G69 VanDerWaalsContact O-N 3.12Å; G69-T71 VanDerWaalsContact C-N 3.3Å; G69-T71 PolarHBondContact O-N 2.97Å; G69-A72 PolarHBondContact O-N 3.14Å; G69-L73 VanDerWaalsContact O-CB 3.26Å; G69-L73 WeakPolarHBondContact O-CB 3.38Å; G69-L73 PolarHBondContact O-N 3.41Å
70	W	98.1	Very high	96.6	Very high	55 Å²	55	61.7 Å²	61.7	21%	0.208	36%	0.359	C	S	.	.	H	α-helix	trans	-60.7	-39.3	174.9	-69.3	122.1	0	0	0	112.2	G66 L73 R74 W104 L154 S157 F158 H161	G66-W70 PolarHBondContact O-N 2.9Å; W70-L73 HydrophobicContact CE3-CD2 3.99Å; W70-L73 HydrophobicContact CZ3-CD2 3.75Å; W70-L73 PolarHBondContact O-N 2.91Å; W70-R74 VanDerWaalsContact O-CB 3.24Å; W70-R74 WeakPolarHBondContact O-CB 3.32Å; W70-R74 PolarHBondContact O-N 3.33Å; W70-W104 HydrophobicContact CB-CZ2 4.48Å; W70-W104 AromaticContact CE3-CH2 3.83Å; W70-W104 HydrophobicContact CE3-CH2 3.83Å; W70-W104 AromaticContact CE3-CZ2 3.78Å; W70-W104 HydrophobicContact CE3-CZ2 3.78Å; W70-W104 HydrophobicContact CZ3-CH2 4.28Å; W70-W104 WeakPolarHBondContact O-CZ2 3.43Å; W70-L154 HydrophobicContact CH2-CD1 3.71Å; W70-L154 HydrophobicContact CZ2-CD1 3.25Å; W70-S157 PolarHBondContact NE1-OG 3.44Å; W70-F158 HydrophobicContact CD2-CD2 4.32Å; W70-F158 HydrophobicContact CG-CD2 4.27Å; W70-H161 HydrophobicContact CB-CB 3.72Å
71	T	97.5	Very high	97	Very high	23 Å²	23	62.4 Å²	62.4	14%	0.141	36%	0.363	C	S	.	.	H	α-helix	trans	-63.7	-45.5	177.2	-53.4	0	0	0	0	111.8	A67 L68 G69 S75 H161 Y164 M169	A67-T71 PolarHBondContact O-N 3.42Å; A67-T71 VanDerWaalsContact O-N 3.11Å; A67-T71 PolarHBondContact O-OG1 3.38Å; L68-T71 WeakPolarHBondContact O-CB 3.49Å; L68-T71 PolarHBondContact O-N 3.44Å; L68-T71 VanDerWaalsContact O-N 3.17Å; G69-T71 VanDerWaalsContact C-N 3.3Å; G69-T71 PolarHBondContact O-N 2.97Å; T71-S75 WeakPolarHBondContact O-CB 3.36Å; T71-S75 PolarHBondContact O-N 2.97Å; T71-S75 VanDerWaalsContact O-N 3.11Å; T71-S75 PolarHBondContact O-OG 3.31Å; T71-H161 VanDerWaalsContact CA-ND1 3.35Å; T71-H161 WeakPolarHBondContact CA-ND1 3.41Å; T71-H161 PolarHBondContact N-ND1 3.09Å; T71-H161 PolarHBondContact OG1-ND1 2.84Å; T71-Y164 HydrophobicContact CG2-CD1 3.82Å; T71-Y164 HydrophobicContact CG2-CE1 3.65Å; T71-M169 HydrophobicContact CG2-SD 4.17Å
72	A	97.7	Very high	97.1	Very high	62 Å²	62	57.8 Å²	57.8	51%	0.512	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-45.4	175.9	0	0	0	0	0	111.3	L68 G69 S75 A76	L68-A72 PolarHBondContact O-N 3.44Å; G69-A72 PolarHBondContact O-N 3.14Å; A72-S75 PolarHBondContact O-N 3.09Å; A72-A76 WeakPolarHBondContact O-CB 3.33Å; A72-A76 PolarHBondContact O-N 2.96Å
73	L	97.9	Very high	97.1	Very high	91 Å²	91	60.7 Å²	60.7	48%	0.476	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-43.4	-179.7	-175.2	59	0	0	0	111.6	G69 W70 S75 A76 A77 W104	G69-L73 VanDerWaalsContact O-CB 3.26Å; G69-L73 WeakPolarHBondContact O-CB 3.38Å; G69-L73 PolarHBondContact O-N 3.41Å; W70-L73 HydrophobicContact CE3-CD2 3.99Å; W70-L73 HydrophobicContact CZ3-CD2 3.75Å; W70-L73 PolarHBondContact O-N 2.91Å; L73-S75 VanDerWaalsContact C-N 3.32Å; L73-S75 PolarHBondContact O-N 3.17Å; L73-A76 PolarHBondContact O-N 3.48Å; L73-A77 VanDerWaalsContact O-CB 3.27Å; L73-A77 WeakPolarHBondContact O-CB 3.41Å; L73-A77 PolarHBondContact O-N 2.99Å; L73-W104 HydrophobicContact CB-CH2 3.85Å; L73-W104 HydrophobicContact CD2-CH2 3.81Å; L73-W104 HydrophobicContact CD2-CZ3 4.33Å; L73-W104 HydrophobicContact CG-CH2 3.59Å; L73-W104 HydrophobicContact CG-CZ3 3.91Å
74	R	97.7	Very high	97.1	Very high	11 Å²	11	62 Å²	62	4%	0.042	35%	0.353	C	S	.	.	H	α-helix	trans	-57.4	-46.2	173.4	-177.6	176.3	175.8	173.7	-9	111.6	W70 A77 T78 W104 H161 A165 M169 D170	W70-R74 VanDerWaalsContact O-CB 3.24Å; W70-R74 WeakPolarHBondContact O-CB 3.32Å; W70-R74 PolarHBondContact O-N 3.33Å; R74-A77 PolarHBondContact O-N 3.13Å; R74-T78 VanDerWaalsContact O-CB 3.25Å; R74-T78 WeakPolarHBondContact O-CB 3.35Å; R74-T78 PolarHBondContact O-N 2.84Å; R74-T78 PolarHBondContact O-OG1 2.86Å; R74-W104 HydrophobicContact CB-CD2 3.75Å; R74-W104 VanDerWaalsContact CB-CE2 3.46Å; R74-W104 HydrophobicContact CB-CE3 4.2Å; R74-W104 HydrophobicContact CB-CG 4.24Å; R74-W104 HydrophobicContact CB-CH2 4.13Å; R74-W104 HydrophobicContact CB-CZ2 3.66Å; R74-W104 HydrophobicContact CB-CZ3 4.38Å; R74-W104 VanDerWaalsContact CD-CD1 3.42Å; R74-W104 HydrophobicContact CG-CB 4.35Å; R74-W104 HydrophobicContact CG-CD2 3.68Å; R74-W104 HydrophobicContact CG-CE3 4.34Å; R74-W104 HydrophobicContact CG-CG 3.64Å; R74-W104 HydrophobicContact CG-CZ2 4.45Å; R74-H161 VanDerWaalsContact CD-NE2 3.34Å; R74-H161 WeakPolarHBondContact CD-NE2 3.28Å; R74-A165 VanDerWaalsContact NH1-CB 3.28Å; R74-M169 HydrophobicContact CG-CE 4.1Å; R74-D170 IonicContact CZ-OD1 3.31Å; R74-D170 IonicContact NH1-OD1 3.73Å; R74-D170 PolarHBondContact NH1-OD1 2.9Å; R74-D170 IonicContact NH2-OD1 2.86Å; R74-D170 PolarHBondContact NH2-OD1 2.86Å
75	S	96.2	Very high	97.1	Very high	59 Å²	59	63 Å²	63	41%	0.413	35%	0.351	S	S	.	.	H	α-helix	trans	-64.1	-44.5	-179.1	-60.1	0	0	0	0	111	T71 A72 L73 T78 A79	T71-S75 WeakPolarHBondContact O-CB 3.36Å; T71-S75 PolarHBondContact O-N 2.97Å; T71-S75 VanDerWaalsContact O-N 3.11Å; T71-S75 PolarHBondContact O-OG 3.31Å; A72-S75 PolarHBondContact O-N 3.09Å; L73-S75 VanDerWaalsContact C-N 3.32Å; L73-S75 PolarHBondContact O-N 3.17Å; S75-T78 PolarHBondContact O-N 2.76Å; S75-A79 WeakPolarHBondContact O-CB 3.25Å; S75-A79 PolarHBondContact O-N 3.3Å
76	A	97.4	Very high	96.9	Very high	36 Å²	36	58.6 Å²	58.6	30%	0.298	33%	0.329	S	S	.	.	H	α-helix	trans	-64	-47.8	175.8	0	0	0	0	0	112.1	A72 L73 T78 A79 R80	A72-A76 WeakPolarHBondContact O-CB 3.33Å; A72-A76 PolarHBondContact O-N 2.96Å; L73-A76 PolarHBondContact O-N 3.48Å; A76-T78 VanDerWaalsContact C-N 3.32Å; A76-T78 PolarHBondContact O-N 3.37Å; A76-A79 PolarHBondContact O-N 2.89Å; A76-R80 VanDerWaalsContact O-CB 3.28Å; A76-R80 WeakPolarHBondContact O-CB 3.15Å; A76-R80 WeakPolarHBondContact O-CG 3.35Å; A76-R80 PolarHBondContact O-N 3.48Å
77	A	97.6	Very high	96.8	Very high	17 Å²	17	65.8 Å²	65.8	14%	0.14	35%	0.354	C	S	.	.	H	α-helix	trans	-61.3	-40.8	177.5	0	0	0	0	0	111.6	L73 R74 L81 F82 W104	L73-A77 VanDerWaalsContact O-CB 3.27Å; L73-A77 WeakPolarHBondContact O-CB 3.41Å; L73-A77 PolarHBondContact O-N 2.99Å; R74-A77 PolarHBondContact O-N 3.13Å; A77-L81 WeakPolarHBondContact O-CA 3.46Å; A77-L81 VanDerWaalsContact O-CB 3.31Å; A77-L81 WeakPolarHBondContact O-CB 3.32Å; A77-L81 PolarHBondContact O-N 3.27Å; A77-F82 HydrophobicContact CB-CD2 4.31Å; A77-F82 HydrophobicContact CB-CE2 3.67Å; A77-F82 HydrophobicContact CB-CZ 3.97Å; A77-F82 PolarHBondContact O-N 2.78Å; A77-W104 HydrophobicContact CB-CE3 4.19Å; A77-W104 HydrophobicContact CB-CZ3 4.15Å
78	T	96.8	Very high	96.6	Very high	20 Å²	20	75.6 Å²	75.6	12%	0.123	39%	0.388	C	S	.	.	I	π-helix	trans	-61	-48.4	175.1	-64.1	0	0	0	0	111.7	R74 S75 A76 R83 P100	R74-T78 VanDerWaalsContact O-CB 3.25Å; R74-T78 WeakPolarHBondContact O-CB 3.35Å; R74-T78 PolarHBondContact O-N 2.84Å; R74-T78 PolarHBondContact O-OG1 2.86Å; S75-T78 PolarHBondContact O-N 2.76Å; A76-T78 VanDerWaalsContact C-N 3.32Å; A76-T78 PolarHBondContact O-N 3.37Å; T78-R83 HydrophobicContact CG2-CG 4.17Å; T78-R83 WeakPolarHBondContact O-CB 3.47Å; T78-R83 VanDerWaalsContact O-CG 3.3Å; T78-R83 WeakPolarHBondContact O-CG 2.98Å; T78-R83 PolarHBondContact O-N 3.22Å; T78-P100 HydrophobicContact CG2-CB 3.85Å; T78-P100 HydrophobicContact CG2-CG 4.4Å
79	A	96.3	Very high	96.4	Very high	58 Å²	58	71.1 Å²	71.1	48%	0.479	37%	0.366	S	S	.	.	I	π-helix	trans	-71.5	-42.2	-176.9	0	0	0	0	0	112.8	S75 A76 P84	S75-A79 WeakPolarHBondContact O-CB 3.25Å; S75-A79 PolarHBondContact O-N 3.3Å; A76-A79 PolarHBondContact O-N 2.89Å; A79-P84 WeakPolarHBondContact O-CD 3.38Å
80	R	96.8	Very high	96.2	Very high	212 Å²	212	78.5 Å²	78.5	80%	0.8	38%	0.382	S	S	*	.	I	π-helix	trans	-96.4	-26.1	-169.2	-61	-177.1	-179.2	-176.8	0.5	114.2	A76	A76-R80 VanDerWaalsContact O-CB 3.28Å; A76-R80 WeakPolarHBondContact O-CB 3.15Å; A76-R80 WeakPolarHBondContact O-CG 3.35Å; A76-R80 PolarHBondContact O-N 3.48Å
81	L	97.3	Very high	95.9	Very high	100 Å²	100	76.6 Å²	76.6	52%	0.524	38%	0.376	S	S	.	.	I	π-helix	trans	-117.6	-60.9	-175.1	-178.5	62.3	0	0	0	112.1	A77 P84 L85	A77-L81 WeakPolarHBondContact O-CA 3.46Å; A77-L81 VanDerWaalsContact O-CB 3.31Å; A77-L81 WeakPolarHBondContact O-CB 3.32Å; A77-L81 PolarHBondContact O-N 3.27Å; L81-P84 WeakPolarHBondContact O-CD 3.49Å; L81-L85 VanDerWaalsContact O-CB 3.24Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 PolarHBondContact O-N 3.43Å
82	F	96.8	Very high	95.6	Very high	9 Å²	9	80.2 Å²	80.2	4%	0.039	39%	0.392	C	S	.	.	I	π-helix	trans	-71.3	-46.2	-168.5	-53.2	-38.9	0	0	0	113.3	A77 L85 A86 M99 P100 A103 W104 L107	A77-F82 HydrophobicContact CB-CD2 4.31Å; A77-F82 HydrophobicContact CB-CE2 3.67Å; A77-F82 HydrophobicContact CB-CZ 3.97Å; A77-F82 PolarHBondContact O-N 2.78Å; F82-L85 PolarHBondContact O-N 2.89Å; F82-A86 PolarHBondContact O-N 3.13Å; F82-M99 HydrophobicContact CB-CE 4.15Å; F82-M99 HydrophobicContact CB-SD 4.45Å; F82-M99 WeakPolarHBondContact O-CE 3.38Å; F82-P100 HydrophobicContact CB-CB 3.84Å; F82-P100 HydrophobicContact CB-CG 4.04Å; F82-P100 HydrophobicContact CD2-CB 4.14Å; F82-P100 HydrophobicContact CG-CB 4.42Å; F82-A103 HydrophobicContact CD1-CB 3.78Å; F82-A103 HydrophobicContact CD2-CB 4.31Å; F82-A103 HydrophobicContact CE1-CB 3.79Å; F82-A103 HydrophobicContact CE2-CB 4.32Å; F82-A103 HydrophobicContact CG-CB 4.08Å; F82-A103 HydrophobicContact CZ-CB 4.08Å; F82-W104 HydrophobicContact CE2-CB 4.01Å; F82-W104 HydrophobicContact CE2-CE3 4.2Å; F82-W104 HydrophobicContact CZ-CE3 4.47Å; F82-L107 HydrophobicContact CE1-CD1 3.93Å; F82-L107 HydrophobicContact CZ-CD1 3.76Å
83	R	95	Very high	95.2	Very high	151 Å²	151	82.9 Å²	82.9	57%	0.57	40%	0.404	S	S	*	.	H	α-helix	trans	-64	-45.8	177.7	-73.9	176.4	179.1	-177.2	2	112.5	T78 L85 A86 K87 P100	T78-R83 HydrophobicContact CG2-CG 4.17Å; T78-R83 WeakPolarHBondContact O-CB 3.47Å; T78-R83 VanDerWaalsContact O-CG 3.3Å; T78-R83 WeakPolarHBondContact O-CG 2.98Å; T78-R83 PolarHBondContact O-N 3.22Å; R83-L85 VanDerWaalsContact C-N 3.33Å; R83-L85 PolarHBondContact O-N 3.37Å; R83-A86 PolarHBondContact O-N 3.09Å; R83-K87 WeakPolarHBondContact O-CG 3.45Å; R83-K87 PolarHBondContact O-N 3.14Å; R83-K87 VanDerWaalsContact O-N 3.09Å; R83-P100 HydrophobicContact CG-CG 4.26Å
84	P	96.4	Very high	94.7	Very high	61 Å²	61	84.7 Å²	84.7	40%	0.396	40%	0.404	S	S	.	.	H	α-helix	trans	-59.2	-41.1	173.1	-28.5	38.2	0	0	0	113.1	A79 L81 K87 R88	A79-P84 WeakPolarHBondContact O-CD 3.38Å; L81-P84 WeakPolarHBondContact O-CD 3.49Å; P84-K87 PolarHBondContact O-N 3.43Å; P84-R88 WeakPolarHBondContact O-CB 3.26Å; P84-R88 PolarHBondContact O-N 3.05Å
85	L	95.4	Very high	94.4	Very high	70 Å²	70	85.2 Å²	85.2	37%	0.366	41%	0.408	S	S	.	.	H	α-helix	trans	-62	-45.8	176.6	-177.7	63.9	0	0	0	111.9	L81 F82 R83 K87 R88 C89 M99	L81-L85 VanDerWaalsContact O-CB 3.24Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 PolarHBondContact O-N 3.43Å; F82-L85 PolarHBondContact O-N 2.89Å; R83-L85 VanDerWaalsContact C-N 3.33Å; R83-L85 PolarHBondContact O-N 3.37Å; L85-K87 VanDerWaalsContact C-N 3.31Å; L85-K87 PolarHBondContact O-N 3.22Å; L85-R88 PolarHBondContact O-N 3.38Å; L85-C89 WeakPolarHBondContact O-CB 3.41Å; L85-C89 PolarHBondContact O-N 2.96Å; L85-M99 HydrophobicContact CB-CE 4.45Å
86	A	94.5	Very high	94.2	Very high	4 Å²	4	83.7 Å²	83.7	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-57.6	-43.1	175.8	0	0	0	0	0	112.3	F82 R83 R90 L91 A96 M99	F82-A86 PolarHBondContact O-N 3.13Å; R83-A86 PolarHBondContact O-N 3.09Å; A86-R90 PolarHBondContact O-N 3.37Å; A86-R90 VanDerWaalsContact O-N 3.13Å; A86-L91 HydrophobicContact CB-CD1 3.88Å; A86-L91 HydrophobicContact CB-CG 4.36Å; A86-L91 PolarHBondContact O-N 3.39Å; A86-L91 VanDerWaalsContact O-N 3.1Å; A86-A96 HydrophobicContact CB-CB 4.1Å; A86-M99 HydrophobicContact CB-CE 3.72Å
87	K	93.8	Very high	93.9	Very high	172 Å²	172	85.7 Å²	85.7	75%	0.748	42%	0.415	S	S	*	.	H	α-helix	trans	-65.5	-46.5	176.5	-71	-179.2	179.6	-173.9	0	111.8	R83 P84 L85 C89 R90	R83-K87 WeakPolarHBondContact O-CG 3.45Å; R83-K87 PolarHBondContact O-N 3.14Å; R83-K87 VanDerWaalsContact O-N 3.09Å; P84-K87 PolarHBondContact O-N 3.43Å; L85-K87 VanDerWaalsContact C-N 3.31Å; L85-K87 PolarHBondContact O-N 3.22Å; K87-C89 VanDerWaalsContact C-N 3.29Å; K87-C89 PolarHBondContact O-N 3.47Å; K87-R90 PolarHBondContact O-N 3.28Å
88	R	93.6	Very high	93.6	Very high	220 Å²	220	86.1 Å²	86.1	83%	0.83	41%	0.414	S	S	*	.	H	α-helix	trans	-60.5	-39.7	178.6	-174.8	176.8	178.5	177.2	-0.1	111.7	P84 L85 R90	P84-R88 WeakPolarHBondContact O-CB 3.26Å; P84-R88 PolarHBondContact O-N 3.05Å; L85-R88 PolarHBondContact O-N 3.38Å; R88-R90 PolarHBondContact O-N 2.75Å
89	C	93	Very high	93.5	Very high	24 Å²	24	85.3 Å²	85.3	16%	0.162	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-3.5	175.6	-68.6	0	0	0	0	113.7	L85 K87 L91 F225 R228	L85-C89 WeakPolarHBondContact O-CB 3.41Å; L85-C89 PolarHBondContact O-N 2.96Å; K87-C89 VanDerWaalsContact C-N 3.29Å; K87-C89 PolarHBondContact O-N 3.47Å; C89-L91 VanDerWaalsContact C-N 3.28Å; C89-L91 HydrophobicContact CB-CD2 4.2Å; C89-L91 HydrophobicContact CB-CG 4.26Å; C89-L91 PolarHBondContact O-N 3.09Å; C89-F225 HydrophobicContact CB-CD1 4.43Å; C89-F225 HydrophobicContact CB-CE1 3.9Å; C89-R228 WeakPolarHBondContact O-CB 3.3Å
90	R	93.6	Very high	93.5	Very high	193 Å²	193	83 Å²	83	73%	0.728	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	48.2	-178.2	-58.7	-179.3	-175.4	-171.5	0.5	111.8	A86 K87 R88 G229	A86-R90 PolarHBondContact O-N 3.37Å; A86-R90 VanDerWaalsContact O-N 3.13Å; K87-R90 PolarHBondContact O-N 3.28Å; R88-R90 PolarHBondContact O-N 2.75Å; R90-G229 PolarHBondContact O-N 2.92Å
91	L	93.3	Very high	93.4	Very high	16 Å²	16	73.4 Å²	73.4	8%	0.084	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-63.7	150.6	174.2	-63.2	-172.5	0	0	0	110.3	A86 C89 A96 M99 Y224 F225 R228	A86-L91 HydrophobicContact CB-CD1 3.88Å; A86-L91 HydrophobicContact CB-CG 4.36Å; A86-L91 PolarHBondContact O-N 3.39Å; A86-L91 VanDerWaalsContact O-N 3.1Å; C89-L91 VanDerWaalsContact C-N 3.28Å; C89-L91 HydrophobicContact CB-CD2 4.2Å; C89-L91 HydrophobicContact CB-CG 4.26Å; C89-L91 PolarHBondContact O-N 3.09Å; L91-A96 HydrophobicContact CB-CB 4.06Å; L91-M99 HydrophobicContact CD1-CB 4.2Å; L91-M99 HydrophobicContact CD1-CE 4.49Å; L91-M99 HydrophobicContact CD1-CG 4.06Å; L91-Y224 WeakPolarHBondContact CD2-O 3.15Å; L91-F225 HydrophobicContact CD1-CE1 4.21Å; L91-F225 HydrophobicContact CD1-CZ 4.15Å; L91-F225 HydrophobicContact CD2-CD1 3.81Å; L91-F225 HydrophobicContact CD2-CE1 4Å; L91-F225 HydrophobicContact CD2-CG 4.36Å; L91-F225 HydrophobicContact CG-CE1 4.44Å; L91-R228 HydrophobicContact CD2-CB 3.7Å
92	Q	90	Very high	93.3	Very high	98 Å²	98	68.6 Å²	68.6	46%	0.458	33%	0.328	S	S	.	.			trans	-60	147	173.2	-61.4	-167.4	10.5	0	0	110.4	R94 D95 A96 S227	Q92-R94 PolarHBondContact O-N 2.84Å; Q92-R94 VanDerWaalsContact O-N 3.12Å; Q92-D95 PolarHBondContact O-N 3.11Å; Q92-A96 WeakPolarHBondContact O-CB 3.41Å; Q92-A96 PolarHBondContact O-N 3.2Å; Q92-S227 PolarHBondContact NE2-OG 3.45Å
93	P	89.3	Confident	93.4	Very high	118 Å²	118	68.6 Å²	68.6	77%	0.766	33%	0.329	S	S	*	.	H	α-helix	trans	-54	-37.3	-176.4	-28.4	35.2	0	0	0	114.2	A97	P93-A97 PolarHBondContact O-N 3.45Å
94	R	87.9	Confident	93.5	Very high	129 Å²	129	62.1 Å²	62.1	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-45.7	176.8	-177.5	-178.7	176.8	-151.9	-8.1	112	Q92 E322	Q92-R94 PolarHBondContact O-N 2.84Å; Q92-R94 VanDerWaalsContact O-N 3.12Å; R94-E322 IonicContact NH2-OE2 3.09Å; R94-E322 PolarHBondContact NH2-OE2 3.45Å
95	D	91.1	Very high	93.5	Very high	22 Å²	22	60.6 Å²	60.6	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-78	-37.9	-177.1	-61.5	-34	0	0	0	111.3	Q92 A97 K98 M99 Y224	Q92-D95 PolarHBondContact O-N 3.11Å; D95-A97 PolarHBondContact O-N 3.3Å; D95-K98 PolarHBondContact O-N 2.94Å; D95-M99 WeakPolarHBondContact O-CB 3.5Å; D95-M99 PolarHBondContact O-N 2.81Å; D95-Y224 HydrophobicContact CB-CD1 3.9Å; D95-Y224 HydrophobicContact CB-CG 4.08Å
96	A	92	Very high	93.7	Very high	27 Å²	27	59 Å²	59	22%	0.223	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-31.5	174.6	0	0	0	0	0	112.8	A86 L91 Q92 P100	A86-A96 HydrophobicContact CB-CB 4.1Å; L91-A96 HydrophobicContact CB-CB 4.06Å; Q92-A96 WeakPolarHBondContact O-CB 3.41Å; Q92-A96 PolarHBondContact O-N 3.2Å; A96-P100 VanDerWaalsContact O-CD 3.31Å; A96-P100 WeakPolarHBondContact O-CD 3.35Å
97	A	90.9	Very high	93.8	Very high	78 Å²	78	63.2 Å²	63.2	65%	0.645	30%	0.304	S	S	*	.	H	α-helix	trans	-72.9	-32.5	176.3	0	0	0	0	0	113	P93 D95	P93-A97 PolarHBondContact O-N 3.45Å; D95-A97 PolarHBondContact O-N 3.3Å
98	K	91.1	Very high	94	Very high	27 Å²	27	55.8 Å²	55.8	12%	0.117	27%	0.272	C	S	.	.	H	α-helix	trans	-92	-31.4	-176.1	-64.1	176.4	179.9	-177	0	113.2	D95 P100 E101 S102 Y224 E322	D95-K98 PolarHBondContact O-N 2.94Å; K98-P100 VanDerWaalsContact C-CD 3.45Å; K98-P100 VanDerWaalsContact C-N 3.35Å; K98-E101 PolarHBondContact O-N 3.11Å; K98-E101 VanDerWaalsContact O-N 3.12Å; K98-S102 PolarHBondContact O-N 3.43Å; K98-Y224 HydrophobicContact CB-CE1 4.37Å; K98-Y224 HydrophobicContact CB-CE2 4.1Å; K98-Y224 HydrophobicContact CD-CE1 4.44Å; K98-E322 IonicContact NZ-OE1 4Å; K98-E322 PolarHBondContact NZ-OE1 3.06Å; K98-E322 IonicContact NZ-OE2 3.44Å; K98-E322 PolarHBondContact NZ-OE2 2.89Å
99	M	94.9	Very high	94.2	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-51.2	-43.4	-175.3	-169	-77.6	-77.8	0	0	113.7	F82 L85 A86 L91 D95 E101 S102 A103 L221 Y224 F225	F82-M99 HydrophobicContact CB-CE 4.15Å; F82-M99 HydrophobicContact CB-SD 4.45Å; F82-M99 WeakPolarHBondContact O-CE 3.38Å; L85-M99 HydrophobicContact CB-CE 4.45Å; A86-M99 HydrophobicContact CB-CE 3.72Å; L91-M99 HydrophobicContact CD1-CB 4.2Å; L91-M99 HydrophobicContact CD1-CE 4.49Å; L91-M99 HydrophobicContact CD1-CG 4.06Å; D95-M99 WeakPolarHBondContact O-CB 3.5Å; D95-M99 PolarHBondContact O-N 2.81Å; M99-E101 VanDerWaalsContact C-N 3.35Å; M99-E101 PolarHBondContact O-N 3.4Å; M99-S102 PolarHBondContact O-N 2.81Å; M99-A103 WeakPolarHBondContact O-CB 3.26Å; M99-A103 PolarHBondContact O-N 3.41Å; M99-A103 HydrophobicContact SD-CB 3.82Å; M99-L221 HydrophobicContact CG-CD2 3.79Å; M99-L221 HydrophobicContact SD-CD2 4.07Å; M99-Y224 HydrophobicContact CB-CD2 3.9Å; M99-Y224 HydrophobicContact CG-CD2 4.14Å; M99-F225 HydrophobicContact CE-CZ 4.42Å; M99-F225 HydrophobicContact CG-CE2 4Å; M99-F225 HydrophobicContact CG-CZ 4.36Å; M99-F225 HydrophobicContact SD-CE2 4.44Å
100	P	96.2	Very high	94.5	Very high	9 Å²	9	47.8 Å²	47.8	6%	0.058	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-35.5	-179.7	-24.3	35.3	0	0	0	114.8	T78 F82 R83 A96 K98 W104	T78-P100 HydrophobicContact CG2-CB 3.85Å; T78-P100 HydrophobicContact CG2-CG 4.4Å; F82-P100 HydrophobicContact CB-CB 3.84Å; F82-P100 HydrophobicContact CB-CG 4.04Å; F82-P100 HydrophobicContact CD2-CB 4.14Å; F82-P100 HydrophobicContact CG-CB 4.42Å; R83-P100 HydrophobicContact CG-CG 4.26Å; A96-P100 VanDerWaalsContact O-CD 3.31Å; A96-P100 WeakPolarHBondContact O-CD 3.35Å; K98-P100 VanDerWaalsContact C-CD 3.45Å; K98-P100 VanDerWaalsContact C-N 3.35Å; P100-W104 WeakPolarHBondContact O-CB 3.27Å; P100-W104 PolarHBondContact O-N 2.82Å; P100-W104 VanDerWaalsContact O-N 3.15Å
101	E	94.7	Very high	94.7	Very high	11 Å²	11	40.5 Å²	40.5	5%	0.051	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-49.3	175.5	-179	-174.1	139.9	0	0	109.8	K98 M99 W104 K105 T171 R173	K98-E101 PolarHBondContact O-N 3.11Å; K98-E101 VanDerWaalsContact O-N 3.12Å; M99-E101 VanDerWaalsContact C-N 3.35Å; M99-E101 PolarHBondContact O-N 3.4Å; E101-W104 PolarHBondContact O-N 3.17Å; E101-K105 HydrophobicContact CG-CD 4.27Å; E101-K105 WeakPolarHBondContact O-CG 3.28Å; E101-K105 PolarHBondContact O-N 2.89Å; E101-K105 VanDerWaalsContact O-N 3.14Å; E101-K105 IonicContact OE1-NZ 3.81Å; E101-K105 PolarHBondContact OE1-NZ 2.94Å; E101-T171 PolarHBondContact OE2-N 3.46Å; E101-R173 IonicContact OE1-CZ 2.83Å; E101-R173 IonicContact OE1-NH1 3Å; E101-R173 PolarHBondContact OE1-NH1 3.07Å; E101-R173 IonicContact OE1-NH2 2.81Å; E101-R173 PolarHBondContact OE1-NH2 2.87Å; E101-R173 VanDerWaalsContact OE1-NH2 3.09Å; E101-R173 IonicContact OE2-NH2 3.12Å
102	S	96.2	Very high	94.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-67	-40.4	-179.7	-73.5	0	0	0	0	113.6	K98 M99 W104 K105 F106 E217	K98-S102 PolarHBondContact O-N 3.43Å; M99-S102 PolarHBondContact O-N 2.81Å; S102-W104 VanDerWaalsContact C-N 3.35Å; S102-W104 PolarHBondContact O-N 3.12Å; S102-K105 PolarHBondContact O-N 3.42Å; S102-F106 VanDerWaalsContact O-CB 3.22Å; S102-F106 WeakPolarHBondContact O-CB 3.24Å; S102-F106 PolarHBondContact O-N 2.89Å; S102-E217 WeakPolarHBondContact CA-OE2 3.38Å; S102-E217 WeakPolarHBondContact CB-OE2 3.18Å; S102-E217 PolarHBondContact OG-OE2 3.38Å
103	A	97.6	Very high	95.3	Very high	8 Å²	8	37.9 Å²	37.9	7%	0.066	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-41.4	178	0	0	0	0	0	111.9	F82 M99 L107 L221	F82-A103 HydrophobicContact CD1-CB 3.78Å; F82-A103 HydrophobicContact CD2-CB 4.31Å; F82-A103 HydrophobicContact CE1-CB 3.79Å; F82-A103 HydrophobicContact CE2-CB 4.32Å; F82-A103 HydrophobicContact CG-CB 4.08Å; F82-A103 HydrophobicContact CZ-CB 4.08Å; M99-A103 WeakPolarHBondContact O-CB 3.26Å; M99-A103 PolarHBondContact O-N 3.41Å; M99-A103 HydrophobicContact SD-CB 3.82Å; A103-L107 WeakPolarHBondContact O-CG 3.38Å; A103-L107 PolarHBondContact O-N 3.43Å; A103-L107 VanDerWaalsContact O-N 3.07Å; A103-L221 HydrophobicContact CB-CD2 4.06Å
104	W	97.9	Very high	95.7	Very high	15 Å²	15	35 Å²	35	6%	0.057	20%	0.195	C	C	.	.	H	α-helix	trans	-62.2	-50.5	176.5	178.3	-107.6	0	0	0	112.1	W70 L73 R74 A77 F82 P100 E101 S102 L107 F108 F158 H161	W70-W104 HydrophobicContact CB-CZ2 4.48Å; W70-W104 AromaticContact CE3-CH2 3.83Å; W70-W104 HydrophobicContact CE3-CH2 3.83Å; W70-W104 AromaticContact CE3-CZ2 3.78Å; W70-W104 HydrophobicContact CE3-CZ2 3.78Å; W70-W104 HydrophobicContact CZ3-CH2 4.28Å; W70-W104 WeakPolarHBondContact O-CZ2 3.43Å; L73-W104 HydrophobicContact CB-CH2 3.85Å; L73-W104 HydrophobicContact CD2-CH2 3.81Å; L73-W104 HydrophobicContact CD2-CZ3 4.33Å; L73-W104 HydrophobicContact CG-CH2 3.59Å; L73-W104 HydrophobicContact CG-CZ3 3.91Å; R74-W104 HydrophobicContact CB-CD2 3.75Å; R74-W104 VanDerWaalsContact CB-CE2 3.46Å; R74-W104 HydrophobicContact CB-CE3 4.2Å; R74-W104 HydrophobicContact CB-CG 4.24Å; R74-W104 HydrophobicContact CB-CH2 4.13Å; R74-W104 HydrophobicContact CB-CZ2 3.66Å; R74-W104 HydrophobicContact CB-CZ3 4.38Å; R74-W104 VanDerWaalsContact CD-CD1 3.42Å; R74-W104 HydrophobicContact CG-CB 4.35Å; R74-W104 HydrophobicContact CG-CD2 3.68Å; R74-W104 HydrophobicContact CG-CE3 4.34Å; R74-W104 HydrophobicContact CG-CG 3.64Å; R74-W104 HydrophobicContact CG-CZ2 4.45Å; A77-W104 HydrophobicContact CB-CE3 4.19Å; A77-W104 HydrophobicContact CB-CZ3 4.15Å; F82-W104 HydrophobicContact CE2-CB 4.01Å; F82-W104 HydrophobicContact CE2-CE3 4.2Å; F82-W104 HydrophobicContact CZ-CE3 4.47Å; P100-W104 WeakPolarHBondContact O-CB 3.27Å; P100-W104 PolarHBondContact O-N 2.82Å; P100-W104 VanDerWaalsContact O-N 3.15Å; E101-W104 PolarHBondContact O-N 3.17Å; S102-W104 VanDerWaalsContact C-N 3.35Å; S102-W104 PolarHBondContact O-N 3.12Å; W104-L107 PolarHBondContact O-N 3.33Å; W104-F108 PolarHBondContact O-N 3.35Å; W104-F108 VanDerWaalsContact O-N 3.14Å; W104-F158 HydrophobicContact CZ2-CE2 4.39Å; W104-F158 AromaticContact NE1-CE2 3.5Å; W104-H161 AromaticContact NE1-CD2 3.99Å; W104-H161 AromaticContact NE1-NE2 3.53Å
105	K	97.2	Very high	96.2	Very high	29 Å²	29	32.1 Å²	32.1	13%	0.126	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-44.5	178.6	-71.3	176.1	179.4	174.1	0	111.3	E101 S102 L107 F108 Y109 D170 E217	E101-K105 HydrophobicContact CG-CD 4.27Å; E101-K105 WeakPolarHBondContact O-CG 3.28Å; E101-K105 PolarHBondContact O-N 2.89Å; E101-K105 VanDerWaalsContact O-N 3.14Å; E101-K105 IonicContact OE1-NZ 3.81Å; E101-K105 PolarHBondContact OE1-NZ 2.94Å; S102-K105 PolarHBondContact O-N 3.42Å; K105-L107 PolarHBondContact O-N 3.24Å; K105-F108 PolarHBondContact O-N 3.25Å; K105-Y109 HydrophobicContact CB-CD2 4.11Å; K105-Y109 HydrophobicContact CB-CE2 3.97Å; K105-Y109 HydrophobicContact CG-CE2 4.4Å; K105-Y109 WeakPolarHBondContact O-CB 3.31Å; K105-Y109 WeakPolarHBondContact O-CD2 3.38Å; K105-Y109 PolarHBondContact O-N 2.81Å; K105-D170 WeakPolarHBondContact CE-OD2 3.46Å; K105-D170 IonicContact NZ-OD2 2.76Å; K105-D170 PolarHBondContact NZ-OD2 2.92Å; K105-E217 HydrophobicContact CB-CG 3.79Å
106	F	98.3	Very high	96.6	Very high	37 Å²	37	31.1 Å²	31.1	16%	0.162	18%	0.18	C	C	.	.	H	α-helix	trans	-56.5	-50.1	176.9	175.4	-108.8	0	0	0	112.4	S102 F108 L110 V214 E217 F218 L221	S102-F106 VanDerWaalsContact O-CB 3.22Å; S102-F106 WeakPolarHBondContact O-CB 3.24Å; S102-F106 PolarHBondContact O-N 2.89Å; F106-F108 PolarHBondContact O-N 2.96Å; F106-L110 HydrophobicContact CE1-CD2 4.09Å; F106-L110 HydrophobicContact CE2-CD2 4.5Å; F106-L110 HydrophobicContact CZ-CD2 3.84Å; F106-L110 WeakPolarHBondContact O-CB 3.39Å; F106-L110 PolarHBondContact O-N 3.48Å; F106-V214 HydrophobicContact CD2-CG1 4.24Å; F106-V214 HydrophobicContact CE2-CG1 3.82Å; F106-E217 HydrophobicContact CB-CB 3.77Å; F106-F218 HydrophobicContact CD2-CB 3.99Å; F106-F218 HydrophobicContact CE2-CB 3.7Å; F106-F218 AromaticContact CE2-CD2 3.99Å; F106-F218 HydrophobicContact CE2-CD2 3.99Å; F106-F218 HydrophobicContact CE2-CG 4.3Å; F106-F218 HydrophobicContact CZ-CD2 4.03Å; F106-L221 HydrophobicContact CB-CD1 3.9Å; F106-L221 HydrophobicContact CD1-CD1 4.01Å; F106-L221 HydrophobicContact CG-CD1 3.96Å
107	L	97.9	Very high	96.8	Very high	93 Å²	93	30.6 Å²	30.6	49%	0.487	18%	0.175	S	C	.	.	H	α-helix	trans	-63.4	-41.8	-178.6	-72	173.5	0	0	0	112.2	F82 A103 W104 K105 G111	F82-L107 HydrophobicContact CE1-CD1 3.93Å; F82-L107 HydrophobicContact CZ-CD1 3.76Å; A103-L107 WeakPolarHBondContact O-CG 3.38Å; A103-L107 PolarHBondContact O-N 3.43Å; A103-L107 VanDerWaalsContact O-N 3.07Å; W104-L107 PolarHBondContact O-N 3.33Å; K105-L107 PolarHBondContact O-N 3.24Å; L107-G111 PolarHBondContact O-N 3.19Å
108	F	98.1	Very high	97.2	Very high	15 Å²	15	33.1 Å²	33.1	7%	0.066	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-56	177	177.4	-93.6	0	0	0	111.3	W104 K105 F106 L110 G111 S112 L154 F158	W104-F108 PolarHBondContact O-N 3.35Å; W104-F108 VanDerWaalsContact O-N 3.14Å; K105-F108 PolarHBondContact O-N 3.25Å; F106-F108 PolarHBondContact O-N 2.96Å; F108-L110 VanDerWaalsContact C-N 3.27Å; F108-L110 PolarHBondContact O-N 3.49Å; F108-G111 PolarHBondContact O-N 3.09Å; F108-G111 VanDerWaalsContact O-N 3.1Å; F108-S112 PolarHBondContact O-N 3.14Å; F108-S112 PolarHBondContact O-OG 3.15Å; F108-L154 HydrophobicContact CE2-CD1 3.8Å; F108-L154 HydrophobicContact CE2-CG 3.96Å; F108-L154 HydrophobicContact CZ-CG 4.31Å; F108-F158 HydrophobicContact CB-CD2 4.21Å; F108-F158 HydrophobicContact CB-CE1 4.48Å; F108-F158 HydrophobicContact CB-CE2 3.59Å; F108-F158 HydrophobicContact CB-CZ 3.76Å; F108-F158 AromaticContact CD1-CD1 3.39Å; F108-F158 HydrophobicContact CD1-CD1 3.39Å; F108-F158 AromaticContact CD1-CD2 3.8Å; F108-F158 HydrophobicContact CD1-CD2 3.8Å; F108-F158 AromaticContact CD1-CE1 3.3Å; F108-F158 HydrophobicContact CD1-CE1 3.3Å; F108-F158 AromaticContact CD1-CE2 3.7Å; F108-F158 HydrophobicContact CD1-CE2 3.7Å; F108-F158 AromaticContact CD1-CG 3.64Å; F108-F158 HydrophobicContact CD1-CG 3.64Å; F108-F158 AromaticContact CD1-CZ 3.46Å; F108-F158 HydrophobicContact CD1-CZ 3.46Å; F108-F158 VanDerWaalsContact CD1-CZ 3.46Å; F108-F158 HydrophobicContact CD2-CB 4.12Å; F108-F158 HydrophobicContact CD2-CD1 4.28Å; F108-F158 AromaticContact CD2-CD2 3.25Å; F108-F158 HydrophobicContact CD2-CD2 3.25Å; F108-F158 AromaticContact CD2-CE2 3.58Å; F108-F158 HydrophobicContact CD2-CE2 3.58Å; F108-F158 AromaticContact CD2-CG 3.63Å; F108-F158 HydrophobicContact CD2-CG 3.63Å; F108-F158 HydrophobicContact CD2-CZ 4.23Å; F108-F158 HydrophobicContact CE1-CB 3.83Å; F108-F158 AromaticContact CE1-CD1 3.16Å; F108-F158 HydrophobicContact CE1-CD1 3.16Å; F108-F158 AromaticContact CE1-CD2 3.99Å; F108-F158 HydrophobicContact CE1-CD2 3.99Å; F108-F158 AromaticContact CE1-CE1 3.59Å; F108-F158 HydrophobicContact CE1-CE1 3.59Å; F108-F158 HydrophobicContact CE1-CE2 4.32Å; F108-F158 AromaticContact CE1-CG 3.38Å; F108-F158 HydrophobicContact CE1-CG 3.38Å; F108-F158 HydrophobicContact CE1-CZ 4.15Å; F108-F158 HydrophobicContact CE2-CB 3.35Å; F108-F158 HydrophobicContact CE2-CD1 4.08Å; F108-F158 AromaticContact CE2-CD2 3.45Å; F108-F158 HydrophobicContact CE2-CD2 3.45Å; F108-F158 VanDerWaalsContact CE2-CD2 3.45Å; F108-F158 HydrophobicContact CE2-CE2 4.21Å; F108-F158 AromaticContact CE2-CG 3.36Å; F108-F158 HydrophobicContact CE2-CG 3.36Å; F108-F158 AromaticContact CG-CD1 3.97Å; F108-F158 HydrophobicContact CG-CD1 3.97Å; F108-F158 AromaticContact CG-CD2 3.45Å; F108-F158 HydrophobicContact CG-CD2 3.45Å; F108-F158 VanDerWaalsContact CG-CD2 3.45Å; F108-F158 AromaticContact CG-CE1 3.85Å; F108-F158 HydrophobicContact CG-CE1 3.85Å; F108-F158 AromaticContact CG-CE2 3.29Å; F108-F158 HydrophobicContact CG-CE2 3.29Å; F108-F158 AromaticContact CG-CG 3.77Å; F108-F158 HydrophobicContact CG-CG 3.77Å; F108-F158 AromaticContact CG-CZ 3.51Å; F108-F158 HydrophobicContact CG-CZ 3.51Å; F108-F158 HydrophobicContact CZ-CB 3.19Å; F108-F158 AromaticContact CZ-CD1 3.54Å; F108-F158 HydrophobicContact CZ-CD1 3.54Å; F108-F158 AromaticContact CZ-CD2 3.83Å; F108-F158 HydrophobicContact CZ-CD2 3.83Å; F108-F158 HydrophobicContact CZ-CE1 4.33Å; F108-F158 AromaticContact CZ-CG 3.23Å; F108-F158 HydrophobicContact CZ-CG 3.23Å
109	Y	98.1	Very high	97.5	Very high	13 Å²	13	31.8 Å²	31.8	5%	0.051	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-34.8	-176.4	-69.2	-53.1	0	0	0	112.4	K105 S112 W113 F158 D210 D213 V214	K105-Y109 HydrophobicContact CB-CD2 4.11Å; K105-Y109 HydrophobicContact CB-CE2 3.97Å; K105-Y109 HydrophobicContact CG-CE2 4.4Å; K105-Y109 WeakPolarHBondContact O-CB 3.31Å; K105-Y109 WeakPolarHBondContact O-CD2 3.38Å; K105-Y109 PolarHBondContact O-N 2.81Å; Y109-S112 WeakPolarHBondContact CA-OG 3.24Å; Y109-S112 PolarHBondContact O-OG 3.48Å; Y109-W113 WeakPolarHBondContact O-CB 3.34Å; Y109-W113 PolarHBondContact O-N 3.47Å; Y109-F158 HydrophobicContact CE1-CE1 4.32Å; Y109-D210 HydrophobicContact CD1-CB 4.45Å; Y109-D213 HydrophobicContact CD1-CB 4.29Å; Y109-D213 HydrophobicContact CD2-CB 3.57Å; Y109-D213 HydrophobicContact CE1-CB 4.44Å; Y109-D213 HydrophobicContact CE2-CB 3.72Å; Y109-D213 HydrophobicContact CG-CB 3.89Å; Y109-V214 VanDerWaalsContact C-CG2 3.4Å; Y109-V214 WeakPolarHBondContact O-CG2 3.22Å
110	L	98.4	Very high	97.5	Very high	64 Å²	64	31.8 Å²	31.8	34%	0.335	16%	0.163	S	C	.	.	H	α-helix	trans	-63	-47.6	175.5	-179.4	63	0	0	0	110.3	F106 F108 S114 V214	F106-L110 HydrophobicContact CE1-CD2 4.09Å; F106-L110 HydrophobicContact CE2-CD2 4.5Å; F106-L110 HydrophobicContact CZ-CD2 3.84Å; F106-L110 WeakPolarHBondContact O-CB 3.39Å; F106-L110 PolarHBondContact O-N 3.48Å; F108-L110 VanDerWaalsContact C-N 3.27Å; F108-L110 PolarHBondContact O-N 3.49Å; L110-S114 VanDerWaalsContact O-CB 3.25Å; L110-S114 WeakPolarHBondContact O-CB 3.24Å; L110-S114 PolarHBondContact O-N 2.86Å; L110-S114 PolarHBondContact O-OG 3.07Å; L110-V214 HydrophobicContact CB-CG1 4.39Å; L110-V214 HydrophobicContact CB-CG2 4.46Å; L110-V214 HydrophobicContact CD1-CG1 3.97Å
111	G	98.2	Very high	97.6	Very high	40 Å²	40	36.6 Å²	36.6	41%	0.412	18%	0.183	S	C	.	.	H	α-helix	trans	-64.5	-47.5	177.8	0	0	0	0	0	113.2	L107 F108 S114 Y115	L107-G111 PolarHBondContact O-N 3.19Å; F108-G111 PolarHBondContact O-N 3.09Å; F108-G111 VanDerWaalsContact O-N 3.1Å; G111-S114 PolarHBondContact O-N 3.09Å; G111-Y115 WeakPolarHBondContact O-CB 3.47Å; G111-Y115 PolarHBondContact O-N 2.89Å
112	S	97.3	Very high	97.6	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-65.5	-41.9	-179.3	64.8	0	0	0	0	112	F108 Y109 Y115 S116 D210	F108-S112 PolarHBondContact O-N 3.14Å; F108-S112 PolarHBondContact O-OG 3.15Å; Y109-S112 WeakPolarHBondContact CA-OG 3.24Å; Y109-S112 PolarHBondContact O-OG 3.48Å; S112-Y115 PolarHBondContact O-N 3.45Å; S112-S116 PolarHBondContact O-N 2.93Å; S112-S116 PolarHBondContact O-OG 3.47Å; S112-D210 PolarHBondContact OG-OD2 2.84Å
113	W	98.1	Very high	97.5	Very high	56 Å²	56	40 Å²	40	21%	0.212	21%	0.214	C	C	.	.	H	α-helix	trans	-67.2	-45	176.9	-177.5	76.9	0	0	0	111.4	Y109 Y115 S116 A117 F207 D210 I211 V214	Y109-W113 WeakPolarHBondContact O-CB 3.34Å; Y109-W113 PolarHBondContact O-N 3.47Å; W113-Y115 VanDerWaalsContact C-N 3.29Å; W113-Y115 PolarHBondContact O-N 3.48Å; W113-S116 PolarHBondContact O-N 2.99Å; W113-A117 HydrophobicContact CZ2-CB 4.49Å; W113-A117 WeakPolarHBondContact O-CB 3.48Å; W113-A117 PolarHBondContact O-N 3.25Å; W113-F207 AromaticContact CD1-CD2 3.94Å; W113-F207 VanDerWaalsContact CD1-O 3.25Å; W113-F207 AromaticContact CE2-CD2 3.97Å; W113-F207 AromaticContact CE2-CE2 3.54Å; W113-F207 HydrophobicContact CZ2-CD2 4.43Å; W113-F207 AromaticContact CZ2-CE2 3.56Å; W113-F207 HydrophobicContact CZ2-CE2 3.56Å; W113-F207 HydrophobicContact CZ2-CZ 4.1Å; W113-F207 AromaticContact NE1-CD2 3.3Å; W113-F207 VanDerWaalsContact NE1-CD2 3.3Å; W113-F207 AromaticContact NE1-CE2 3.27Å; W113-F207 VanDerWaalsContact NE1-CE2 3.27Å; W113-F207 PolarHBondContact NE1-O 2.8Å; W113-D210 HydrophobicContact CB-CB 3.94Å; W113-D210 HydrophobicContact CG-CB 4.39Å; W113-I211 HydrophobicContact CD2-CB 4.43Å; W113-I211 HydrophobicContact CD2-CD1 3.91Å; W113-I211 HydrophobicContact CE3-CD1 4.17Å; W113-I211 HydrophobicContact CG-CB 4.38Å; W113-I211 HydrophobicContact CH2-CD1 4.01Å; W113-I211 HydrophobicContact CZ2-CB 4.42Å; W113-I211 HydrophobicContact CZ2-CD1 3.74Å; W113-I211 HydrophobicContact CZ2-CG1 4.16Å; W113-I211 HydrophobicContact CZ3-CD1 4.22Å; W113-V214 HydrophobicContact CB-CG2 4.26Å
114	S	98.4	Very high	97.2	Very high	57 Å²	57	47.7 Å²	47.7	40%	0.399	25%	0.254	S	S	.	.	H	α-helix	trans	-59.8	-39.2	175.5	-70.1	0	0	0	0	112.1	L110 G111 A117 Y118	L110-S114 VanDerWaalsContact O-CB 3.25Å; L110-S114 WeakPolarHBondContact O-CB 3.24Å; L110-S114 PolarHBondContact O-N 2.86Å; L110-S114 PolarHBondContact O-OG 3.07Å; G111-S114 PolarHBondContact O-N 3.09Å; S114-A117 PolarHBondContact O-N 3.38Å; S114-Y118 WeakPolarHBondContact O-CB 3.45Å; S114-Y118 PolarHBondContact O-N 3.15Å
115	Y	98.4	Very high	97	Very high	70 Å²	70	49.4 Å²	49.4	28%	0.275	26%	0.261	S	S	.	.	H	α-helix	trans	-66.9	-42.6	175.7	-172.1	-128.3	0	0	0	112.1	G111 S112 W113 A117 Y118 L119 D147 A150 A151	G111-Y115 WeakPolarHBondContact O-CB 3.47Å; G111-Y115 PolarHBondContact O-N 2.89Å; S112-Y115 PolarHBondContact O-N 3.45Å; W113-Y115 VanDerWaalsContact C-N 3.29Å; W113-Y115 PolarHBondContact O-N 3.48Å; Y115-A117 VanDerWaalsContact C-N 3.34Å; Y115-A117 PolarHBondContact O-N 3.29Å; Y115-Y118 HydrophobicContact CD2-CD1 4.2Å; Y115-Y118 HydrophobicContact CE2-CD1 4.13Å; Y115-Y118 WeakPolarHBondContact O-CB 3.35Å; Y115-Y118 PolarHBondContact O-N 3.28Å; Y115-L119 HydrophobicContact CE1-CD1 4.29Å; Y115-L119 HydrophobicContact CE2-CD2 4.49Å; Y115-L119 WeakPolarHBondContact O-CG 3.36Å; Y115-L119 PolarHBondContact O-N 2.77Å; Y115-D147 WeakPolarHBondContact OH-CA 3.36Å; Y115-D147 PolarHBondContact OH-O 3.41Å; Y115-A150 HydrophobicContact CE1-CB 4.4Å; Y115-A151 HydrophobicContact CD1-CB 3.83Å; Y115-A151 HydrophobicContact CE1-CB 3.65Å
116	S	97.9	Very high	96.8	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-40.6	175.5	-54	0	0	0	0	111.6	S112 W113 Y118 L119 L120	S112-S116 PolarHBondContact O-N 2.93Å; S112-S116 PolarHBondContact O-OG 3.47Å; W113-S116 PolarHBondContact O-N 2.99Å; S116-Y118 VanDerWaalsContact C-N 3.34Å; S116-L119 PolarHBondContact O-N 3.48Å; S116-L120 WeakPolarHBondContact O-CG 3.31Å; S116-L120 PolarHBondContact O-N 2.81Å
117	A	98	Very high	96.5	Very high	15 Å²	15	49.8 Å²	49.8	12%	0.124	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-40.6	174.5	0	0	0	0	0	111.7	W113 S114 Y115 L120 F121 F207	W113-A117 HydrophobicContact CZ2-CB 4.49Å; W113-A117 WeakPolarHBondContact O-CB 3.48Å; W113-A117 PolarHBondContact O-N 3.25Å; S114-A117 PolarHBondContact O-N 3.38Å; Y115-A117 VanDerWaalsContact C-N 3.34Å; Y115-A117 PolarHBondContact O-N 3.29Å; A117-L120 PolarHBondContact O-N 2.83Å; A117-F121 HydrophobicContact CB-CD2 4.36Å; A117-F121 VanDerWaalsContact O-CD2 3.27Å; A117-F121 WeakPolarHBondContact O-CD2 3.5Å; A117-F121 PolarHBondContact O-N 3.37Å; A117-F207 HydrophobicContact CB-CD2 4.09Å; A117-F207 HydrophobicContact CB-CE2 3.78Å
118	Y	97.9	Very high	96.2	Very high	131 Å²	131	46 Å²	46	51%	0.514	25%	0.25	S	C	.	.	H	α-helix	trans	-60.7	-43.9	173.4	167.7	-103.3	0	0	0	111.8	S114 Y115 S116 L120 G122 T123	S114-Y118 WeakPolarHBondContact O-CB 3.45Å; S114-Y118 PolarHBondContact O-N 3.15Å; Y115-Y118 HydrophobicContact CD2-CD1 4.2Å; Y115-Y118 HydrophobicContact CE2-CD1 4.13Å; Y115-Y118 WeakPolarHBondContact O-CB 3.35Å; Y115-Y118 PolarHBondContact O-N 3.28Å; S116-Y118 VanDerWaalsContact C-N 3.34Å; Y118-L120 VanDerWaalsContact C-N 3.32Å; Y118-L120 PolarHBondContact O-N 3.18Å; Y118-G122 CarbonylContact O-C 3.45Å; Y118-G122 WeakPolarHBondContact O-CA 3.37Å; Y118-G122 PolarHBondContact O-N 2.61Å; Y118-T123 HydrophobicContact CE1-CG2 4.06Å; Y118-T123 PolarHBondContact O-N 3.39Å
119	L	97.4	Very high	95.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-43.4	174.8	-64.8	176.5	0	0	0	111.3	Y115 S116 T123 Y125 D147 I148 A151 I203	Y115-L119 HydrophobicContact CE1-CD1 4.29Å; Y115-L119 HydrophobicContact CE2-CD2 4.49Å; Y115-L119 WeakPolarHBondContact O-CG 3.36Å; Y115-L119 PolarHBondContact O-N 2.77Å; S116-L119 PolarHBondContact O-N 3.48Å; L119-T123 PolarHBondContact O-OG1 2.97Å; L119-Y125 HydrophobicContact CB-CD2 4.46Å; L119-Y125 HydrophobicContact CD2-CE2 4.32Å; L119-Y125 WeakPolarHBondContact O-CD2 3.49Å; L119-D147 HydrophobicContact CD2-CB 3.86Å; L119-I148 HydrophobicContact CD1-CG1 4.46Å; L119-A151 HydrophobicContact CD1-CB 4.02Å; L119-I203 HydrophobicContact CB-CG2 4.46Å; L119-I203 HydrophobicContact CD1-CD1 3.98Å; L119-I203 HydrophobicContact CD1-CG2 4.44Å
120	L	96.4	Very high	95.5	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-75.7	-32.1	-175.6	-66.2	-177.6	0	0	0	115.1	S116 A117 Y118 F127 F128 I203 L204 F207	S116-L120 WeakPolarHBondContact O-CG 3.31Å; S116-L120 PolarHBondContact O-N 2.81Å; A117-L120 PolarHBondContact O-N 2.83Å; Y118-L120 VanDerWaalsContact C-N 3.32Å; Y118-L120 PolarHBondContact O-N 3.18Å; L120-F127 HydrophobicContact CD2-CD2 3.77Å; L120-F127 HydrophobicContact CD2-CE2 3.2Å; L120-F127 HydrophobicContact CD2-CZ 4.03Å; L120-F128 HydrophobicContact CB-CB 4.33Å; L120-F128 HydrophobicContact CD1-CB 4.42Å; L120-F128 HydrophobicContact CD1-CD2 3.84Å; L120-F128 HydrophobicContact CD1-CG 4.4Å; L120-F128 HydrophobicContact CD2-CB 4.13Å; L120-I203 HydrophobicContact CD2-CG2 3.84Å; L120-I203 HydrophobicContact CG-CG2 4.23Å; L120-L204 HydrophobicContact CD1-CD2 4.3Å; L120-L204 HydrophobicContact CD2-CD2 4.04Å; L120-F207 HydrophobicContact CD1-CB 3.56Å; L120-F207 HydrophobicContact CD1-CD1 3.5Å; L120-F207 VanDerWaalsContact CD1-CD1 3.5Å; L120-F207 HydrophobicContact CD1-CD2 3.86Å; L120-F207 HydrophobicContact CD1-CE1 4.15Å; L120-F207 HydrophobicContact CD1-CE2 4.45Å; L120-F207 HydrophobicContact CD1-CG 3.33Å
121	F	96.8	Very high	95.1	Very high	109 Å²	109	49.8 Å²	49.8	48%	0.478	27%	0.268	S	S	.	.	H	α-helix	trans	-121.7	-15.8	-170.8	-57	-64.6	0	0	0	114.1	A117 F128 F207	A117-F121 HydrophobicContact CB-CD2 4.36Å; A117-F121 VanDerWaalsContact O-CD2 3.27Å; A117-F121 WeakPolarHBondContact O-CD2 3.5Å; A117-F121 PolarHBondContact O-N 3.37Å; F121-F128 AromaticContact CE1-CD1 3.4Å; F121-F128 HydrophobicContact CE1-CD1 3.4Å; F121-F128 AromaticContact CE1-CE1 3.53Å; F121-F128 HydrophobicContact CE1-CE1 3.53Å; F121-F128 HydrophobicContact CE1-CG 4.01Å; F121-F128 HydrophobicContact CE1-CZ 4.24Å; F121-F128 AromaticContact CZ-CD1 3.71Å; F121-F128 HydrophobicContact CZ-CD1 3.71Å; F121-F128 HydrophobicContact CZ-CD2 4.28Å; F121-F128 AromaticContact CZ-CE1 3.55Å; F121-F128 HydrophobicContact CZ-CE1 3.55Å; F121-F128 HydrophobicContact CZ-CE2 4.13Å; F121-F128 HydrophobicContact CZ-CG 4.07Å; F121-F128 AromaticContact CZ-CZ 3.77Å; F121-F128 HydrophobicContact CZ-CZ 3.77Å; F121-F207 HydrophobicContact CE2-CE1 4.32Å; F121-F207 AromaticContact CE2-CE2 3.85Å; F121-F207 HydrophobicContact CE2-CE2 3.85Å; F121-F207 AromaticContact CE2-CZ 3.6Å; F121-F207 HydrophobicContact CE2-CZ 3.6Å; F121-F207 HydrophobicContact CZ-CE1 4.43Å; F121-F207 HydrophobicContact CZ-CZ 4.07Å
122	G	94.6	Very high	94.7	Very high	47 Å²	47	48.6 Å²	48.6	49%	0.485	25%	0.253	S	S	.	.	S	Bend	trans	-107	1.9	-179.8	0	0	0	0	0	113.9	Y118	Y118-G122 CarbonylContact O-C 3.45Å; Y118-G122 WeakPolarHBondContact O-CA 3.37Å; Y118-G122 PolarHBondContact O-N 2.61Å
123	T	94.8	Very high	94.4	Very high	36 Å²	36	48.9 Å²	48.9	22%	0.221	26%	0.255	C	S	.	.	S	Bend	trans	-132.5	173.7	174.4	79.9	0	0	0	0	110	Y118 L119 Y125	Y118-T123 HydrophobicContact CE1-CG2 4.06Å; Y118-T123 PolarHBondContact O-N 3.39Å; L119-T123 PolarHBondContact O-OG1 2.97Å; T123-Y125 PolarHBondContact O-N 3.32Å; T123-Y125 WeakPolarHBondContact OG1-CD2 3.46Å; T123-Y125 WeakPolarHBondContact OG1-CE2 3.41Å
124	D	91.8	Very high	94.1	Very high	170 Å²	170	46.4 Å²	46.4	91%	0.909	25%	0.246	S	C	*	.	S	Bend	trans	-83.2	16.9	-174.2	-57.6	-50.4	0	0	0	114.3	P126	D124-P126 WeakPolarHBondContact O-CD 3.41Å
125	Y	93.5	Very high	93.8	Very high	50 Å²	50	44 Å²	44	20%	0.196	23%	0.228	C	C	.	.			trans	-69.5	120.3	178.6	-72.1	-47.9	0	0	0	111.9	L119 T123 F127 P145 D147 I148	L119-Y125 HydrophobicContact CB-CD2 4.46Å; L119-Y125 HydrophobicContact CD2-CE2 4.32Å; L119-Y125 WeakPolarHBondContact O-CD2 3.49Å; T123-Y125 PolarHBondContact O-N 3.32Å; T123-Y125 WeakPolarHBondContact OG1-CD2 3.46Å; T123-Y125 WeakPolarHBondContact OG1-CE2 3.41Å; Y125-F127 VanDerWaalsContact CB-CE1 3.41Å; Y125-F127 HydrophobicContact CD1-CD1 4.46Å; Y125-F127 AromaticContact CD1-CE1 3.68Å; Y125-F127 HydrophobicContact CD1-CE1 3.68Å; Y125-F127 HydrophobicContact CD1-CZ 4.46Å; Y125-F127 HydrophobicContact CD2-CE1 4.21Å; Y125-F127 HydrophobicContact CD2-CZ 4.2Å; Y125-F127 HydrophobicContact CG-CD1 4.37Å; Y125-F127 AromaticContact CG-CE1 3.5Å; Y125-F127 HydrophobicContact CG-CE1 3.5Å; Y125-F127 VanDerWaalsContact CG-CE1 3.5Å; Y125-F127 AromaticContact CG-CZ 3.91Å; Y125-F127 HydrophobicContact CG-CZ 3.91Å; Y125-F127 PolarHBondContact O-N 3.02Å; Y125-P145 VanDerWaalsContact OH-CB 3.24Å; Y125-P145 WeakPolarHBondContact OH-CB 3.34Å; Y125-D147 WeakPolarHBondContact CE2-OD2 3.45Å; Y125-D147 PolarHBondContact OH-OD1 2.98Å; Y125-D147 VanDerWaalsContact OH-OD1 3.13Å; Y125-D147 PolarHBondContact OH-OD2 3.14Å; Y125-I148 HydrophobicContact CE1-CD1 4.06Å; Y125-I148 HydrophobicContact CE2-CD1 3.97Å; Y125-I148 HydrophobicContact CE2-CG1 4.09Å
126	P	91.6	Very high	93.5	Very high	72 Å²	72	45.9 Å²	45.9	47%	0.468	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-81.1	-17.1	-171.8	30.7	-35	0	0	0	113.8	D124 F128 H129 D130	D124-P126 WeakPolarHBondContact O-CD 3.41Å; P126-F128 VanDerWaalsContact C-N 3.28Å; P126-F128 PolarHBondContact O-N 3.31Å; P126-F128 VanDerWaalsContact O-N 3.11Å; P126-H129 PolarHBondContact O-N 3Å; P126-D130 PolarHBondContact O-N 2.93Å
127	F	92.2	Very high	93	Very high	3 Å²	3	53 Å²	53	1%	0.013	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-71.8	-11.4	-159.8	51.6	-105.7	0	0	0	116.5	L120 Y125 D130 P131 S133 V134 N200 I203 L204	L120-F127 HydrophobicContact CD2-CD2 3.77Å; L120-F127 HydrophobicContact CD2-CE2 3.2Å; L120-F127 HydrophobicContact CD2-CZ 4.03Å; Y125-F127 VanDerWaalsContact CB-CE1 3.41Å; Y125-F127 HydrophobicContact CD1-CD1 4.46Å; Y125-F127 AromaticContact CD1-CE1 3.68Å; Y125-F127 HydrophobicContact CD1-CE1 3.68Å; Y125-F127 HydrophobicContact CD1-CZ 4.46Å; Y125-F127 HydrophobicContact CD2-CE1 4.21Å; Y125-F127 HydrophobicContact CD2-CZ 4.2Å; Y125-F127 HydrophobicContact CG-CD1 4.37Å; Y125-F127 AromaticContact CG-CE1 3.5Å; Y125-F127 HydrophobicContact CG-CE1 3.5Å; Y125-F127 VanDerWaalsContact CG-CE1 3.5Å; Y125-F127 AromaticContact CG-CZ 3.91Å; Y125-F127 HydrophobicContact CG-CZ 3.91Å; Y125-F127 PolarHBondContact O-N 3.02Å; F127-D130 WeakPolarHBondContact CA-O 3.03Å; F127-P131 WeakPolarHBondContact O-CA 3.38Å; F127-S133 WeakPolarHBondContact CA-OG 3.22Å; F127-S133 WeakPolarHBondContact CB-OG 3.18Å; F127-S133 PolarHBondContact N-OG 3.2Å; F127-V134 HydrophobicContact CB-CB 4.48Å; F127-V134 HydrophobicContact CB-CG1 3.49Å; F127-V134 VanDerWaalsContact CB-CG1 3.49Å; F127-V134 HydrophobicContact CD2-CG1 4.38Å; F127-V134 HydrophobicContact CG-CG1 4.07Å; F127-N200 HydrophobicContact CD1-CB 3.88Å; F127-N200 HydrophobicContact CE1-CB 3.88Å; F127-N200 WeakPolarHBondContact CE1-OD1 3.29Å; F127-N200 HydrophobicContact CG-CB 4.25Å; F127-N200 HydrophobicContact CZ-CB 4.28Å; F127-I203 HydrophobicContact CE2-CB 4.1Å; F127-I203 HydrophobicContact CE2-CG2 3.99Å; F127-I203 HydrophobicContact CZ-CB 4.27Å; F127-I203 HydrophobicContact CZ-CG2 4.23Å; F127-L204 HydrophobicContact CD2-CD1 4.22Å; F127-L204 HydrophobicContact CD2-CD2 3.83Å; F127-L204 HydrophobicContact CD2-CG 3.76Å; F127-L204 HydrophobicContact CE2-CD2 4.33Å; F127-L204 HydrophobicContact CE2-CG 4.25Å
128	F	92.5	Very high	92.8	Very high	14 Å²	14	53.6 Å²	53.6	6%	0.061	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-73.9	-40.1	166.3	-173.8	-96.8	0	0	0	111.9	L120 F121 P126 L204 F207 W258 K262	L120-F128 HydrophobicContact CB-CB 4.33Å; L120-F128 HydrophobicContact CD1-CB 4.42Å; L120-F128 HydrophobicContact CD1-CD2 3.84Å; L120-F128 HydrophobicContact CD1-CG 4.4Å; L120-F128 HydrophobicContact CD2-CB 4.13Å; F121-F128 AromaticContact CE1-CD1 3.4Å; F121-F128 HydrophobicContact CE1-CD1 3.4Å; F121-F128 AromaticContact CE1-CE1 3.53Å; F121-F128 HydrophobicContact CE1-CE1 3.53Å; F121-F128 HydrophobicContact CE1-CG 4.01Å; F121-F128 HydrophobicContact CE1-CZ 4.24Å; F121-F128 AromaticContact CZ-CD1 3.71Å; F121-F128 HydrophobicContact CZ-CD1 3.71Å; F121-F128 HydrophobicContact CZ-CD2 4.28Å; F121-F128 AromaticContact CZ-CE1 3.55Å; F121-F128 HydrophobicContact CZ-CE1 3.55Å; F121-F128 HydrophobicContact CZ-CE2 4.13Å; F121-F128 HydrophobicContact CZ-CG 4.07Å; F121-F128 AromaticContact CZ-CZ 3.77Å; F121-F128 HydrophobicContact CZ-CZ 3.77Å; P126-F128 VanDerWaalsContact C-N 3.28Å; P126-F128 PolarHBondContact O-N 3.31Å; P126-F128 VanDerWaalsContact O-N 3.11Å; F128-L204 HydrophobicContact CB-CD2 4.21Å; F128-L204 HydrophobicContact CD2-CD2 3.93Å; F128-F207 HydrophobicContact CD2-CD1 4.46Å; F128-F207 HydrophobicContact CD2-CE1 4.36Å; F128-F207 HydrophobicContact CE2-CD1 4.08Å; F128-F207 AromaticContact CE2-CE1 3.67Å; F128-F207 HydrophobicContact CE2-CE1 3.67Å; F128-F207 HydrophobicContact CZ-CE1 4.28Å; F128-W258 HydrophobicContact CE2-CE3 4.34Å; F128-W258 HydrophobicContact CE2-CZ3 4.26Å; F128-W258 HydrophobicContact CZ-CE3 4.12Å; F128-W258 AromaticContact CZ-CH2 3.95Å; F128-W258 HydrophobicContact CZ-CH2 3.95Å; F128-W258 AromaticContact CZ-CZ3 3.71Å; F128-W258 HydrophobicContact CZ-CZ3 3.71Å; F128-K262 HydrophobicContact CE2-CD 4.45Å; F128-K262 PolarHBondContact O-NZ 2.87Å
129	H	91	Very high	92.4	Very high	131 Å²	131	51 Å²	51	61%	0.606	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-35	-177	-65.5	-73.9	0	0	0	112.2	P126 P131	P126-H129 PolarHBondContact O-N 3Å; H129-P131 WeakPolarHBondContact O-CD 3.43Å
130	D	90.8	Very high	92	Very high	25 Å²	25	54.4 Å²	54.4	13%	0.134	29%	0.293	C	S	.	.	S	Bend	trans	-119.4	81.8	172.9	-175.6	34.8	0	0	0	110.5	P13 P126 F127 P132 S133 Y136	P13-D130 HydrophobicContact CB-CB 4.44Å; P126-D130 PolarHBondContact O-N 2.93Å; F127-D130 WeakPolarHBondContact CA-O 3.03Å; D130-P132 VanDerWaalsContact C-N 3.34Å; D130-P132 WeakPolarHBondContact OD1-CD 3.25Å; D130-S133 VanDerWaalsContact O-CB 3.29Å; D130-S133 WeakPolarHBondContact O-CB 3.12Å; D130-S133 PolarHBondContact O-N 3.19Å; D130-S133 PolarHBondContact O-OG 3.03Å; D130-Y136 VanDerWaalsContact OD2-CE2 3.25Å; D130-Y136 WeakPolarHBondContact OD2-CE2 3.37Å; D130-Y136 PolarHBondContact OD2-OH 3.32Å
131	P	89.3	Confident	91.5	Very high	15 Å²	15	55.8 Å²	55.8	10%	0.097	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-53.3	-36.2	-175.8	-25.1	33.4	0	0	0	116.3	F127 H129 S133 V134 K262	F127-P131 WeakPolarHBondContact O-CA 3.38Å; H129-P131 WeakPolarHBondContact O-CD 3.43Å; P131-S133 PolarHBondContact O-N 2.93Å; P131-V134 WeakPolarHBondContact O-CG1 3.39Å; P131-V134 WeakPolarHBondContact O-CG2 3.45Å; P131-V134 PolarHBondContact O-N 3.41Å; P131-K262 HydrophobicContact CB-CB 4.12Å; P131-K262 HydrophobicContact CG-CB 3.94Å; P131-K262 HydrophobicContact CG-CD 4.37Å; P131-K262 HydrophobicContact CG-CG 3.81Å
132	P	89.6	Confident	91.3	Very high	14 Å²	14	53 Å²	53	9%	0.091	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-57	-27.2	173.4	-27.3	35.9	0	0	0	114.4	D130 V134 F135 Y136 C270	D130-P132 VanDerWaalsContact C-N 3.34Å; D130-P132 WeakPolarHBondContact OD1-CD 3.25Å; P132-V134 PolarHBondContact O-N 3.36Å; P132-F135 PolarHBondContact O-N 2.95Å; P132-Y136 HydrophobicContact CB-CE1 4.19Å; P132-C270 HydrophobicContact CB-CB 4.11Å; P132-C270 HydrophobicContact CG-CB 4.47Å
133	S	90.9	Very high	91.2	Very high	8 Å²	8	54.8 Å²	54.8	6%	0.056	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-64.3	-11.1	-179.3	69.4	0	0	0	0	115.1	F127 D130 P131 F135 Y136	F127-S133 WeakPolarHBondContact CA-OG 3.22Å; F127-S133 WeakPolarHBondContact CB-OG 3.18Å; F127-S133 PolarHBondContact N-OG 3.2Å; D130-S133 VanDerWaalsContact O-CB 3.29Å; D130-S133 WeakPolarHBondContact O-CB 3.12Å; D130-S133 PolarHBondContact O-N 3.19Å; D130-S133 PolarHBondContact O-OG 3.03Å; P131-S133 PolarHBondContact O-N 2.93Å; S133-F135 PolarHBondContact O-N 3.47Å; S133-Y136 VanDerWaalsContact CA-CD2 3.46Å; S133-Y136 PolarHBondContact O-N 3.22Å; S133-Y136 VanDerWaalsContact O-N 3.12Å
134	V	92.1	Very high	91.2	Very high	5 Å²	5	54 Å²	54	3%	0.03	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-57	-21.1	171.5	-63.8	0	0	0	0	113.6	F127 P131 P132 N200 V201 L204 A266	F127-V134 HydrophobicContact CB-CB 4.48Å; F127-V134 HydrophobicContact CB-CG1 3.49Å; F127-V134 VanDerWaalsContact CB-CG1 3.49Å; F127-V134 HydrophobicContact CD2-CG1 4.38Å; F127-V134 HydrophobicContact CG-CG1 4.07Å; P131-V134 WeakPolarHBondContact O-CG1 3.39Å; P131-V134 WeakPolarHBondContact O-CG2 3.45Å; P131-V134 PolarHBondContact O-N 3.41Å; P132-V134 PolarHBondContact O-N 3.36Å; V134-N200 HydrophobicContact CB-CB 4.01Å; V134-N200 HydrophobicContact CG1-CB 4.08Å; V134-V201 HydrophobicContact CB-CG2 3.77Å; V134-V201 HydrophobicContact CG1-CG2 4.29Å; V134-V201 HydrophobicContact CG2-CG2 3.67Å; V134-L204 HydrophobicContact CG1-CD1 3.65Å; V134-A266 HydrophobicContact CG2-CB 4.03Å
135	F	93.1	Very high	91.3	Very high	5 Å²	5	48 Å²	48	2%	0.022	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-112.6	1.6	178.5	-64.6	-67	0	0	0	114.1	P132 S133 D137 W138 Y198 V201 A266 T267 S271 A274 I278	P132-F135 PolarHBondContact O-N 2.95Å; S133-F135 PolarHBondContact O-N 3.47Å; F135-D137 PolarHBondContact O-N 3.28Å; F135-W138 WeakPolarHBondContact O-CB 3.49Å; F135-W138 PolarHBondContact O-N 3.19Å; F135-Y198 HydrophobicContact CD1-CD1 4.48Å; F135-Y198 AromaticContact CE1-CD1 3.79Å; F135-Y198 HydrophobicContact CE1-CD1 3.79Å; F135-Y198 HydrophobicContact CE1-CE1 4.08Å; F135-Y198 HydrophobicContact CE1-CG 4.35Å; F135-V201 HydrophobicContact CE1-CG2 4.2Å; F135-V201 HydrophobicContact CE2-CG2 4.21Å; F135-V201 HydrophobicContact CZ-CG2 3.76Å; F135-A266 WeakPolarHBondContact CE2-O 3.48Å; F135-T267 HydrophobicContact CE2-CG2 4.22Å; F135-T267 HydrophobicContact CZ-CG2 4.04Å; F135-S271 VanDerWaalsContact CE2-CB 3.49Å; F135-A274 HydrophobicContact CB-CB 3.95Å; F135-I278 HydrophobicContact CD1-CD1 3.53Å; F135-I278 HydrophobicContact CE1-CD1 3.34Å; F135-I278 HydrophobicContact CG-CD1 4.42Å; F135-I278 HydrophobicContact CZ-CD1 4.12Å
136	Y	90.5	Very high	91.4	Very high	111 Å²	111	56.4 Å²	56.4	44%	0.435	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	136.9	176.5	-65.1	-6.8	0	0	0	109.8	D130 P132 S133 W138	D130-Y136 VanDerWaalsContact OD2-CE2 3.25Å; D130-Y136 WeakPolarHBondContact OD2-CE2 3.37Å; D130-Y136 PolarHBondContact OD2-OH 3.32Å; P132-Y136 HydrophobicContact CB-CE1 4.19Å; S133-Y136 VanDerWaalsContact CA-CD2 3.46Å; S133-Y136 PolarHBondContact O-N 3.22Å; S133-Y136 VanDerWaalsContact O-N 3.12Å; Y136-W138 PolarHBondContact O-N 3.45Å
137	D	88.3	Confident	91.7	Very high	150 Å²	150	55.1 Å²	55.1	80%	0.802	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	19.8	-178	-51.6	-45.8	0	0	0	114.6	F135 T139	F135-D137 PolarHBondContact O-N 3.28Å; D137-T139 PolarHBondContact O-N 3.33Å
138	W	93.4	Very high	91.9	Very high	28 Å²	28	55 Å²	55	11%	0.106	29%	0.292	C	S	.	.			trans	-61.5	127.8	176.5	178.8	92.6	0	0	0	109.6	F135 Y136 P140 F196 Y198 V275 P279	F135-W138 WeakPolarHBondContact O-CB 3.49Å; F135-W138 PolarHBondContact O-N 3.19Å; Y136-W138 PolarHBondContact O-N 3.45Å; W138-P140 HydrophobicContact CH2-CG 3.84Å; W138-P140 HydrophobicContact CZ3-CG 4.03Å; W138-F196 PolarHBondContact NE1-O 3.42Å; W138-Y198 AromaticContact CE2-CE1 3.82Å; W138-Y198 HydrophobicContact CZ2-CE1 4.06Å; W138-Y198 AromaticContact NE1-CD1 3.65Å; W138-Y198 AromaticContact NE1-CE1 3.47Å; W138-V275 HydrophobicContact CB-CG2 4.18Å; W138-V275 HydrophobicContact CD2-CG2 4.46Å; W138-V275 HydrophobicContact CE3-CB 4.39Å; W138-V275 HydrophobicContact CE3-CG1 3.66Å; W138-V275 HydrophobicContact CE3-CG2 3.92Å; W138-V275 HydrophobicContact CZ3-CG1 3.73Å; W138-P279 HydrophobicContact CH2-CG 3.53Å; W138-P279 HydrophobicContact CZ2-CG 3.7Å
139	T	89.8	Confident	92.1	Very high	75 Å²	75	55.4 Å²	55.4	46%	0.46	30%	0.299	S	S	.	.			trans	-137.1	145.4	174.9	48.7	0	0	0	0	110.2	D137 G141 M142	D137-T139 PolarHBondContact O-N 3.33Å; T139-G141 PolarHBondContact O-N 2.96Å; T139-M142 WeakPolarHBondContact O-CB 3.36Å; T139-M142 WeakPolarHBondContact O-CG 3.48Å; T139-M142 PolarHBondContact O-N 3.02Å
140	P	88.2	Confident	92.4	Very high	73 Å²	73	51.4 Å²	51.4	47%	0.474	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	131.7	174.1	-25	33.9	0	0	0	110.9	W138 M142	W138-P140 HydrophobicContact CH2-CG 3.84Å; W138-P140 HydrophobicContact CZ3-CG 4.03Å; P140-M142 PolarHBondContact O-N 3.07Å
141	G	86.4	Confident	92.7	Very high	31 Å²	31	50.3 Å²	50.3	32%	0.32	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	4.3	176.1	0	0	0	0	0	115.9	H54 T139	H54-G141 WeakPolarHBondContact CD2-CA 3.41Å; H54-G141 PolarHBondContact CD2-N 3.36Å; H54-G141 VanDerWaalsContact CD2-N 3.29Å; H54-G141 VanDerWaalsContact NE2-CA 3.27Å; H54-G141 WeakPolarHBondContact NE2-CA 3.35Å; H54-G141 PolarHBondContact NE2-N 2.92Å; H54-G141 VanDerWaalsContact NE2-N 3.14Å; T139-G141 PolarHBondContact O-N 2.96Å
142	M	92.2	Very high	93.1	Very high	50 Å²	50	50 Å²	50	25%	0.246	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-50.4	143.8	176.1	70.1	-176.1	-60.9	0	0	111.7	T139 P140 V144 R197	T139-M142 WeakPolarHBondContact O-CB 3.36Å; T139-M142 WeakPolarHBondContact O-CG 3.48Å; T139-M142 PolarHBondContact O-N 3.02Å; P140-M142 PolarHBondContact O-N 3.07Å; M142-V144 PolarHBondContact O-N 3.38Å; M142-R197 HydrophobicContact CG-CB 3.76Å; M142-R197 HydrophobicContact CG-CG 3.89Å; M142-R197 VanDerWaalsContact O-CD 3.24Å; M142-R197 WeakPolarHBondContact O-CD 2.96Å; M142-R197 PolarHBondContact O-NE 3.4Å; M142-R197 HydrophobicContact SD-CB 4.26Å
143	A	92.6	Very high	93.5	Very high	85 Å²	85	52.6 Å²	52.6	70%	0.702	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-63.9	137.2	179.6	0	0	0	0	0	110.2
144	V	94.8	Very high	93.8	Very high	20 Å²	20	54.5 Å²	54.5	12%	0.121	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-85.5	125.5	170.8	-175.5	0	0	0	0	108	M142 I148 A149 Y194 H199	M142-V144 PolarHBondContact O-N 3.38Å; V144-I148 HydrophobicContact CG1-CB 4.1Å; V144-I148 HydrophobicContact CG1-CG2 3.8Å; V144-A149 HydrophobicContact CG1-CB 4.21Å; V144-Y194 HydrophobicContact CB-CE2 3.99Å; V144-Y194 HydrophobicContact CG1-CD2 4.42Å; V144-Y194 HydrophobicContact CG1-CE2 3.75Å; V144-Y194 HydrophobicContact CG2-CD2 4.37Å; V144-Y194 HydrophobicContact CG2-CE2 3.88Å; V144-H199 HydrophobicContact CG1-CB 4.13Å
145	P	95.6	Very high	94	Very high	43 Å²	43	54.3 Å²	54.3	28%	0.279	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-51.8	140.3	173.6	-29.5	37.9	0	0	0	112	Y125 D147 I148 A149	Y125-P145 VanDerWaalsContact OH-CB 3.24Å; Y125-P145 WeakPolarHBondContact OH-CB 3.34Å; P145-D147 VanDerWaalsContact C-N 3.29Å; P145-D147 VanDerWaalsContact C-OD1 3.29Å; P145-D147 WeakPolarHBondContact CB-OD1 3.44Å; P145-D147 PolarHBondContact O-N 3.38Å; P145-I148 HydrophobicContact CB-CB 4.35Å; P145-I148 HydrophobicContact CB-CD1 4.31Å; P145-I148 HydrophobicContact CB-CG1 4.28Å; P145-I148 HydrophobicContact CG-CD1 4.16Å; P145-I148 PolarHBondContact O-N 3.15Å; P145-I148 VanDerWaalsContact O-N 3.14Å; P145-A149 WeakPolarHBondContact O-CB 3.41Å; P145-A149 PolarHBondContact O-N 3.26Å
146	R	95.5	Very high	94.2	Very high	227 Å²	227	54.1 Å²	54.1	86%	0.857	30%	0.299	S	S	*	.	H	α-helix	trans	-63.2	-35.3	-170.5	-71.4	-175.8	-71	170.6	-2.7	113.3	A149 A150	R146-A149 PolarHBondContact O-N 2.96Å; R146-A150 WeakPolarHBondContact O-CB 3.48Å; R146-A150 PolarHBondContact O-N 3.37Å
147	D	96.8	Very high	94.6	Very high	44 Å²	44	49 Å²	49	24%	0.235	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-47.1	173.3	57.7	-25.1	0	0	0	111.7	Y115 L119 Y125 P145 A150 A151	Y115-D147 WeakPolarHBondContact OH-CA 3.36Å; Y115-D147 PolarHBondContact OH-O 3.41Å; L119-D147 HydrophobicContact CD2-CB 3.86Å; Y125-D147 WeakPolarHBondContact CE2-OD2 3.45Å; Y125-D147 PolarHBondContact OH-OD1 2.98Å; Y125-D147 VanDerWaalsContact OH-OD1 3.13Å; Y125-D147 PolarHBondContact OH-OD2 3.14Å; P145-D147 VanDerWaalsContact C-N 3.29Å; P145-D147 VanDerWaalsContact C-OD1 3.29Å; P145-D147 WeakPolarHBondContact CB-OD1 3.44Å; P145-D147 PolarHBondContact O-N 3.38Å; D147-A150 PolarHBondContact O-N 3.03Å; D147-A151 PolarHBondContact O-N 3.13Å; D147-A151 VanDerWaalsContact O-N 3.13Å
148	I	97.1	Very high	95.1	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-43.7	173.2	-65.5	-177.8	0	0	0	110.5	L119 Y125 V144 P145 A150 A151 Y152 H199 I203	L119-I148 HydrophobicContact CD1-CG1 4.46Å; Y125-I148 HydrophobicContact CE1-CD1 4.06Å; Y125-I148 HydrophobicContact CE2-CD1 3.97Å; Y125-I148 HydrophobicContact CE2-CG1 4.09Å; V144-I148 HydrophobicContact CG1-CB 4.1Å; V144-I148 HydrophobicContact CG1-CG2 3.8Å; P145-I148 HydrophobicContact CB-CB 4.35Å; P145-I148 HydrophobicContact CB-CD1 4.31Å; P145-I148 HydrophobicContact CB-CG1 4.28Å; P145-I148 HydrophobicContact CG-CD1 4.16Å; P145-I148 PolarHBondContact O-N 3.15Å; P145-I148 VanDerWaalsContact O-N 3.14Å; I148-A150 VanDerWaalsContact C-N 3.27Å; I148-A150 PolarHBondContact O-N 3.33Å; I148-A151 WeakPolarHBondContact O-CB 3.47Å; I148-A151 PolarHBondContact O-N 3Å; I148-A151 VanDerWaalsContact O-N 3.1Å; I148-Y152 HydrophobicContact CG2-CD2 3.78Å; I148-Y152 HydrophobicContact CG2-CE2 3.85Å; I148-Y152 WeakPolarHBondContact O-CD2 3.41Å; I148-Y152 PolarHBondContact O-N 3.07Å; I148-H199 HydrophobicContact CG2-CB 3.85Å; I148-I203 HydrophobicContact CD1-CG1 4.49Å; I148-I203 HydrophobicContact CG1-CG1 4.3Å; I148-I203 HydrophobicContact CG2-CD1 4.06Å; I148-I203 HydrophobicContact CG2-CG1 3.96Å
149	A	96.7	Very high	95.2	Very high	24 Å²	24	41 Å²	41	20%	0.198	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-37.7	177.3	0	0	0	0	0	112.3	V144 P145 R146 Y152 L153 Y194	V144-A149 HydrophobicContact CG1-CB 4.21Å; P145-A149 WeakPolarHBondContact O-CB 3.41Å; P145-A149 PolarHBondContact O-N 3.26Å; R146-A149 PolarHBondContact O-N 2.96Å; A149-Y152 PolarHBondContact O-N 3.13Å; A149-L153 WeakPolarHBondContact O-CB 3.3Å; A149-L153 PolarHBondContact O-N 2.9Å; A149-Y194 HydrophobicContact CB-CE2 4.17Å
150	A	97.1	Very high	95.5	Very high	46 Å²	46	38.3 Å²	38.3	38%	0.38	23%	0.226	S	C	.	.	H	α-helix	trans	-64.2	-42.1	173.9	0	0	0	0	0	112.1	Y115 R146 D147 I148 Y152 L153 L154	Y115-A150 HydrophobicContact CE1-CB 4.4Å; R146-A150 WeakPolarHBondContact O-CB 3.48Å; R146-A150 PolarHBondContact O-N 3.37Å; D147-A150 PolarHBondContact O-N 3.03Å; I148-A150 VanDerWaalsContact C-N 3.27Å; I148-A150 PolarHBondContact O-N 3.33Å; A150-Y152 VanDerWaalsContact C-N 3.3Å; A150-Y152 PolarHBondContact O-N 3.37Å; A150-L153 PolarHBondContact O-N 2.88Å; A150-L154 VanDerWaalsContact O-CB 3.31Å; A150-L154 WeakPolarHBondContact O-CB 3.29Å; A150-L154 PolarHBondContact O-N 3.28Å
151	A	97.8	Very high	95.9	Very high	2 Å²	2	34.9 Å²	34.9	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-60.9	-42.1	175.4	0	0	0	0	0	111.3	Y115 L119 D147 I148 L154 Q155 I203	Y115-A151 HydrophobicContact CD1-CB 3.83Å; Y115-A151 HydrophobicContact CE1-CB 3.65Å; L119-A151 HydrophobicContact CD1-CB 4.02Å; D147-A151 PolarHBondContact O-N 3.13Å; D147-A151 VanDerWaalsContact O-N 3.13Å; I148-A151 WeakPolarHBondContact O-CB 3.47Å; I148-A151 PolarHBondContact O-N 3Å; I148-A151 VanDerWaalsContact O-N 3.1Å; A151-L154 PolarHBondContact O-N 2.88Å; A151-Q155 WeakPolarHBondContact O-CB 3.4Å; A151-Q155 WeakPolarHBondContact O-CG 3.37Å; A151-Q155 PolarHBondContact O-N 3.49Å; A151-I203 HydrophobicContact CB-CD1 3.81Å
152	Y	97.6	Very high	96.4	Very high	8 Å²	8	33.8 Å²	33.8	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-65.3	-44.3	177.1	-93.7	-101	0	0	0	113	I148 A149 A150 G156 I190 S193 Y194 H199 G202 I203	I148-Y152 HydrophobicContact CG2-CD2 3.78Å; I148-Y152 HydrophobicContact CG2-CE2 3.85Å; I148-Y152 WeakPolarHBondContact O-CD2 3.41Å; I148-Y152 PolarHBondContact O-N 3.07Å; A149-Y152 PolarHBondContact O-N 3.13Å; A150-Y152 VanDerWaalsContact C-N 3.3Å; A150-Y152 PolarHBondContact O-N 3.37Å; Y152-G156 WeakPolarHBondContact O-CA 3.47Å; Y152-G156 PolarHBondContact O-N 3.24Å; Y152-I190 HydrophobicContact CD1-CG2 3.69Å; Y152-I190 HydrophobicContact CE1-CG2 4.06Å; Y152-I190 WeakPolarHBondContact CE1-O 3.47Å; Y152-S193 WeakPolarHBondContact CE1-OG 3.47Å; Y152-S193 PolarHBondContact OH-OG 3.21Å; Y152-Y194 AromaticContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CG 4.12Å; Y152-Y194 HydrophobicContact CD2-CD2 4.42Å; Y152-Y194 HydrophobicContact CE1-CD2 4.23Å; Y152-Y194 AromaticContact CG-CD2 3.71Å; Y152-Y194 HydrophobicContact CG-CD2 3.71Å; Y152-Y194 HydrophobicContact CG-CE2 4.39Å; Y152-H199 HydrophobicContact CE2-CB 3.97Å; Y152-H199 WeakPolarHBondContact CE2-O 3.49Å; Y152-H199 WeakPolarHBondContact OH-CA 3.49Å; Y152-H199 PolarHBondContact OH-O 3.02Å; Y152-G202 WeakPolarHBondContact OH-CA 3.42Å; Y152-I203 HydrophobicContact CD2-CD1 4.17Å; Y152-I203 HydrophobicContact CE2-CD1 3.93Å; Y152-I203 HydrophobicContact CE2-CG1 4.26Å
153	L	97.1	Very high	96.6	Very high	69 Å²	69	33.2 Å²	33.2	36%	0.361	19%	0.188	S	C	.	.	H	α-helix	trans	-63.8	-45.1	176.8	-179.8	61.3	0	0	0	110.9	L62 L63 A149 A150 S157	L62-L153 HydrophobicContact CB-CD1 3.92Å; L62-L153 HydrophobicContact CB-CD2 4.47Å; L63-L153 HydrophobicContact CB-CD1 4.42Å; A149-L153 WeakPolarHBondContact O-CB 3.3Å; A149-L153 PolarHBondContact O-N 2.9Å; A150-L153 PolarHBondContact O-N 2.88Å; L153-S157 WeakPolarHBondContact O-CB 3.42Å; L153-S157 PolarHBondContact O-N 3.36Å; L153-S157 PolarHBondContact O-OG 3.27Å
154	L	97	Very high	96.8	Very high	48 Å²	48	34.6 Å²	34.6	25%	0.251	18%	0.176	S	C	.	.	H	α-helix	trans	-57.2	-53.1	177.5	178.5	62.8	0	0	0	111.2	W70 F108 A150 A151 S157 F158	W70-L154 HydrophobicContact CH2-CD1 3.71Å; W70-L154 HydrophobicContact CZ2-CD1 3.25Å; F108-L154 HydrophobicContact CE2-CD1 3.8Å; F108-L154 HydrophobicContact CE2-CG 3.96Å; F108-L154 HydrophobicContact CZ-CG 4.31Å; A150-L154 VanDerWaalsContact O-CB 3.31Å; A150-L154 WeakPolarHBondContact O-CB 3.29Å; A150-L154 PolarHBondContact O-N 3.28Å; A151-L154 PolarHBondContact O-N 2.88Å; L154-S157 PolarHBondContact O-OG 3.37Å; L154-F158 WeakPolarHBondContact O-CB 3.46Å; L154-F158 PolarHBondContact O-N 2.83Å
155	Q	97.6	Very high	96.8	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-70.2	-50.7	-178.2	-74.6	-80.5	31	0	0	112.6	A151 S157 F158 Y159 I190 L206 D210	A151-Q155 WeakPolarHBondContact O-CB 3.4Å; A151-Q155 WeakPolarHBondContact O-CG 3.37Å; A151-Q155 PolarHBondContact O-N 3.49Å; Q155-S157 VanDerWaalsContact C-N 3.32Å; Q155-S157 PolarHBondContact O-N 2.85Å; Q155-F158 PolarHBondContact O-N 3Å; Q155-F158 VanDerWaalsContact O-N 3.12Å; Q155-Y159 WeakPolarHBondContact O-CD2 3.41Å; Q155-Y159 PolarHBondContact O-N 3.33Å; Q155-I190 HydrophobicContact CB-CD1 4.27Å; Q155-L206 HydrophobicContact CB-CD1 4.28Å; Q155-L206 HydrophobicContact CB-CD2 4.06Å; Q155-L206 HydrophobicContact CG-CD1 3.88Å; Q155-L206 HydrophobicContact CG-CD2 3.82Å; Q155-L206 HydrophobicContact CG-CG 4.37Å; Q155-D210 PolarHBondContact NE2-OD2 2.86Å
156	G	97.4	Very high	96.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58	-44.6	-178.3	0	0	0	0	0	112.2	Y152 Y159 G160 L187	Y152-G156 WeakPolarHBondContact O-CA 3.47Å; Y152-G156 PolarHBondContact O-N 3.24Å; G156-Y159 PolarHBondContact O-N 2.9Å; G156-G160 PolarHBondContact O-N 3.01Å; G156-L187 WeakPolarHBondContact O-CD1 3.3Å
157	S	97.8	Very high	96.6	Very high	4 Å²	4	24.2 Å²	24.2	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-67.4	-37	177	63	0	0	0	0	112.8	L63 A67 W70 L153 L154 Q155 G160 H161	L63-S157 WeakPolarHBondContact O-CB 3.45Å; A67-S157 VanDerWaalsContact CA-O 3.3Å; A67-S157 WeakPolarHBondContact CA-O 3.28Å; A67-S157 VanDerWaalsContact CB-O 3.3Å; A67-S157 WeakPolarHBondContact CB-O 3.49Å; W70-S157 PolarHBondContact NE1-OG 3.44Å; L153-S157 WeakPolarHBondContact O-CB 3.42Å; L153-S157 PolarHBondContact O-N 3.36Å; L153-S157 PolarHBondContact O-OG 3.27Å; L154-S157 PolarHBondContact O-OG 3.37Å; Q155-S157 VanDerWaalsContact C-N 3.32Å; Q155-S157 PolarHBondContact O-N 2.85Å; S157-G160 PolarHBondContact O-N 2.81Å; S157-H161 PolarHBondContact O-N 3.43Å
158	F	97.9	Very high	96.4	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-69	-37.4	175.7	-176	-94.9	0	0	0	113	W70 W104 F108 Y109 L154 Q155 G160 H161 S162	W70-F158 HydrophobicContact CD2-CD2 4.32Å; W70-F158 HydrophobicContact CG-CD2 4.27Å; W104-F158 HydrophobicContact CZ2-CE2 4.39Å; W104-F158 AromaticContact NE1-CE2 3.5Å; F108-F158 HydrophobicContact CB-CD2 4.21Å; F108-F158 HydrophobicContact CB-CE1 4.48Å; F108-F158 HydrophobicContact CB-CE2 3.59Å; F108-F158 HydrophobicContact CB-CZ 3.76Å; F108-F158 AromaticContact CD1-CD1 3.39Å; F108-F158 HydrophobicContact CD1-CD1 3.39Å; F108-F158 AromaticContact CD1-CD2 3.8Å; F108-F158 HydrophobicContact CD1-CD2 3.8Å; F108-F158 AromaticContact CD1-CE1 3.3Å; F108-F158 HydrophobicContact CD1-CE1 3.3Å; F108-F158 AromaticContact CD1-CE2 3.7Å; F108-F158 HydrophobicContact CD1-CE2 3.7Å; F108-F158 AromaticContact CD1-CG 3.64Å; F108-F158 HydrophobicContact CD1-CG 3.64Å; F108-F158 AromaticContact CD1-CZ 3.46Å; F108-F158 HydrophobicContact CD1-CZ 3.46Å; F108-F158 VanDerWaalsContact CD1-CZ 3.46Å; F108-F158 HydrophobicContact CD2-CB 4.12Å; F108-F158 HydrophobicContact CD2-CD1 4.28Å; F108-F158 AromaticContact CD2-CD2 3.25Å; F108-F158 HydrophobicContact CD2-CD2 3.25Å; F108-F158 AromaticContact CD2-CE2 3.58Å; F108-F158 HydrophobicContact CD2-CE2 3.58Å; F108-F158 AromaticContact CD2-CG 3.63Å; F108-F158 HydrophobicContact CD2-CG 3.63Å; F108-F158 HydrophobicContact CD2-CZ 4.23Å; F108-F158 HydrophobicContact CE1-CB 3.83Å; F108-F158 AromaticContact CE1-CD1 3.16Å; F108-F158 HydrophobicContact CE1-CD1 3.16Å; F108-F158 AromaticContact CE1-CD2 3.99Å; F108-F158 HydrophobicContact CE1-CD2 3.99Å; F108-F158 AromaticContact CE1-CE1 3.59Å; F108-F158 HydrophobicContact CE1-CE1 3.59Å; F108-F158 HydrophobicContact CE1-CE2 4.32Å; F108-F158 AromaticContact CE1-CG 3.38Å; F108-F158 HydrophobicContact CE1-CG 3.38Å; F108-F158 HydrophobicContact CE1-CZ 4.15Å; F108-F158 HydrophobicContact CE2-CB 3.35Å; F108-F158 HydrophobicContact CE2-CD1 4.08Å; F108-F158 AromaticContact CE2-CD2 3.45Å; F108-F158 HydrophobicContact CE2-CD2 3.45Å; F108-F158 VanDerWaalsContact CE2-CD2 3.45Å; F108-F158 HydrophobicContact CE2-CE2 4.21Å; F108-F158 AromaticContact CE2-CG 3.36Å; F108-F158 HydrophobicContact CE2-CG 3.36Å; F108-F158 AromaticContact CG-CD1 3.97Å; F108-F158 HydrophobicContact CG-CD1 3.97Å; F108-F158 AromaticContact CG-CD2 3.45Å; F108-F158 HydrophobicContact CG-CD2 3.45Å; F108-F158 VanDerWaalsContact CG-CD2 3.45Å; F108-F158 AromaticContact CG-CE1 3.85Å; F108-F158 HydrophobicContact CG-CE1 3.85Å; F108-F158 AromaticContact CG-CE2 3.29Å; F108-F158 HydrophobicContact CG-CE2 3.29Å; F108-F158 AromaticContact CG-CG 3.77Å; F108-F158 HydrophobicContact CG-CG 3.77Å; F108-F158 AromaticContact CG-CZ 3.51Å; F108-F158 HydrophobicContact CG-CZ 3.51Å; F108-F158 HydrophobicContact CZ-CB 3.19Å; F108-F158 AromaticContact CZ-CD1 3.54Å; F108-F158 HydrophobicContact CZ-CD1 3.54Å; F108-F158 AromaticContact CZ-CD2 3.83Å; F108-F158 HydrophobicContact CZ-CD2 3.83Å; F108-F158 HydrophobicContact CZ-CE1 4.33Å; F108-F158 AromaticContact CZ-CG 3.23Å; F108-F158 HydrophobicContact CZ-CG 3.23Å; Y109-F158 HydrophobicContact CE1-CE1 4.32Å; L154-F158 WeakPolarHBondContact O-CB 3.46Å; L154-F158 PolarHBondContact O-N 2.83Å; Q155-F158 PolarHBondContact O-N 3Å; Q155-F158 VanDerWaalsContact O-N 3.12Å; F158-G160 VanDerWaalsContact C-N 3.34Å; F158-H161 CarbonylContact O-C 3.5Å; F158-H161 WeakPolarHBondContact O-CB 3.2Å; F158-H161 PolarHBondContact O-N 2.99Å; F158-S162 WeakPolarHBondContact CD1-OG 3.35Å; F158-S162 WeakPolarHBondContact CE1-OG 2.91Å; F158-S162 WeakPolarHBondContact O-CB 3.33Å; F158-S162 PolarHBondContact O-N 2.96Å; F158-S162 PolarHBondContact O-OG 3.41Å
159	Y	96	Very high	96.1	Very high	8 Å²	8	33 Å²	33	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-37.1	173.2	-88.9	-91.4	0	0	0	111.5	Q155 G156 H161 S162 I163 H182 H183 T186 I190	Q155-Y159 WeakPolarHBondContact O-CD2 3.41Å; Q155-Y159 PolarHBondContact O-N 3.33Å; G156-Y159 PolarHBondContact O-N 2.9Å; Y159-H161 PolarHBondContact O-N 3.37Å; Y159-S162 WeakPolarHBondContact O-CB 3.48Å; Y159-S162 PolarHBondContact O-N 2.82Å; Y159-S162 VanDerWaalsContact O-N 3.09Å; Y159-I163 PolarHBondContact O-N 3.17Å; Y159-I163 VanDerWaalsContact O-N 3.09Å; Y159-H182 AromaticContact CE1-NE2 3.94Å; Y159-H183 HydrophobicContact CD1-CB 4.46Å; Y159-H183 AromaticContact CD1-ND1 3.57Å; Y159-H183 AromaticContact CE1-ND1 3.6Å; Y159-T186 WeakPolarHBondContact CD1-OG1 3.39Å; Y159-T186 HydrophobicContact CE1-CG2 4.04Å; Y159-T186 WeakPolarHBondContact CE1-OG1 3.47Å; Y159-I190 HydrophobicContact CD2-CD1 3.93Å; Y159-I190 HydrophobicContact CE2-CD1 4.4Å; Y159-I190 HydrophobicContact CG-CD1 4.3Å
160	G	96.6	Very high	95.9	Very high	19 Å²	19	32.9 Å²	32.9	20%	0.196	17%	0.165	C	C	.	.	H	α-helix	trans	-57.3	-46.6	168.5	0	0	0	0	0	112.4	G156 S157 F158 S162	G156-G160 PolarHBondContact O-N 3.01Å; S157-G160 PolarHBondContact O-N 2.81Å; F158-G160 VanDerWaalsContact C-N 3.34Å; G160-S162 VanDerWaalsContact C-N 3.33Å; G160-S162 PolarHBondContact O-N 2.81Å
161	H	97	Very high	95.4	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-41.3	170.8	164.2	66.6	0	0	0	112.5	W70 T71 R74 W104 S157 F158 Y159 I163 Y164 A165	W70-H161 HydrophobicContact CB-CB 3.72Å; T71-H161 VanDerWaalsContact CA-ND1 3.35Å; T71-H161 WeakPolarHBondContact CA-ND1 3.41Å; T71-H161 PolarHBondContact N-ND1 3.09Å; T71-H161 PolarHBondContact OG1-ND1 2.84Å; R74-H161 VanDerWaalsContact CD-NE2 3.34Å; R74-H161 WeakPolarHBondContact CD-NE2 3.28Å; W104-H161 AromaticContact NE1-CD2 3.99Å; W104-H161 AromaticContact NE1-NE2 3.53Å; S157-H161 PolarHBondContact O-N 3.43Å; F158-H161 CarbonylContact O-C 3.5Å; F158-H161 WeakPolarHBondContact O-CB 3.2Å; F158-H161 PolarHBondContact O-N 2.99Å; Y159-H161 PolarHBondContact O-N 3.37Å; H161-I163 VanDerWaalsContact C-N 3.3Å; H161-I163 PolarHBondContact O-N 2.78Å; H161-Y164 PolarHBondContact O-N 3.12Å; H161-Y164 VanDerWaalsContact O-N 3.15Å; H161-A165 WeakPolarHBondContact O-CB 3.37Å; H161-A165 PolarHBondContact O-N 3.05Å
162	S	96.1	Very high	95	Very high	8 Å²	8	39.4 Å²	39.4	6%	0.056	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-31.4	-175.7	-63.3	0	0	0	0	113	F158 Y159 G160 A165 T166	F158-S162 WeakPolarHBondContact CD1-OG 3.35Å; F158-S162 WeakPolarHBondContact CE1-OG 2.91Å; F158-S162 WeakPolarHBondContact O-CB 3.33Å; F158-S162 PolarHBondContact O-N 2.96Å; F158-S162 PolarHBondContact O-OG 3.41Å; Y159-S162 WeakPolarHBondContact O-CB 3.48Å; Y159-S162 PolarHBondContact O-N 2.82Å; Y159-S162 VanDerWaalsContact O-N 3.09Å; G160-S162 VanDerWaalsContact C-N 3.33Å; G160-S162 PolarHBondContact O-N 2.81Å; S162-A165 PolarHBondContact O-N 3.33Å; S162-T166 VanDerWaalsContact O-CB 3.31Å; S162-T166 WeakPolarHBondContact O-CB 3.16Å; S162-T166 PolarHBondContact O-N 2.96Å; S162-T166 PolarHBondContact O-OG1 2.97Å
163	I	96.8	Very high	94.6	Very high	37 Å²	37	40 Å²	40	19%	0.19	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-53.5	170.7	-66.3	172	0	0	0	110	Y159 H161 A165 T166 L167 L180 H183 V184 L187	Y159-I163 PolarHBondContact O-N 3.17Å; Y159-I163 VanDerWaalsContact O-N 3.09Å; H161-I163 VanDerWaalsContact C-N 3.3Å; H161-I163 PolarHBondContact O-N 2.78Å; I163-A165 VanDerWaalsContact C-N 3.32Å; I163-A165 PolarHBondContact O-N 3.36Å; I163-T166 PolarHBondContact O-N 3.42Å; I163-L167 HydrophobicContact CG2-CD1 4.29Å; I163-L167 WeakPolarHBondContact O-CG 3.08Å; I163-L167 PolarHBondContact O-N 3.41Å; I163-L180 HydrophobicContact CG2-CD1 3.99Å; I163-H183 HydrophobicContact CG1-CB 3.67Å; I163-V184 HydrophobicContact CD1-CG2 4.12Å; I163-L187 HydrophobicContact CD1-CD2 3.82Å
164	Y	96.5	Very high	94.3	Very high	114 Å²	114	40.5 Å²	40.5	45%	0.447	19%	0.19	S	C	.	.	H	α-helix	trans	-60.3	-43.9	177.5	175.6	-94.2	0	0	0	111.6	T71 H161 T166 L167 Y168 M169	T71-Y164 HydrophobicContact CG2-CD1 3.82Å; T71-Y164 HydrophobicContact CG2-CE1 3.65Å; H161-Y164 PolarHBondContact O-N 3.12Å; H161-Y164 VanDerWaalsContact O-N 3.15Å; Y164-T166 PolarHBondContact O-N 3.18Å; Y164-L167 PolarHBondContact O-N 2.61Å; Y164-Y168 AromaticContact CD2-CD2 3.5Å; Y164-Y168 HydrophobicContact CD2-CD2 3.5Å; Y164-Y168 VanDerWaalsContact CD2-CD2 3.5Å; Y164-Y168 AromaticContact CD2-CE2 3.96Å; Y164-Y168 HydrophobicContact CD2-CE2 3.96Å; Y164-Y168 AromaticContact CE2-CD2 3.48Å; Y164-Y168 HydrophobicContact CE2-CD2 3.48Å; Y164-Y168 VanDerWaalsContact CE2-CD2 3.48Å; Y164-Y168 HydrophobicContact CE2-CE2 4.05Å; Y164-Y168 HydrophobicContact CE2-CG 4.19Å; Y164-Y168 HydrophobicContact CG-CD2 4.18Å; Y164-Y168 WeakPolarHBondContact O-CD2 3.48Å; Y164-Y168 PolarHBondContact O-N 2.85Å; Y164-M169 HydrophobicContact CD1-CG 4.42Å; Y164-M169 HydrophobicContact CD1-SD 4.09Å; Y164-M169 HydrophobicContact CE1-CG 4.06Å; Y164-M169 HydrophobicContact CE1-SD 3.9Å
165	A	94.8	Very high	94	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-44.8	178.6	0	0	0	0	0	112	R74 H161 S162 I163 L167 Y168 M169 D170	R74-A165 VanDerWaalsContact NH1-CB 3.28Å; H161-A165 WeakPolarHBondContact O-CB 3.37Å; H161-A165 PolarHBondContact O-N 3.05Å; S162-A165 PolarHBondContact O-N 3.33Å; I163-A165 VanDerWaalsContact C-N 3.32Å; I163-A165 PolarHBondContact O-N 3.36Å; A165-L167 VanDerWaalsContact C-N 3.28Å; A165-L167 PolarHBondContact O-N 3.34Å; A165-Y168 PolarHBondContact O-N 2.86Å; A165-M169 HydrophobicContact CB-CB 4.31Å; A165-M169 HydrophobicContact CB-SD 4.35Å; A165-M169 CarbonylContact O-C 3.55Å; A165-M169 WeakPolarHBondContact O-CA 3.33Å; A165-M169 WeakPolarHBondContact O-CB 3.46Å; A165-M169 PolarHBondContact O-N 3.47Å; A165-D170 PolarHBondContact O-N 3.36Å
166	T	93	Very high	93.8	Very high	6 Å²	6	38.6 Å²	38.6	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-61.2	-39	178.8	-61.5	0	0	0	0	111.5	S162 I163 Y164 W172 L180 H183	S162-T166 VanDerWaalsContact O-CB 3.31Å; S162-T166 WeakPolarHBondContact O-CB 3.16Å; S162-T166 PolarHBondContact O-N 2.96Å; S162-T166 PolarHBondContact O-OG1 2.97Å; I163-T166 PolarHBondContact O-N 3.42Å; Y164-T166 PolarHBondContact O-N 3.18Å; T166-W172 PolarHBondContact O-NE1 3.36Å; T166-L180 HydrophobicContact CG2-CB 4.23Å; T166-L180 HydrophobicContact CG2-CD1 4.48Å; T166-H183 PolarHBondContact OG1-CD2 3.49Å; T166-H183 PolarHBondContact OG1-NE2 2.94Å
167	L	93.2	Very high	93.6	Very high	66 Å²	66	43.4 Å²	43.4	35%	0.346	21%	0.21	S	C	.	.	H	α-helix	trans	-72.7	-40.6	-179.8	-69.4	172.3	0	0	0	113.2	I163 Y164 A165 W172 L180	I163-L167 HydrophobicContact CG2-CD1 4.29Å; I163-L167 WeakPolarHBondContact O-CG 3.08Å; I163-L167 PolarHBondContact O-N 3.41Å; Y164-L167 PolarHBondContact O-N 2.61Å; A165-L167 VanDerWaalsContact C-N 3.28Å; A165-L167 PolarHBondContact O-N 3.34Å; L167-W172 HydrophobicContact CD2-CZ2 4.29Å; L167-L180 HydrophobicContact CD2-CD1 4.23Å; L167-L180 HydrophobicContact CD2-CD2 3.75Å; L167-L180 HydrophobicContact CG-CD1 4.12Å
168	Y	93.3	Very high	93.5	Very high	167 Å²	167	44.9 Å²	44.9	66%	0.655	22%	0.219	S	C	*	.	H	α-helix	trans	-125.9	-18.8	-164.2	-58.1	-70.1	0	0	0	116.1	Y164 A165	Y164-Y168 AromaticContact CD2-CD2 3.5Å; Y164-Y168 HydrophobicContact CD2-CD2 3.5Å; Y164-Y168 VanDerWaalsContact CD2-CD2 3.5Å; Y164-Y168 AromaticContact CD2-CE2 3.96Å; Y164-Y168 HydrophobicContact CD2-CE2 3.96Å; Y164-Y168 AromaticContact CE2-CD2 3.48Å; Y164-Y168 HydrophobicContact CE2-CD2 3.48Å; Y164-Y168 VanDerWaalsContact CE2-CD2 3.48Å; Y164-Y168 HydrophobicContact CE2-CE2 4.05Å; Y164-Y168 HydrophobicContact CE2-CG 4.19Å; Y164-Y168 HydrophobicContact CG-CD2 4.18Å; Y164-Y168 WeakPolarHBondContact O-CD2 3.48Å; Y164-Y168 PolarHBondContact O-N 2.85Å; A165-Y168 PolarHBondContact O-N 2.86Å
169	M	91.8	Very high	93.4	Very high	62 Å²	62	47 Å²	47	31%	0.305	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-37	-173.8	-58.2	-177.9	70.4	0	0	113.6	T71 R74 Y164 A165	T71-M169 HydrophobicContact CG2-SD 4.17Å; R74-M169 HydrophobicContact CG-CE 4.1Å; Y164-M169 HydrophobicContact CD1-CG 4.42Å; Y164-M169 HydrophobicContact CD1-SD 4.09Å; Y164-M169 HydrophobicContact CE1-CG 4.06Å; Y164-M169 HydrophobicContact CE1-SD 3.9Å; A165-M169 HydrophobicContact CB-CB 4.31Å; A165-M169 HydrophobicContact CB-SD 4.35Å; A165-M169 CarbonylContact O-C 3.55Å; A165-M169 WeakPolarHBondContact O-CA 3.33Å; A165-M169 WeakPolarHBondContact O-CB 3.46Å; A165-M169 PolarHBondContact O-N 3.47Å
170	D	91.1	Very high	93.4	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.107	24%	0.237	C	C	.	.	S	Bend	trans	-84	153	-173.6	-73.1	7.9	0	0	0	111.3	R74 K105 A165 W172	R74-D170 IonicContact CZ-OD1 3.31Å; R74-D170 IonicContact NH1-OD1 3.73Å; R74-D170 PolarHBondContact NH1-OD1 2.9Å; R74-D170 IonicContact NH2-OD1 2.86Å; R74-D170 PolarHBondContact NH2-OD1 2.86Å; K105-D170 WeakPolarHBondContact CE-OD2 3.46Å; K105-D170 IonicContact NZ-OD2 2.76Å; K105-D170 PolarHBondContact NZ-OD2 2.92Å; A165-D170 PolarHBondContact O-N 3.36Å; D170-W172 PolarHBondContact O-N 3.14Å
171	T	88.3	Confident	93.4	Very high	78 Å²	78	51.7 Å²	51.7	48%	0.479	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-74.3	124.8	173.4	-55.4	0	0	0	0	109.8	E101 R173	E101-T171 PolarHBondContact OE2-N 3.46Å; T171-R173 PolarHBondContact O-NH1 3.42Å; T171-R173 VanDerWaalsContact O-NH1 3.1Å
172	W	88.9	Confident	93.4	Very high	107 Å²	107	52 Å²	52	41%	0.405	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-67.5	137.9	175.5	-82.7	55.7	0	0	0	111.9	T166 L167 D170 S176 V177 Y323	T166-W172 PolarHBondContact O-NE1 3.36Å; L167-W172 HydrophobicContact CD2-CZ2 4.29Å; D170-W172 PolarHBondContact O-N 3.14Å; W172-S176 VanDerWaalsContact CA-OG 3.31Å; W172-S176 WeakPolarHBondContact CA-OG 3.36Å; W172-V177 HydrophobicContact CZ3-CG2 3.95Å; W172-Y323 WeakPolarHBondContact O-CD2 2.95Å; W172-Y323 WeakPolarHBondContact O-CE2 3.33Å
173	R	89.3	Confident	93.5	Very high	22 Å²	22	51.9 Å²	51.9	8%	0.083	25%	0.25	C	C	.	.			trans	-132.5	169.9	-177	-65.6	177.5	-171.6	92.5	-7.5	108.9	E101 T171 D175 S176 R321 Y323	E101-R173 IonicContact OE1-CZ 2.83Å; E101-R173 IonicContact OE1-NH1 3Å; E101-R173 PolarHBondContact OE1-NH1 3.07Å; E101-R173 IonicContact OE1-NH2 2.81Å; E101-R173 PolarHBondContact OE1-NH2 2.87Å; E101-R173 VanDerWaalsContact OE1-NH2 3.09Å; E101-R173 IonicContact OE2-NH2 3.12Å; T171-R173 PolarHBondContact O-NH1 3.42Å; T171-R173 VanDerWaalsContact O-NH1 3.1Å; R173-D175 WeakPolarHBondContact CB-OD1 3.47Å; R173-D175 PolarHBondContact O-N 3.28Å; R173-S176 PolarHBondContact N-OG 2.91Å; R173-S176 VanDerWaalsContact O-CB 3.31Å; R173-S176 WeakPolarHBondContact O-CB 3.39Å; R173-S176 PolarHBondContact O-N 3.46Å; R173-S176 PolarHBondContact O-OG 2.94Å; R173-R321 HydrophobicContact CB-CB 4.34Å; R173-R321 WeakPolarHBondContact CB-O 3.39Å; R173-Y323 VanDerWaalsContact C-CE2 3.42Å; R173-Y323 VanDerWaalsContact CA-CE2 3.49Å; R173-Y323 PolarHBondContact O-OH 3.23Å
174	K	89.4	Confident	93.5	Very high	78 Å²	78	53 Å²	53	34%	0.339	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-28.1	-177.9	-68.1	179.9	-176.5	-167.1	0	113.1	R321 Y323 E327	K174-R321 WeakPolarHBondContact CB-O 3.48Å; K174-R321 WeakPolarHBondContact CG-O 3.41Å; K174-R321 PolarHBondContact N-O 3.24Å; K174-Y323 HydrophobicContact CB-CE1 4.44Å; K174-Y323 HydrophobicContact CG-CD1 3.76Å; K174-Y323 HydrophobicContact CG-CE1 3.59Å; K174-Y323 HydrophobicContact CG-CG 4.5Å; K174-E327 WeakPolarHBondContact CE-OE2 3.48Å; K174-E327 IonicContact NZ-OE1 2.97Å; K174-E327 IonicContact NZ-OE2 3.93Å; K174-E327 PolarHBondContact NZ-OE2 2.59Å
175	D	91.8	Very high	93.6	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.016	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	6.3	178.8	68.4	-37.3	0	0	0	114.4	R173 V177 V178 M179 Y297 W298 R321	R173-D175 WeakPolarHBondContact CB-OD1 3.47Å; R173-D175 PolarHBondContact O-N 3.28Å; D175-V177 VanDerWaalsContact C-N 3.27Å; D175-V177 PolarHBondContact O-N 3.27Å; D175-V178 CarbonylContact O-C 3.53Å; D175-V178 WeakPolarHBondContact O-CA 3.26Å; D175-V178 PolarHBondContact O-N 3.44Å; D175-M179 PolarHBondContact O-N 3.36Å; D175-Y297 HydrophobicContact CB-CE1 4.32Å; D175-W298 PolarHBondContact OD2-NE1 3.22Å; D175-R321 VanDerWaalsContact OD2-CD 3.3Å; D175-R321 WeakPolarHBondContact OD2-CD 3.18Å; D175-R321 IonicContact OD2-CZ 2.64Å; D175-R321 IonicContact OD2-NE 3.64Å; D175-R321 IonicContact OD2-NH1 3.18Å; D175-R321 PolarHBondContact OD2-NH1 3Å; D175-R321 VanDerWaalsContact OD2-NH1 3.09Å
176	S	92.3	Very high	93.7	Very high	8 Å²	8	48.3 Å²	48.3	6%	0.056	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-35.1	-174.6	-79.9	0	0	0	0	114.3	W172 R173 M179 L180	W172-S176 VanDerWaalsContact CA-OG 3.31Å; W172-S176 WeakPolarHBondContact CA-OG 3.36Å; R173-S176 PolarHBondContact N-OG 2.91Å; R173-S176 VanDerWaalsContact O-CB 3.31Å; R173-S176 WeakPolarHBondContact O-CB 3.39Å; R173-S176 PolarHBondContact O-N 3.46Å; R173-S176 PolarHBondContact O-OG 2.94Å; S176-M179 PolarHBondContact O-N 3.45Å; S176-L180 WeakPolarHBondContact O-CB 3.38Å; S176-L180 PolarHBondContact O-N 3.24Å
177	V	94.4	Very high	93.9	Very high	100 Å²	100	49.7 Å²	49.7	61%	0.606	25%	0.248	S	C	*	.	H	α-helix	trans	-66.9	-42.5	175.5	178.1	0	0	0	0	110.9	W172 D175 L180 L181	W172-V177 HydrophobicContact CZ3-CG2 3.95Å; D175-V177 VanDerWaalsContact C-N 3.27Å; D175-V177 PolarHBondContact O-N 3.27Å; V177-L180 PolarHBondContact O-N 2.79Å; V177-L181 PolarHBondContact O-N 3Å
178	V	95.9	Very high	94.1	Very high	36 Å²	36	49.9 Å²	49.9	22%	0.218	25%	0.249	C	C	.	.	H	α-helix	trans	-66.6	-39.8	176.8	-176.1	0	0	0	0	110.4	D175 L181 H182 M294 Y297 W298	D175-V178 CarbonylContact O-C 3.53Å; D175-V178 WeakPolarHBondContact O-CA 3.26Å; D175-V178 PolarHBondContact O-N 3.44Å; V178-L181 PolarHBondContact O-N 3.4Å; V178-H182 VanDerWaalsContact O-CB 3.28Å; V178-H182 WeakPolarHBondContact O-CB 3.32Å; V178-H182 PolarHBondContact O-N 2.91Å; V178-M294 HydrophobicContact CG1-CG 4.43Å; V178-Y297 HydrophobicContact CB-CE1 4.31Å; V178-Y297 HydrophobicContact CG1-CD1 4.14Å; V178-Y297 HydrophobicContact CG1-CE1 4.14Å; V178-Y297 HydrophobicContact CG2-CE1 4.11Å; V178-W298 HydrophobicContact CB-CZ2 4.43Å; V178-W298 HydrophobicContact CG1-CH2 4.27Å; V178-W298 HydrophobicContact CG1-CZ2 3.72Å
179	M	95.2	Very high	94.3	Very high	45 Å²	45	42.5 Å²	42.5	22%	0.222	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-41.5	173.5	-75.4	-60.5	-50	0	0	112.5	D175 S176 H182 H183 W298	D175-M179 PolarHBondContact O-N 3.36Å; S176-M179 PolarHBondContact O-N 3.45Å; M179-H182 WeakPolarHBondContact O-CB 3.21Å; M179-H182 PolarHBondContact O-N 3.47Å; M179-H183 PolarHBondContact O-CD2 2.98Å; M179-H183 PolarHBondContact O-N 3.42Å; M179-W298 HydrophobicContact CG-CZ2 4.2Å; M179-W298 HydrophobicContact SD-CH2 4.08Å; M179-W298 HydrophobicContact SD-CZ2 3.39Å; M179-W298 WeakPolarHBondContact SD-CZ2 3.37Å
180	L	96.1	Very high	94.6	Very high	39 Å²	39	40.1 Å²	40.1	20%	0.204	21%	0.209	C	C	.	.	H	α-helix	trans	-64.5	-46.7	175.5	-178.6	65.5	0	0	0	111.4	I163 T166 L167 S176 V177 H182 H183 V184	I163-L180 HydrophobicContact CG2-CD1 3.99Å; T166-L180 HydrophobicContact CG2-CB 4.23Å; T166-L180 HydrophobicContact CG2-CD1 4.48Å; L167-L180 HydrophobicContact CD2-CD1 4.23Å; L167-L180 HydrophobicContact CD2-CD2 3.75Å; L167-L180 HydrophobicContact CG-CD1 4.12Å; S176-L180 WeakPolarHBondContact O-CB 3.38Å; S176-L180 PolarHBondContact O-N 3.24Å; V177-L180 PolarHBondContact O-N 2.79Å; L180-H182 VanDerWaalsContact C-N 3.27Å; L180-H182 PolarHBondContact O-N 3.45Å; L180-H183 PolarHBondContact O-N 2.75Å; L180-V184 WeakPolarHBondContact O-CG2 3.33Å; L180-V184 PolarHBondContact O-N 3.31Å
181	L	97.1	Very high	94.8	Very high	88 Å²	88	41.2 Å²	41.2	46%	0.461	22%	0.216	S	C	.	.	H	α-helix	trans	-59.2	-42	175.7	-179.3	63.6	0	0	0	110.9	V177 V178 V184 V185 M294	V177-L181 PolarHBondContact O-N 3Å; V178-L181 PolarHBondContact O-N 3.4Å; L181-V184 PolarHBondContact O-N 2.94Å; L181-V185 HydrophobicContact CD1-CG2 4.34Å; L181-V185 HydrophobicContact CG-CG2 4.42Å; L181-V185 WeakPolarHBondContact O-CB 3.43Å; L181-V185 VanDerWaalsContact O-CG2 3.31Å; L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 2.84Å; L181-M294 HydrophobicContact CB-CE 4.22Å; L181-M294 HydrophobicContact CD2-CE 3.57Å; L181-M294 HydrophobicContact CG-CE 3.54Å
182	H	97.3	Very high	95.1	Very high	8 Å²	8	38 Å²	38	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-49.6	174	167.2	82.7	0	0	0	111.9	Y159 V178 M179 L180 V184 V185 T186 M294 W298	Y159-H182 AromaticContact CE1-NE2 3.94Å; V178-H182 VanDerWaalsContact O-CB 3.28Å; V178-H182 WeakPolarHBondContact O-CB 3.32Å; V178-H182 PolarHBondContact O-N 2.91Å; M179-H182 WeakPolarHBondContact O-CB 3.21Å; M179-H182 PolarHBondContact O-N 3.47Å; L180-H182 VanDerWaalsContact C-N 3.27Å; L180-H182 PolarHBondContact O-N 3.45Å; H182-V184 VanDerWaalsContact C-N 3.25Å; H182-V184 PolarHBondContact O-N 2.94Å; H182-V185 PolarHBondContact O-N 2.85Å; H182-V185 VanDerWaalsContact O-N 3.15Å; H182-T186 WeakPolarHBondContact CE1-CG2 3.48Å; H182-T186 WeakPolarHBondContact O-CG2 3.23Å; H182-T186 PolarHBondContact O-N 3.4Å; H182-T186 PolarHBondContact O-OG1 3.18Å; H182-M294 HydrophobicContact CB-SD 3.78Å; H182-W298 HydrophobicContact CB-CH2 3.68Å; H182-W298 HydrophobicContact CB-CZ2 4.42Å; H182-W298 AromaticContact CG-CH2 3.71Å; H182-W298 AromaticContact ND1-CH2 3.83Å
183	H	97.3	Very high	95.5	Very high	5 Å²	5	33 Å²	33	2%	0.023	18%	0.179	C	C	.	.	H	α-helix	trans	-60.3	-35	178.3	-67.7	-41.8	0	0	0	113.1	Y159 I163 T166 M179 L180 T186 L187	Y159-H183 HydrophobicContact CD1-CB 4.46Å; Y159-H183 AromaticContact CD1-ND1 3.57Å; Y159-H183 AromaticContact CE1-ND1 3.6Å; I163-H183 HydrophobicContact CG1-CB 3.67Å; T166-H183 PolarHBondContact OG1-CD2 3.49Å; T166-H183 PolarHBondContact OG1-NE2 2.94Å; M179-H183 PolarHBondContact O-CD2 2.98Å; M179-H183 PolarHBondContact O-N 3.42Å; L180-H183 PolarHBondContact O-N 2.75Å; H183-T186 WeakPolarHBondContact CA-OG1 3.17Å; H183-T186 PolarHBondContact O-OG1 3.04Å; H183-L187 VanDerWaalsContact O-CB 3.24Å; H183-L187 WeakPolarHBondContact O-CB 3.48Å; H183-L187 PolarHBondContact O-N 3.47Å; H183-L187 VanDerWaalsContact O-N 3.07Å
184	V	97.3	Very high	95.8	Very high	59 Å²	59	33.3 Å²	33.3	36%	0.358	18%	0.18	S	C	.	.	H	α-helix	trans	-67.8	-49	173.5	173.4	0	0	0	0	110.8	I163 L180 L181 H182 T186 L187 I188	I163-V184 HydrophobicContact CD1-CG2 4.12Å; L180-V184 WeakPolarHBondContact O-CG2 3.33Å; L180-V184 PolarHBondContact O-N 3.31Å; L181-V184 PolarHBondContact O-N 2.94Å; H182-V184 VanDerWaalsContact C-N 3.25Å; H182-V184 PolarHBondContact O-N 2.94Å; V184-T186 PolarHBondContact O-N 2.72Å; V184-L187 PolarHBondContact O-N 2.94Å; V184-I188 HydrophobicContact CG1-CD1 3.87Å; V184-I188 VanDerWaalsContact O-CG1 3.28Å; V184-I188 WeakPolarHBondContact O-CG1 3.43Å; V184-I188 PolarHBondContact O-N 3.23Å
185	V	97.9	Very high	96	Very high	6 Å²	6	29.9 Å²	29.9	4%	0.036	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-44.7	179.9	167.9	0	0	0	0	111.5	L181 H182 I188 L189 L287 L290 M294	L181-V185 HydrophobicContact CD1-CG2 4.34Å; L181-V185 HydrophobicContact CG-CG2 4.42Å; L181-V185 WeakPolarHBondContact O-CB 3.43Å; L181-V185 VanDerWaalsContact O-CG2 3.31Å; L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 2.84Å; H182-V185 PolarHBondContact O-N 2.85Å; H182-V185 VanDerWaalsContact O-N 3.15Å; V185-I188 PolarHBondContact O-N 2.95Å; V185-L189 HydrophobicContact CG1-CD1 4.08Å; V185-L189 WeakPolarHBondContact O-CG 3.29Å; V185-L189 PolarHBondContact O-N 2.94Å; V185-L287 HydrophobicContact CG1-CD2 4.29Å; V185-L290 HydrophobicContact CG1-CD2 4.36Å; V185-L290 HydrophobicContact CG2-CD2 3.61Å; V185-L290 HydrophobicContact CG2-CG 4.46Å; V185-M294 HydrophobicContact CG2-CE 4.15Å
186	T	97.3	Very high	96.2	Very high	11 Å²	11	30.1 Å²	30.1	7%	0.067	17%	0.167	C	C	.	.	H	α-helix	trans	-68.4	-38	178.6	55.1	0	0	0	0	112	Y159 H182 H183 V184 I188 L189 I190 L291	Y159-T186 WeakPolarHBondContact CD1-OG1 3.39Å; Y159-T186 HydrophobicContact CE1-CG2 4.04Å; Y159-T186 WeakPolarHBondContact CE1-OG1 3.47Å; H182-T186 WeakPolarHBondContact CE1-CG2 3.48Å; H182-T186 WeakPolarHBondContact O-CG2 3.23Å; H182-T186 PolarHBondContact O-N 3.4Å; H182-T186 PolarHBondContact O-OG1 3.18Å; H183-T186 WeakPolarHBondContact CA-OG1 3.17Å; H183-T186 PolarHBondContact O-OG1 3.04Å; V184-T186 PolarHBondContact O-N 2.72Å; T186-I188 VanDerWaalsContact C-N 3.33Å; T186-I188 PolarHBondContact O-N 3.19Å; T186-L189 WeakPolarHBondContact O-CB 3.45Å; T186-L189 PolarHBondContact O-N 3.29Å; T186-I190 WeakPolarHBondContact O-CB 3.31Å; T186-I190 VanDerWaalsContact O-CG1 3.24Å; T186-I190 WeakPolarHBondContact O-CG1 3.32Å; T186-I190 PolarHBondContact O-N 2.95Å; T186-L291 HydrophobicContact CG2-CD1 4.19Å
187	L	97.2	Very high	96.3	Very high	35 Å²	35	31.1 Å²	31.1	18%	0.183	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-41.2	174.3	-175.2	62	0	0	0	111.2	G156 I163 H183 V184 I190 V191	G156-L187 WeakPolarHBondContact O-CD1 3.3Å; I163-L187 HydrophobicContact CD1-CD2 3.82Å; H183-L187 VanDerWaalsContact O-CB 3.24Å; H183-L187 WeakPolarHBondContact O-CB 3.48Å; H183-L187 PolarHBondContact O-N 3.47Å; H183-L187 VanDerWaalsContact O-N 3.07Å; V184-L187 PolarHBondContact O-N 2.94Å; L187-I190 PolarHBondContact O-N 3.11Å; L187-V191 HydrophobicContact CD1-CG2 4.33Å; L187-V191 WeakPolarHBondContact O-CB 3.47Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.48Å
188	I	97.1	Very high	96.4	Very high	70 Å²	70	26.6 Å²	26.6	36%	0.359	14%	0.142	S	C	.	.	H	α-helix	trans	-62.9	-44	173.6	-66.4	167.1	0	0	0	110.5	V184 V185 T186 V191 S192 F283 L287	V184-I188 HydrophobicContact CG1-CD1 3.87Å; V184-I188 VanDerWaalsContact O-CG1 3.28Å; V184-I188 WeakPolarHBondContact O-CG1 3.43Å; V184-I188 PolarHBondContact O-N 3.23Å; V185-I188 PolarHBondContact O-N 2.95Å; T186-I188 VanDerWaalsContact C-N 3.33Å; T186-I188 PolarHBondContact O-N 3.19Å; I188-V191 PolarHBondContact O-N 3.45Å; I188-S192 VanDerWaalsContact O-CB 3.22Å; I188-S192 WeakPolarHBondContact O-CB 3.37Å; I188-S192 PolarHBondContact O-N 2.88Å; I188-S192 PolarHBondContact O-OG 3.48Å; I188-F283 HydrophobicContact CG2-CE1 4.43Å; I188-F283 HydrophobicContact CG2-CZ 3.71Å; I188-L287 HydrophobicContact CB-CD1 4.47Å; I188-L287 HydrophobicContact CG2-CD1 3.59Å
189	L	98	Very high	96.4	Very high	12 Å²	12	25 Å²	25	6%	0.063	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-47.5	175.7	-82.3	166.7	0	0	0	111.7	V185 T186 S192 S193 F284 L287 L288 L291	V185-L189 HydrophobicContact CG1-CD1 4.08Å; V185-L189 WeakPolarHBondContact O-CG 3.29Å; V185-L189 PolarHBondContact O-N 2.94Å; T186-L189 WeakPolarHBondContact O-CB 3.45Å; T186-L189 PolarHBondContact O-N 3.29Å; L189-S192 PolarHBondContact O-OG 3.48Å; L189-S193 VanDerWaalsContact O-CB 3.22Å; L189-S193 WeakPolarHBondContact O-CB 3.21Å; L189-S193 PolarHBondContact O-N 3.26Å; L189-S193 PolarHBondContact O-OG 3.13Å; L189-F284 HydrophobicContact CD2-CD2 3.97Å; L189-F284 HydrophobicContact CD2-CE2 3.61Å; L189-F284 HydrophobicContact CD2-CZ 4.09Å; L189-L287 HydrophobicContact CD1-CB 4.27Å; L189-L287 HydrophobicContact CD2-CB 3.53Å; L189-L287 HydrophobicContact CD2-CD1 4.13Å; L189-L287 HydrophobicContact CG-CB 3.81Å; L189-L287 HydrophobicContact CG-CD1 4.24Å; L189-L288 HydrophobicContact CD1-CD2 4.2Å; L189-L288 HydrophobicContact CD2-CD2 3.83Å; L189-L288 HydrophobicContact CD2-CG 4.07Å; L189-L291 HydrophobicContact CD1-CD2 4.09Å
190	I	97.4	Very high	96.5	Very high	13 Å²	13	24 Å²	24	7%	0.067	13%	0.127	C	C	.	.	H	α-helix	trans	-62.2	-48.7	178.9	-68.7	165.2	0	0	0	110.8	Y152 Q155 Y159 T186 L187 S193 Y194 L206	Y152-I190 HydrophobicContact CD1-CG2 3.69Å; Y152-I190 HydrophobicContact CE1-CG2 4.06Å; Y152-I190 WeakPolarHBondContact CE1-O 3.47Å; Q155-I190 HydrophobicContact CB-CD1 4.27Å; Y159-I190 HydrophobicContact CD2-CD1 3.93Å; Y159-I190 HydrophobicContact CE2-CD1 4.4Å; Y159-I190 HydrophobicContact CG-CD1 4.3Å; T186-I190 WeakPolarHBondContact O-CB 3.31Å; T186-I190 VanDerWaalsContact O-CG1 3.24Å; T186-I190 WeakPolarHBondContact O-CG1 3.32Å; T186-I190 PolarHBondContact O-N 2.95Å; L187-I190 PolarHBondContact O-N 3.11Å; I190-S193 PolarHBondContact O-OG 3.05Å; I190-Y194 WeakPolarHBondContact O-CB 3.25Å; I190-Y194 PolarHBondContact O-N 3.11Å; I190-L206 HydrophobicContact CD1-CD2 4.39Å
191	V	95.8	Very high	96.5	Very high	43 Å²	43	22.1 Å²	22.1	26%	0.261	12%	0.117	S	C	.	.	H	α-helix	trans	-66.7	-44.9	-178.3	172.4	0	0	0	0	110.8	L55 L63 L187 I188 Y194 A195	L55-V191 HydrophobicContact CD2-CG1 3.92Å; L63-V191 HydrophobicContact CD1-CG2 4.29Å; L187-V191 HydrophobicContact CD1-CG2 4.33Å; L187-V191 WeakPolarHBondContact O-CB 3.47Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.48Å; I188-V191 PolarHBondContact O-N 3.45Å; V191-Y194 PolarHBondContact O-N 3.49Å; V191-A195 VanDerWaalsContact O-CB 3.29Å; V191-A195 WeakPolarHBondContact O-CB 3.34Å; V191-A195 PolarHBondContact O-N 3Å
192	S	95.1	Very high	96.5	Very high	10 Å²	10	18.3 Å²	18.3	7%	0.07	10%	0.099	C	C	.	.	H	α-helix	trans	-70.7	-38.5	-179.6	61	0	0	0	0	112.9	I188 L189 Y194 A195 F196	I188-S192 VanDerWaalsContact O-CB 3.22Å; I188-S192 WeakPolarHBondContact O-CB 3.37Å; I188-S192 PolarHBondContact O-N 2.88Å; I188-S192 PolarHBondContact O-OG 3.48Å; L189-S192 PolarHBondContact O-OG 3.48Å; S192-Y194 VanDerWaalsContact C-N 3.3Å; S192-Y194 PolarHBondContact O-N 3.46Å; S192-A195 PolarHBondContact O-N 3.5Å; S192-F196 WeakPolarHBondContact O-CB 3.49Å; S192-F196 WeakPolarHBondContact O-CD2 3.5Å; S192-F196 VanDerWaalsContact O-CG 3.31Å; S192-F196 WeakPolarHBondContact O-CG 3.46Å; S192-F196 PolarHBondContact O-N 3.26Å
193	S	96.6	Very high	96.6	Very high	3 Å²	3	18 Å²	18	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-66.1	-34.4	174.6	67.4	0	0	0	0	111.6	Y152 L189 I190 R197 Y198	Y152-S193 WeakPolarHBondContact CE1-OG 3.47Å; Y152-S193 PolarHBondContact OH-OG 3.21Å; L189-S193 VanDerWaalsContact O-CB 3.22Å; L189-S193 WeakPolarHBondContact O-CB 3.21Å; L189-S193 PolarHBondContact O-N 3.26Å; L189-S193 PolarHBondContact O-OG 3.13Å; I190-S193 PolarHBondContact O-OG 3.05Å; S193-R197 CarbonylContact O-C 3.6Å; S193-R197 PolarHBondContact O-N 2.95Å; S193-Y198 CarbonylContact O-C 3.56Å; S193-Y198 WeakPolarHBondContact O-CA 3.33Å; S193-Y198 PolarHBondContact O-N 2.88Å
194	Y	95.8	Very high	96.6	Very high	28 Å²	28	17.8 Å²	17.8	11%	0.11	10%	0.097	C	C	.	.	H	α-helix	trans	-68.1	-46.3	172.8	-166.2	-92.1	0	0	0	112	L55 E59 V144 A149 Y152 I190 V191 S192 R197	L55-Y194 HydrophobicContact CD1-CD1 3.72Å; L55-Y194 HydrophobicContact CD1-CE1 4.19Å; E59-Y194 PolarHBondContact OE1-OH 3.37Å; E59-Y194 VanDerWaalsContact OE1-OH 3.11Å; V144-Y194 HydrophobicContact CB-CE2 3.99Å; V144-Y194 HydrophobicContact CG1-CD2 4.42Å; V144-Y194 HydrophobicContact CG1-CE2 3.75Å; V144-Y194 HydrophobicContact CG2-CD2 4.37Å; V144-Y194 HydrophobicContact CG2-CE2 3.88Å; A149-Y194 HydrophobicContact CB-CE2 4.17Å; Y152-Y194 AromaticContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CD2 3.6Å; Y152-Y194 HydrophobicContact CD1-CG 4.12Å; Y152-Y194 HydrophobicContact CD2-CD2 4.42Å; Y152-Y194 HydrophobicContact CE1-CD2 4.23Å; Y152-Y194 AromaticContact CG-CD2 3.71Å; Y152-Y194 HydrophobicContact CG-CD2 3.71Å; Y152-Y194 HydrophobicContact CG-CE2 4.39Å; I190-Y194 WeakPolarHBondContact O-CB 3.25Å; I190-Y194 PolarHBondContact O-N 3.11Å; V191-Y194 PolarHBondContact O-N 3.49Å; S192-Y194 VanDerWaalsContact C-N 3.3Å; S192-Y194 PolarHBondContact O-N 3.46Å; Y194-R197 WeakPolarHBondContact O-CD 3.44Å; Y194-R197 PolarHBondContact O-N 3.5Å; Y194-R197 PolarHBondContact O-NH1 3.45Å
195	A	94.2	Very high	96.6	Very high	6 Å²	6	15.9 Å²	15.9	5%	0.05	9%	0.085	C	C	.	.	H	α-helix	trans	-64.1	-44	-177.7	0	0	0	0	0	112.3	A53 H54 V191 S192 R197	A53-A195 HydrophobicContact CB-CB 4.2Å; H54-A195 PolarHBondContact N-O 2.87Å; V191-A195 VanDerWaalsContact O-CB 3.29Å; V191-A195 WeakPolarHBondContact O-CB 3.34Å; V191-A195 PolarHBondContact O-N 3Å; S192-A195 PolarHBondContact O-N 3.5Å; A195-R197 VanDerWaalsContact C-N 3.29Å; A195-R197 PolarHBondContact O-N 3.48Å
196	F	94.2	Very high	96.6	Very high	8 Å²	8	16.1 Å²	16.1	4%	0.035	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	6.1	179.2	-52.4	-37.7	0	0	0	113.7	L49 H52 A53 W138 S192 Y198 F280 F283	L49-F196 HydrophobicContact CD1-CE1 3.98Å; L49-F196 HydrophobicContact CD1-CZ 3.97Å; H52-F196 HydrophobicContact CB-CD1 4.39Å; A53-F196 HydrophobicContact CB-CE1 4.02Å; W138-F196 PolarHBondContact NE1-O 3.42Å; S192-F196 WeakPolarHBondContact O-CB 3.49Å; S192-F196 WeakPolarHBondContact O-CD2 3.5Å; S192-F196 VanDerWaalsContact O-CG 3.31Å; S192-F196 WeakPolarHBondContact O-CG 3.46Å; S192-F196 PolarHBondContact O-N 3.26Å; F196-Y198 VanDerWaalsContact C-N 3.28Å; F196-Y198 HydrophobicContact CB-CD2 4.09Å; F196-Y198 HydrophobicContact CB-CE1 4.27Å; F196-Y198 HydrophobicContact CB-CE2 3.8Å; F196-Y198 HydrophobicContact CB-CG 4.43Å; F196-Y198 HydrophobicContact CD2-CE2 4.21Å; F196-Y198 HydrophobicContact CG-CE2 4.45Å; F196-Y198 WeakPolarHBondContact O-CE1 3.5Å; F196-Y198 PolarHBondContact O-N 2.89Å; F196-F280 AromaticContact CD1-CD2 3.87Å; F196-F280 HydrophobicContact CD1-CD2 3.87Å; F196-F280 HydrophobicContact CD1-CE2 4.26Å; F196-F280 HydrophobicContact CD2-CB 4.07Å; F196-F280 HydrophobicContact CD2-CD2 4.2Å; F196-F280 HydrophobicContact CD2-CG 4.37Å; F196-F280 AromaticContact CE1-CD2 3.31Å; F196-F280 HydrophobicContact CE1-CD2 3.31Å; F196-F280 AromaticContact CE1-CE2 3.43Å; F196-F280 HydrophobicContact CE1-CE2 3.43Å; F196-F280 VanDerWaalsContact CE1-CE2 3.43Å; F196-F280 HydrophobicContact CE1-CG 4.12Å; F196-F280 HydrophobicContact CE1-CZ 4.32Å; F196-F280 HydrophobicContact CE2-CB 3.64Å; F196-F280 HydrophobicContact CE2-CD1 4.41Å; F196-F280 AromaticContact CE2-CD2 3.67Å; F196-F280 HydrophobicContact CE2-CD2 3.67Å; F196-F280 HydrophobicContact CE2-CE2 4.45Å; F196-F280 AromaticContact CE2-CG 3.65Å; F196-F280 HydrophobicContact CE2-CG 3.65Å; F196-F280 HydrophobicContact CG-CD2 4.3Å; F196-F280 HydrophobicContact CZ-CB 4.06Å; F196-F280 HydrophobicContact CZ-CD1 4.1Å; F196-F280 AromaticContact CZ-CD2 3.19Å; F196-F280 HydrophobicContact CZ-CD2 3.19Å; F196-F280 HydrophobicContact CZ-CE1 4.39Å; F196-F280 AromaticContact CZ-CE2 3.55Å; F196-F280 HydrophobicContact CZ-CE2 3.55Å; F196-F280 AromaticContact CZ-CG 3.51Å; F196-F280 HydrophobicContact CZ-CG 3.51Å; F196-F280 HydrophobicContact CZ-CZ 4.14Å; F196-F283 HydrophobicContact CE2-CD1 4.33Å; F196-F283 HydrophobicContact CE2-CE1 4.39Å
197	R	95.4	Very high	96.7	Very high	29 Å²	29	15.8 Å²	15.8	11%	0.109	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	27.9	-179.8	-49.8	-57.1	-170	-149.5	6.3	114.7	H54 M142 S193 Y194 A195 H199	H54-R197 VanDerWaalsContact CB-NH2 3.3Å; H54-R197 PolarHBondContact O-NH1 3.01Å; H54-R197 VanDerWaalsContact O-NH1 3.16Å; M142-R197 HydrophobicContact CG-CB 3.76Å; M142-R197 HydrophobicContact CG-CG 3.89Å; M142-R197 VanDerWaalsContact O-CD 3.24Å; M142-R197 WeakPolarHBondContact O-CD 2.96Å; M142-R197 PolarHBondContact O-NE 3.4Å; M142-R197 HydrophobicContact SD-CB 4.26Å; S193-R197 CarbonylContact O-C 3.6Å; S193-R197 PolarHBondContact O-N 2.95Å; Y194-R197 WeakPolarHBondContact O-CD 3.44Å; Y194-R197 PolarHBondContact O-N 3.5Å; Y194-R197 PolarHBondContact O-NH1 3.45Å; A195-R197 VanDerWaalsContact C-N 3.29Å; A195-R197 PolarHBondContact O-N 3.48Å; R197-H199 PolarHBondContact O-N 3.21Å; R197-H199 VanDerWaalsContact O-N 3.1Å; R197-H199 PolarHBondContact O-ND1 3.15Å; R197-H199 VanDerWaalsContact O-ND1 3.08Å
198	Y	96.3	Very high	96.7	Very high	5 Å²	5	14.1 Å²	14.1	2%	0.02	8%	0.075	C	C	.	.			trans	-82.1	34.6	166.3	-52.7	-25.4	0	0	0	112.3	F135 W138 S193 F196 N200 V201 G202 I278 P279 F284	F135-Y198 HydrophobicContact CD1-CD1 4.48Å; F135-Y198 AromaticContact CE1-CD1 3.79Å; F135-Y198 HydrophobicContact CE1-CD1 3.79Å; F135-Y198 HydrophobicContact CE1-CE1 4.08Å; F135-Y198 HydrophobicContact CE1-CG 4.35Å; W138-Y198 AromaticContact CE2-CE1 3.82Å; W138-Y198 HydrophobicContact CZ2-CE1 4.06Å; W138-Y198 AromaticContact NE1-CD1 3.65Å; W138-Y198 AromaticContact NE1-CE1 3.47Å; S193-Y198 CarbonylContact O-C 3.56Å; S193-Y198 WeakPolarHBondContact O-CA 3.33Å; S193-Y198 PolarHBondContact O-N 2.88Å; F196-Y198 VanDerWaalsContact C-N 3.28Å; F196-Y198 HydrophobicContact CB-CD2 4.09Å; F196-Y198 HydrophobicContact CB-CE1 4.27Å; F196-Y198 HydrophobicContact CB-CE2 3.8Å; F196-Y198 HydrophobicContact CB-CG 4.43Å; F196-Y198 HydrophobicContact CD2-CE2 4.21Å; F196-Y198 HydrophobicContact CG-CE2 4.45Å; F196-Y198 WeakPolarHBondContact O-CE1 3.5Å; F196-Y198 PolarHBondContact O-N 2.89Å; Y198-N200 VanDerWaalsContact C-N 3.32Å; Y198-N200 PolarHBondContact O-N 2.9Å; Y198-V201 WeakPolarHBondContact O-CB 3.46Å; Y198-V201 PolarHBondContact O-N 3.26Å; Y198-V201 VanDerWaalsContact O-N 3.16Å; Y198-G202 PolarHBondContact O-N 3.34Å; Y198-G202 VanDerWaalsContact O-N 3.15Å; Y198-I278 HydrophobicContact CE1-CD1 3.7Å; Y198-I278 HydrophobicContact CE1-CG1 3.91Å; Y198-I278 VanDerWaalsContact OH-CG1 3.28Å; Y198-I278 WeakPolarHBondContact OH-CG1 3.44Å; Y198-P279 VanDerWaalsContact OH-CD 3.3Å; Y198-P279 WeakPolarHBondContact OH-CD 3.35Å; Y198-P279 WeakPolarHBondContact OH-CG 3.47Å; Y198-P279 PolarHBondContact OH-O 2.81Å; Y198-F284 AromaticContact CD2-CD1 3.94Å; Y198-F284 HydrophobicContact CD2-CD1 3.94Å; Y198-F284 HydrophobicContact CD2-CD2 4.13Å; Y198-F284 HydrophobicContact CD2-CE1 4.09Å; Y198-F284 HydrophobicContact CD2-CE2 4.3Å; Y198-F284 AromaticContact CD2-CG 3.95Å; Y198-F284 HydrophobicContact CD2-CG 3.95Å; Y198-F284 HydrophobicContact CD2-CZ 4.28Å; Y198-F284 HydrophobicContact CE2-CB 4.43Å; Y198-F284 HydrophobicContact CE2-CD1 4.45Å; Y198-F284 HydrophobicContact CE2-CG 4.27Å
199	H	95.8	Very high	96.8	Very high	3 Å²	3	11.1 Å²	11.1	1%	0.014	6%	0.06	C	C	.	.	H	α-helix	trans	-65	-38.7	-168	52.2	-86.2	0	0	0	111.8	V144 I148 Y152 R197 V201 G202 I203	V144-H199 HydrophobicContact CG1-CB 4.13Å; I148-H199 HydrophobicContact CG2-CB 3.85Å; Y152-H199 HydrophobicContact CE2-CB 3.97Å; Y152-H199 WeakPolarHBondContact CE2-O 3.49Å; Y152-H199 WeakPolarHBondContact OH-CA 3.49Å; Y152-H199 PolarHBondContact OH-O 3.02Å; R197-H199 PolarHBondContact O-N 3.21Å; R197-H199 VanDerWaalsContact O-N 3.1Å; R197-H199 PolarHBondContact O-ND1 3.15Å; R197-H199 VanDerWaalsContact O-ND1 3.08Å; H199-V201 PolarHBondContact O-N 3.37Å; H199-G202 PolarHBondContact O-N 2.87Å; H199-G202 VanDerWaalsContact O-N 3.14Å; H199-I203 PolarHBondContact O-N 3Å
200	N	96.6	Very high	96.8	Very high	22 Å²	22	10.6 Å²	10.6	12%	0.118	6%	0.057	C	C	.	.	H	α-helix	trans	-59.1	-43.2	174.5	-64.7	-20.3	0	0	0	112.5	F127 V134 Y198 G202 I203 L204	F127-N200 HydrophobicContact CD1-CB 3.88Å; F127-N200 HydrophobicContact CE1-CB 3.88Å; F127-N200 WeakPolarHBondContact CE1-OD1 3.29Å; F127-N200 HydrophobicContact CG-CB 4.25Å; F127-N200 HydrophobicContact CZ-CB 4.28Å; V134-N200 HydrophobicContact CB-CB 4.01Å; V134-N200 HydrophobicContact CG1-CB 4.08Å; Y198-N200 VanDerWaalsContact C-N 3.32Å; Y198-N200 PolarHBondContact O-N 2.9Å; N200-G202 VanDerWaalsContact C-N 3.33Å; N200-G202 PolarHBondContact O-N 3.35Å; N200-I203 PolarHBondContact O-N 3.43Å; N200-L204 PolarHBondContact O-N 2.79Å
201	V	97.3	Very high	96.8	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.006	6%	0.058	C	C	.	.	H	α-helix	trans	-59.4	-47.2	174.7	-177.5	0	0	0	0	110	V134 F135 Y198 H199 I203 L204 V205 V263 T267 F284	V134-V201 HydrophobicContact CB-CG2 3.77Å; V134-V201 HydrophobicContact CG1-CG2 4.29Å; V134-V201 HydrophobicContact CG2-CG2 3.67Å; F135-V201 HydrophobicContact CE1-CG2 4.2Å; F135-V201 HydrophobicContact CE2-CG2 4.21Å; F135-V201 HydrophobicContact CZ-CG2 3.76Å; Y198-V201 WeakPolarHBondContact O-CB 3.46Å; Y198-V201 PolarHBondContact O-N 3.26Å; Y198-V201 VanDerWaalsContact O-N 3.16Å; H199-V201 PolarHBondContact O-N 3.37Å; V201-I203 PolarHBondContact O-N 2.91Å; V201-L204 WeakPolarHBondContact O-CB 3.31Å; V201-L204 PolarHBondContact O-N 2.9Å; V201-V205 WeakPolarHBondContact O-CG2 3.48Å; V201-V205 PolarHBondContact O-N 3.32Å; V201-V263 HydrophobicContact CG1-CG1 3.73Å; V201-T267 HydrophobicContact CG1-CG2 3.56Å; V201-T267 HydrophobicContact CG2-CG2 4.15Å; V201-F284 HydrophobicContact CG1-CE1 4.04Å; V201-F284 HydrophobicContact CG1-CZ 4.43Å
202	G	97.4	Very high	96.8	Very high	8 Å²	8	8.7 Å²	8.7	8%	0.082	5%	0.045	C	C	.	.	H	α-helix	trans	-66.4	-32.7	-179.3	0	0	0	0	0	113.6	Y152 Y198 H199 N200 L204 V205 L206	Y152-G202 WeakPolarHBondContact OH-CA 3.42Å; Y198-G202 PolarHBondContact O-N 3.34Å; Y198-G202 VanDerWaalsContact O-N 3.15Å; H199-G202 PolarHBondContact O-N 2.87Å; H199-G202 VanDerWaalsContact O-N 3.14Å; N200-G202 VanDerWaalsContact C-N 3.33Å; N200-G202 PolarHBondContact O-N 3.35Å; G202-L204 VanDerWaalsContact C-N 3.31Å; G202-L204 PolarHBondContact O-N 3.37Å; G202-V205 PolarHBondContact O-N 2.92Å; G202-V205 VanDerWaalsContact O-N 3.11Å; G202-L206 VanDerWaalsContact O-CG 3.23Å; G202-L206 WeakPolarHBondContact O-CG 3.22Å; G202-L206 PolarHBondContact O-N 3.09Å
203	I	98.1	Very high	96.9	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-60.2	-42.2	172.2	-64.6	-55.9	0	0	0	111.2	L119 L120 F127 I148 A151 Y152 H199 N200 V201 V205 L206 F207	L119-I203 HydrophobicContact CB-CG2 4.46Å; L119-I203 HydrophobicContact CD1-CD1 3.98Å; L119-I203 HydrophobicContact CD1-CG2 4.44Å; L120-I203 HydrophobicContact CD2-CG2 3.84Å; L120-I203 HydrophobicContact CG-CG2 4.23Å; F127-I203 HydrophobicContact CE2-CB 4.1Å; F127-I203 HydrophobicContact CE2-CG2 3.99Å; F127-I203 HydrophobicContact CZ-CB 4.27Å; F127-I203 HydrophobicContact CZ-CG2 4.23Å; I148-I203 HydrophobicContact CD1-CG1 4.49Å; I148-I203 HydrophobicContact CG1-CG1 4.3Å; I148-I203 HydrophobicContact CG2-CD1 4.06Å; I148-I203 HydrophobicContact CG2-CG1 3.96Å; A151-I203 HydrophobicContact CB-CD1 3.81Å; Y152-I203 HydrophobicContact CD2-CD1 4.17Å; Y152-I203 HydrophobicContact CE2-CD1 3.93Å; Y152-I203 HydrophobicContact CE2-CG1 4.26Å; H199-I203 PolarHBondContact O-N 3Å; N200-I203 PolarHBondContact O-N 3.43Å; V201-I203 PolarHBondContact O-N 2.91Å; I203-V205 VanDerWaalsContact C-N 3.35Å; I203-V205 PolarHBondContact O-N 3.44Å; I203-L206 HydrophobicContact CD1-CD1 4.28Å; I203-L206 PolarHBondContact O-N 2.94Å; I203-F207 WeakPolarHBondContact O-CB 3.33Å; I203-F207 PolarHBondContact O-N 3.43Å
204	L	97.9	Very high	97	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-60.5	-44.6	172.7	-68.6	176.7	0	0	0	111.5	L120 F127 F128 V134 N200 V201 G202 F207 L208 V263	L120-L204 HydrophobicContact CD1-CD2 4.3Å; L120-L204 HydrophobicContact CD2-CD2 4.04Å; F127-L204 HydrophobicContact CD2-CD1 4.22Å; F127-L204 HydrophobicContact CD2-CD2 3.83Å; F127-L204 HydrophobicContact CD2-CG 3.76Å; F127-L204 HydrophobicContact CE2-CD2 4.33Å; F127-L204 HydrophobicContact CE2-CG 4.25Å; F128-L204 HydrophobicContact CB-CD2 4.21Å; F128-L204 HydrophobicContact CD2-CD2 3.93Å; V134-L204 HydrophobicContact CG1-CD1 3.65Å; N200-L204 PolarHBondContact O-N 2.79Å; V201-L204 WeakPolarHBondContact O-CB 3.31Å; V201-L204 PolarHBondContact O-N 2.9Å; G202-L204 VanDerWaalsContact C-N 3.31Å; G202-L204 PolarHBondContact O-N 3.37Å; L204-F207 PolarHBondContact O-N 2.9Å; L204-L208 WeakPolarHBondContact O-CB 3.5Å; L204-L208 WeakPolarHBondContact O-CG 3.38Å; L204-L208 PolarHBondContact O-N 3.22Å; L204-V263 HydrophobicContact CB-CG2 3.88Å; L204-V263 HydrophobicContact CD1-CG2 4.45Å
205	V	98.2	Very high	97	Very high	19 Å²	19	10.3 Å²	10.3	12%	0.115	5%	0.054	C	C	.	.	H	α-helix	trans	-59.6	-49.2	178.4	178.3	0	0	0	0	111.1	V201 G202 I203 L208 H209 F259 V263 L288 L291	V201-V205 WeakPolarHBondContact O-CG2 3.48Å; V201-V205 PolarHBondContact O-N 3.32Å; G202-V205 PolarHBondContact O-N 2.92Å; G202-V205 VanDerWaalsContact O-N 3.11Å; I203-V205 VanDerWaalsContact C-N 3.35Å; I203-V205 PolarHBondContact O-N 3.44Å; V205-L208 PolarHBondContact O-N 2.97Å; V205-H209 PolarHBondContact O-N 3.34Å; V205-H209 PolarHBondContact O-ND1 2.85Å; V205-F259 HydrophobicContact CG2-CE2 3.98Å; V205-V263 HydrophobicContact CG2-CG1 3.76Å; V205-V263 HydrophobicContact CG2-CG2 4.38Å; V205-L288 HydrophobicContact CG2-CD2 4.17Å; V205-L291 HydrophobicContact CG1-CD2 4.12Å
206	L	97.9	Very high	97.1	Very high	11 Å²	11	11.1 Å²	11.1	6%	0.058	6%	0.057	C	C	.	.	H	α-helix	trans	-59.9	-48.5	-179.5	-65.5	170.1	0	0	0	111.5	Q155 I190 G202 I203 L208 H209 D210	Q155-L206 HydrophobicContact CB-CD1 4.28Å; Q155-L206 HydrophobicContact CB-CD2 4.06Å; Q155-L206 HydrophobicContact CG-CD1 3.88Å; Q155-L206 HydrophobicContact CG-CD2 3.82Å; Q155-L206 HydrophobicContact CG-CG 4.37Å; I190-L206 HydrophobicContact CD1-CD2 4.39Å; G202-L206 VanDerWaalsContact O-CG 3.23Å; G202-L206 WeakPolarHBondContact O-CG 3.22Å; G202-L206 PolarHBondContact O-N 3.09Å; I203-L206 HydrophobicContact CD1-CD1 4.28Å; I203-L206 PolarHBondContact O-N 2.94Å; L206-L208 PolarHBondContact O-N 3.49Å; L206-H209 PolarHBondContact O-N 3.34Å; L206-D210 WeakPolarHBondContact O-CB 3.24Å; L206-D210 PolarHBondContact O-N 3.08Å
207	F	98.3	Very high	97.3	Very high	5 Å²	5	11.1 Å²	11.1	2%	0.022	6%	0.057	C	C	.	.	H	α-helix	trans	-60	-45.1	178	172.5	-101.8	0	0	0	112.8	W113 A117 L120 F121 F128 I203 L204 H209 F254	W113-F207 AromaticContact CD1-CD2 3.94Å; W113-F207 VanDerWaalsContact CD1-O 3.25Å; W113-F207 AromaticContact CE2-CD2 3.97Å; W113-F207 AromaticContact CE2-CE2 3.54Å; W113-F207 HydrophobicContact CZ2-CD2 4.43Å; W113-F207 AromaticContact CZ2-CE2 3.56Å; W113-F207 HydrophobicContact CZ2-CE2 3.56Å; W113-F207 HydrophobicContact CZ2-CZ 4.1Å; W113-F207 AromaticContact NE1-CD2 3.3Å; W113-F207 VanDerWaalsContact NE1-CD2 3.3Å; W113-F207 AromaticContact NE1-CE2 3.27Å; W113-F207 VanDerWaalsContact NE1-CE2 3.27Å; W113-F207 PolarHBondContact NE1-O 2.8Å; A117-F207 HydrophobicContact CB-CD2 4.09Å; A117-F207 HydrophobicContact CB-CE2 3.78Å; L120-F207 HydrophobicContact CD1-CB 3.56Å; L120-F207 HydrophobicContact CD1-CD1 3.5Å; L120-F207 VanDerWaalsContact CD1-CD1 3.5Å; L120-F207 HydrophobicContact CD1-CD2 3.86Å; L120-F207 HydrophobicContact CD1-CE1 4.15Å; L120-F207 HydrophobicContact CD1-CE2 4.45Å; L120-F207 HydrophobicContact CD1-CG 3.33Å; F121-F207 HydrophobicContact CE2-CE1 4.32Å; F121-F207 AromaticContact CE2-CE2 3.85Å; F121-F207 HydrophobicContact CE2-CE2 3.85Å; F121-F207 AromaticContact CE2-CZ 3.6Å; F121-F207 HydrophobicContact CE2-CZ 3.6Å; F121-F207 HydrophobicContact CZ-CE1 4.43Å; F121-F207 HydrophobicContact CZ-CZ 4.07Å; F128-F207 HydrophobicContact CD2-CD1 4.46Å; F128-F207 HydrophobicContact CD2-CE1 4.36Å; F128-F207 HydrophobicContact CE2-CD1 4.08Å; F128-F207 AromaticContact CE2-CE1 3.67Å; F128-F207 HydrophobicContact CE2-CE1 3.67Å; F128-F207 HydrophobicContact CZ-CE1 4.28Å; I203-F207 WeakPolarHBondContact O-CB 3.33Å; I203-F207 PolarHBondContact O-N 3.43Å; L204-F207 PolarHBondContact O-N 2.9Å; F207-H209 VanDerWaalsContact C-N 3.34Å; F207-H209 PolarHBondContact O-N 3.09Å; F207-F254 HydrophobicContact CE1-CD1 4.32Å; F207-F254 AromaticContact CE1-CE1 3.9Å; F207-F254 HydrophobicContact CE1-CE1 3.9Å; F207-F254 HydrophobicContact CZ-CE1 4.09Å
208	L	98.2	Very high	97.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-71.4	-28.7	-176.6	-66.6	174.8	0	0	0	112.6	L204 V205 L206 F254 W258 F259 V263	L204-L208 WeakPolarHBondContact O-CB 3.5Å; L204-L208 WeakPolarHBondContact O-CG 3.38Å; L204-L208 PolarHBondContact O-N 3.22Å; V205-L208 PolarHBondContact O-N 2.97Å; L206-L208 PolarHBondContact O-N 3.49Å; L208-F254 HydrophobicContact CD2-CB 4.43Å; L208-F254 HydrophobicContact CD2-CD1 3.78Å; L208-F254 WeakPolarHBondContact O-CB 3.42Å; L208-W258 HydrophobicContact CD1-CB 4.47Å; L208-W258 HydrophobicContact CD2-CB 3.81Å; L208-W258 HydrophobicContact CD2-CD2 4.46Å; L208-W258 HydrophobicContact CD2-CE3 3.76Å; L208-F259 HydrophobicContact CD1-CB 4.01Å; L208-V263 HydrophobicContact CD1-CG2 3.78Å
209	H	97.9	Very high	97.4	Very high	7 Å²	7	14 Å²	14	3%	0.032	7%	0.072	C	C	.	.	H	α-helix	trans	-88.4	-44.9	-177.9	-71.3	75.6	0	0	0	112.4	V205 L206 F207 I211 S212 R255 F259 N295	V205-H209 PolarHBondContact O-N 3.34Å; V205-H209 PolarHBondContact O-ND1 2.85Å; L206-H209 PolarHBondContact O-N 3.34Å; F207-H209 VanDerWaalsContact C-N 3.34Å; F207-H209 PolarHBondContact O-N 3.09Å; H209-I211 VanDerWaalsContact C-N 3.33Å; H209-I211 PolarHBondContact O-N 3.45Å; H209-S212 PolarHBondContact O-N 2.82Å; H209-R255 PolarHBondContact O-NE 3.42Å; H209-R255 PolarHBondContact O-NH2 3.37Å; H209-F259 AromaticContact CE1-CD2 3.58Å; H209-F259 AromaticContact CE1-CE2 3.75Å; H209-F259 AromaticContact CE1-CG 3.77Å; H209-N295 PolarHBondContact NE2-ND2 2.91Å
210	D	97.5	Very high	97.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-65.8	-29.7	-167.7	-77.5	16.3	0	0	0	114.1	Y109 S112 W113 Q155 L206 S212 D213 V214	Y109-D210 HydrophobicContact CD1-CB 4.45Å; S112-D210 PolarHBondContact OG-OD2 2.84Å; W113-D210 HydrophobicContact CB-CB 3.94Å; W113-D210 HydrophobicContact CG-CB 4.39Å; Q155-D210 PolarHBondContact NE2-OD2 2.86Å; L206-D210 WeakPolarHBondContact O-CB 3.24Å; L206-D210 PolarHBondContact O-N 3.08Å; D210-S212 VanDerWaalsContact C-N 3.26Å; D210-S212 PolarHBondContact O-N 3.41Å; D210-D213 PolarHBondContact O-N 3.22Å; D210-V214 PolarHBondContact O-N 2.85Å
211	I	97.6	Very high	97.3	Very high	17 Å²	17	14.7 Å²	14.7	9%	0.087	8%	0.075	C	C	.	.	H	α-helix	trans	-57.8	-38.3	-177.6	-173.5	53.5	0	0	0	113	W113 H209 D213 V214 Q215 F254	W113-I211 HydrophobicContact CD2-CB 4.43Å; W113-I211 HydrophobicContact CD2-CD1 3.91Å; W113-I211 HydrophobicContact CE3-CD1 4.17Å; W113-I211 HydrophobicContact CG-CB 4.38Å; W113-I211 HydrophobicContact CH2-CD1 4.01Å; W113-I211 HydrophobicContact CZ2-CB 4.42Å; W113-I211 HydrophobicContact CZ2-CD1 3.74Å; W113-I211 HydrophobicContact CZ2-CG1 4.16Å; W113-I211 HydrophobicContact CZ3-CD1 4.22Å; H209-I211 VanDerWaalsContact C-N 3.33Å; H209-I211 PolarHBondContact O-N 3.45Å; I211-D213 VanDerWaalsContact C-N 3.29Å; I211-D213 PolarHBondContact O-N 2.66Å; I211-V214 PolarHBondContact O-N 2.64Å; I211-Q215 WeakPolarHBondContact O-CG 3.35Å; I211-Q215 PolarHBondContact O-N 2.68Å; I211-F254 HydrophobicContact CG2-CB 4.09Å; I211-F254 HydrophobicContact CG2-CD1 3.81Å; I211-F254 HydrophobicContact CG2-CD2 3.84Å; I211-F254 HydrophobicContact CG2-CE1 4.14Å; I211-F254 HydrophobicContact CG2-CE2 4.18Å; I211-F254 HydrophobicContact CG2-CG 3.65Å; I211-F254 HydrophobicContact CG2-CZ 4.33Å
212	S	97.1	Very high	97.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-68.3	-32.8	178.5	-60.5	0	0	0	0	111.3	H209 D210 Q215 L216 F247 S250 W251	H209-S212 PolarHBondContact O-N 2.82Å; D210-S212 VanDerWaalsContact C-N 3.26Å; D210-S212 PolarHBondContact O-N 3.41Å; S212-Q215 PolarHBondContact O-N 3.2Å; S212-L216 WeakPolarHBondContact O-CB 3.4Å; S212-L216 PolarHBondContact O-N 3.1Å; S212-F247 VanDerWaalsContact O-CD2 3.26Å; S212-F247 WeakPolarHBondContact O-CD2 3.01Å; S212-S250 PolarHBondContact OG-OG 3.06Å; S212-W251 WeakPolarHBondContact OG-CA 3.23Å; S212-W251 PolarHBondContact OG-N 2.86Å
213	D	96.6	Very high	97.2	Very high	21 Å²	21	16.4 Å²	16.4	11%	0.112	8%	0.081	C	C	.	.	H	α-helix	trans	-74.3	-35	178.3	-64.6	-43.8	0	0	0	111.7	Y109 D210 I211 Q215 L216 E217 R255	Y109-D213 HydrophobicContact CD1-CB 4.29Å; Y109-D213 HydrophobicContact CD2-CB 3.57Å; Y109-D213 HydrophobicContact CE1-CB 4.44Å; Y109-D213 HydrophobicContact CE2-CB 3.72Å; Y109-D213 HydrophobicContact CG-CB 3.89Å; D210-D213 PolarHBondContact O-N 3.22Å; I211-D213 VanDerWaalsContact C-N 3.29Å; I211-D213 PolarHBondContact O-N 2.66Å; D213-Q215 VanDerWaalsContact C-N 3.34Å; D213-Q215 PolarHBondContact O-N 3.27Å; D213-L216 PolarHBondContact O-N 3.17Å; D213-E217 WeakPolarHBondContact O-CG 3.47Å; D213-E217 PolarHBondContact O-N 3.18Å; D213-R255 VanDerWaalsContact CG-NH2 3.34Å; D213-R255 IonicContact OD1-NH2 3.09Å; D213-R255 PolarHBondContact OD1-NH2 3.45Å; D213-R255 IonicContact OD2-NH2 3.69Å; D213-R255 PolarHBondContact OD2-NH2 2.98Å
214	V	97.9	Very high	96.9	Very high	13 Å²	13	17 Å²	17	8%	0.079	8%	0.084	C	C	.	.	H	α-helix	trans	-55.4	-50.8	168.7	178.5	0	0	0	0	110.6	F106 Y109 L110 W113 D210 I211 F218	F106-V214 HydrophobicContact CD2-CG1 4.24Å; F106-V214 HydrophobicContact CE2-CG1 3.82Å; Y109-V214 VanDerWaalsContact C-CG2 3.4Å; Y109-V214 WeakPolarHBondContact O-CG2 3.22Å; L110-V214 HydrophobicContact CB-CG1 4.39Å; L110-V214 HydrophobicContact CB-CG2 4.46Å; L110-V214 HydrophobicContact CD1-CG1 3.97Å; W113-V214 HydrophobicContact CB-CG2 4.26Å; D210-V214 PolarHBondContact O-N 2.85Å; I211-V214 PolarHBondContact O-N 2.64Å; V214-F218 WeakPolarHBondContact O-CB 3.28Å; V214-F218 PolarHBondContact O-N 3.05Å
215	Q	97.6	Very high	96.8	Very high	40 Å²	40	18.1 Å²	18.1	19%	0.187	9%	0.089	C	C	.	.	H	α-helix	trans	-67.6	-38.1	-178.1	-68.4	175.7	-6.5	0	0	112.5	I211 S212 D213 T219 S246 F247 S250	I211-Q215 WeakPolarHBondContact O-CG 3.35Å; I211-Q215 PolarHBondContact O-N 2.68Å; S212-Q215 PolarHBondContact O-N 3.2Å; D213-Q215 VanDerWaalsContact C-N 3.34Å; D213-Q215 PolarHBondContact O-N 3.27Å; Q215-T219 VanDerWaalsContact O-CB 3.32Å; Q215-T219 WeakPolarHBondContact O-CB 3.29Å; Q215-T219 PolarHBondContact O-N 2.89Å; Q215-T219 PolarHBondContact O-OG1 2.84Å; Q215-S246 PolarHBondContact OE1-O 3.16Å; Q215-F247 HydrophobicContact CB-CB 4.17Å; Q215-F247 VanDerWaalsContact OE1-CA 3.23Å; Q215-S250 PolarHBondContact OE1-OG 3.44Å
216	L	96.1	Very high	96.5	Very high	23 Å²	23	18.5 Å²	18.5	12%	0.12	9%	0.089	C	C	.	.	H	α-helix	trans	-61.7	-51	176.7	179.7	60.4	0	0	0	111.5	S212 D213 T219 K220 F247	S212-L216 WeakPolarHBondContact O-CB 3.4Å; S212-L216 PolarHBondContact O-N 3.1Å; D213-L216 PolarHBondContact O-N 3.17Å; L216-T219 WeakPolarHBondContact O-CB 3.38Å; L216-T219 PolarHBondContact O-N 3.3Å; L216-K220 WeakPolarHBondContact O-CG 3.31Å; L216-K220 PolarHBondContact O-N 3.46Å; L216-F247 HydrophobicContact CB-CD2 3.79Å; L216-F247 HydrophobicContact CB-CE2 3.69Å; L216-F247 HydrophobicContact CB-CZ 4.36Å; L216-F247 HydrophobicContact CD1-CD1 4.39Å; L216-F247 HydrophobicContact CD1-CD2 4.44Å; L216-F247 HydrophobicContact CD1-CE1 4.06Å; L216-F247 HydrophobicContact CD1-CE2 4.11Å; L216-F247 HydrophobicContact CD1-CZ 3.92Å; L216-F247 HydrophobicContact CD2-CE2 4.24Å; L216-F247 HydrophobicContact CD2-CZ 4.3Å; L216-F247 HydrophobicContact CG-CE2 4.22Å; L216-F247 HydrophobicContact CG-CZ 4.42Å
217	E	97.3	Very high	96	Very high	8 Å²	8	19.7 Å²	19.7	4%	0.037	10%	0.098	C	C	.	.	H	α-helix	trans	-72.7	-34.1	-177.1	-61.8	-56	146.4	0	0	111.6	S102 K105 F106 D213 T219 K220 L221	S102-E217 WeakPolarHBondContact CA-OE2 3.38Å; S102-E217 WeakPolarHBondContact CB-OE2 3.18Å; S102-E217 PolarHBondContact OG-OE2 3.38Å; K105-E217 HydrophobicContact CB-CG 3.79Å; F106-E217 HydrophobicContact CB-CB 3.77Å; D213-E217 WeakPolarHBondContact O-CG 3.47Å; D213-E217 PolarHBondContact O-N 3.18Å; E217-T219 VanDerWaalsContact C-N 3.35Å; E217-T219 PolarHBondContact O-N 3.27Å; E217-K220 PolarHBondContact O-N 2.98Å; E217-K220 IonicContact OE1-NZ 3.45Å; E217-K220 PolarHBondContact OE1-NZ 3.43Å; E217-K220 WeakPolarHBondContact OE2-CD 3.44Å; E217-K220 IonicContact OE2-NZ 2.79Å; E217-L221 VanDerWaalsContact O-CG 3.25Å; E217-L221 WeakPolarHBondContact O-CG 3.04Å; E217-L221 PolarHBondContact O-N 3.28Å
218	F	97.1	Very high	95.6	Very high	86 Å²	86	23 Å²	23	38%	0.377	11%	0.11	S	C	.	.	H	α-helix	trans	-58.3	-46.6	169.3	179.5	-101.8	0	0	0	111.8	F106 V214 L221 N222 A239	F106-F218 HydrophobicContact CD2-CB 3.99Å; F106-F218 HydrophobicContact CE2-CB 3.7Å; F106-F218 AromaticContact CE2-CD2 3.99Å; F106-F218 HydrophobicContact CE2-CD2 3.99Å; F106-F218 HydrophobicContact CE2-CG 4.3Å; F106-F218 HydrophobicContact CZ-CD2 4.03Å; V214-F218 WeakPolarHBondContact O-CB 3.28Å; V214-F218 PolarHBondContact O-N 3.05Å; F218-L221 PolarHBondContact O-N 3.41Å; F218-N222 WeakPolarHBondContact CE1-ND2 3.39Å; F218-N222 WeakPolarHBondContact CE2-ND2 3.41Å; F218-N222 WeakPolarHBondContact CZ-ND2 3.45Å; F218-N222 PolarHBondContact O-N 3.31Å; F218-N222 PolarHBondContact O-ND2 3.04Å; F218-A239 HydrophobicContact CE1-CB 4.47Å
219	T	96.5	Very high	94.9	Very high	10 Å²	10	24.9 Å²	24.9	6%	0.061	13%	0.13	C	C	.	.	H	α-helix	trans	-60.1	-48.6	177.8	-60.7	0	0	0	0	111.2	Q215 L216 E217 L221 N222 I223 A240 G243 C244	Q215-T219 VanDerWaalsContact O-CB 3.32Å; Q215-T219 WeakPolarHBondContact O-CB 3.29Å; Q215-T219 PolarHBondContact O-N 2.89Å; Q215-T219 PolarHBondContact O-OG1 2.84Å; L216-T219 WeakPolarHBondContact O-CB 3.38Å; L216-T219 PolarHBondContact O-N 3.3Å; E217-T219 VanDerWaalsContact C-N 3.35Å; E217-T219 PolarHBondContact O-N 3.27Å; T219-L221 VanDerWaalsContact C-N 3.35Å; T219-L221 PolarHBondContact O-N 2.92Å; T219-N222 PolarHBondContact O-N 2.96Å; T219-I223 HydrophobicContact CG2-CD1 4.04Å; T219-I223 WeakPolarHBondContact O-CG1 3.35Å; T219-I223 PolarHBondContact O-N 3.5Å; T219-A240 WeakPolarHBondContact CG2-O 3.27Å; T219-G243 VanDerWaalsContact OG1-CA 3.31Å; T219-G243 WeakPolarHBondContact OG1-CA 3.46Å; T219-G243 PolarHBondContact OG1-O 3.47Å; T219-C244 HydrophobicContact CG2-CB 4.21Å; T219-C244 PolarHBondContact OG1-N 3.22Å
220	K	95.1	Very high	94.3	Very high	17 Å²	17	28.6 Å²	28.6	7%	0.074	17%	0.17	C	C	.	.	H	α-helix	trans	-58.3	-45.1	177.4	-74.7	174	-177.4	170.3	0	112.3	L216 E217 N222 I223 Y224	L216-K220 WeakPolarHBondContact O-CG 3.31Å; L216-K220 PolarHBondContact O-N 3.46Å; E217-K220 PolarHBondContact O-N 2.98Å; E217-K220 IonicContact OE1-NZ 3.45Å; E217-K220 PolarHBondContact OE1-NZ 3.43Å; E217-K220 WeakPolarHBondContact OE2-CD 3.44Å; E217-K220 IonicContact OE2-NZ 2.79Å; K220-N222 PolarHBondContact O-N 2.78Å; K220-I223 WeakPolarHBondContact O-CB 3.46Å; K220-I223 PolarHBondContact O-N 3.35Å; K220-Y224 HydrophobicContact CB-CE2 4.05Å; K220-Y224 WeakPolarHBondContact O-CD1 3.3Å; K220-Y224 VanDerWaalsContact O-CD2 3.27Å; K220-Y224 WeakPolarHBondContact O-CD2 3.38Å; K220-Y224 PolarHBondContact O-N 3.25Å
221	L	96.6	Very high	93.8	Very high	21 Å²	21	32 Å²	32	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-58.6	-48.4	176.2	-70.1	170.4	0	0	0	110.8	M99 A103 F106 E217 F218 T219 I223 Y224 F225	M99-L221 HydrophobicContact CG-CD2 3.79Å; M99-L221 HydrophobicContact SD-CD2 4.07Å; A103-L221 HydrophobicContact CB-CD2 4.06Å; F106-L221 HydrophobicContact CB-CD1 3.9Å; F106-L221 HydrophobicContact CD1-CD1 4.01Å; F106-L221 HydrophobicContact CG-CD1 3.96Å; E217-L221 VanDerWaalsContact O-CG 3.25Å; E217-L221 WeakPolarHBondContact O-CG 3.04Å; E217-L221 PolarHBondContact O-N 3.28Å; F218-L221 PolarHBondContact O-N 3.41Å; T219-L221 VanDerWaalsContact C-N 3.35Å; T219-L221 PolarHBondContact O-N 2.92Å; L221-I223 VanDerWaalsContact C-N 3.28Å; L221-I223 PolarHBondContact O-N 3.06Å; L221-Y224 HydrophobicContact CD2-CD2 4.37Å; L221-Y224 WeakPolarHBondContact O-CB 3.16Å; L221-Y224 PolarHBondContact O-N 3.09Å; L221-F225 HydrophobicContact CD2-CE2 4.49Å; L221-F225 WeakPolarHBondContact O-CD2 3.47Å; L221-F225 PolarHBondContact O-N 2.89Å
222	N	96.7	Very high	93.5	Very high	13 Å²	13	37.9 Å²	37.9	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-36.3	177.4	-78.5	-75.2	0	0	0	112.8	F218 T219 K220 Y224 F225 K226 H236 A239 A240	F218-N222 WeakPolarHBondContact CE1-ND2 3.39Å; F218-N222 WeakPolarHBondContact CE2-ND2 3.41Å; F218-N222 WeakPolarHBondContact CZ-ND2 3.45Å; F218-N222 PolarHBondContact O-N 3.31Å; F218-N222 PolarHBondContact O-ND2 3.04Å; T219-N222 PolarHBondContact O-N 2.96Å; K220-N222 PolarHBondContact O-N 2.78Å; N222-Y224 VanDerWaalsContact C-N 3.34Å; N222-Y224 PolarHBondContact O-N 3.22Å; N222-F225 PolarHBondContact O-N 3.43Å; N222-K226 WeakPolarHBondContact O-CB 3.38Å; N222-K226 PolarHBondContact O-N 3.41Å; N222-H236 PolarHBondContact OD1-ND1 2.8Å; N222-A239 HydrophobicContact CB-CB 4.31Å; N222-A239 WeakPolarHBondContact OD1-CB 3.3Å; N222-A240 HydrophobicContact CB-CB 3.98Å
223	I	94.1	Very high	93.3	Very high	32 Å²	32	40.7 Å²	40.7	16%	0.164	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-43.2	171.6	-68.1	168.6	0	0	0	111	T219 K220 L221 K226 A240 L317	T219-I223 HydrophobicContact CG2-CD1 4.04Å; T219-I223 WeakPolarHBondContact O-CG1 3.35Å; T219-I223 PolarHBondContact O-N 3.5Å; K220-I223 WeakPolarHBondContact O-CB 3.46Å; K220-I223 PolarHBondContact O-N 3.35Å; L221-I223 VanDerWaalsContact C-N 3.28Å; L221-I223 PolarHBondContact O-N 3.06Å; I223-K226 WeakPolarHBondContact O-CG 3.43Å; I223-A240 HydrophobicContact CG1-CB 3.69Å; I223-L317 HydrophobicContact CD1-CB 3.83Å; I223-L317 HydrophobicContact CD1-CD1 4.32Å; I223-L317 HydrophobicContact CG1-CB 4.47Å
224	Y	93.7	Very high	93	Very high	12 Å²	12	49.8 Å²	49.8	5%	0.047	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-36.6	178.1	-56	-25.3	0	0	0	112.2	L91 D95 K98 M99 K220 L221 N222	L91-Y224 WeakPolarHBondContact CD2-O 3.15Å; D95-Y224 HydrophobicContact CB-CD1 3.9Å; D95-Y224 HydrophobicContact CB-CG 4.08Å; K98-Y224 HydrophobicContact CB-CE1 4.37Å; K98-Y224 HydrophobicContact CB-CE2 4.1Å; K98-Y224 HydrophobicContact CD-CE1 4.44Å; M99-Y224 HydrophobicContact CB-CD2 3.9Å; M99-Y224 HydrophobicContact CG-CD2 4.14Å; K220-Y224 HydrophobicContact CB-CE2 4.05Å; K220-Y224 WeakPolarHBondContact O-CD1 3.3Å; K220-Y224 VanDerWaalsContact O-CD2 3.27Å; K220-Y224 WeakPolarHBondContact O-CD2 3.38Å; K220-Y224 PolarHBondContact O-N 3.25Å; L221-Y224 HydrophobicContact CD2-CD2 4.37Å; L221-Y224 WeakPolarHBondContact O-CB 3.16Å; L221-Y224 PolarHBondContact O-N 3.09Å; N222-Y224 VanDerWaalsContact C-N 3.34Å; N222-Y224 PolarHBondContact O-N 3.22Å
225	F	93.8	Very high	92.8	Very high	25 Å²	25	56.1 Å²	56.1	11%	0.11	29%	0.294	C	S	.	.	H	α-helix	trans	-86.2	-12.1	-177.5	-76.9	-81	0	0	0	114.4	C89 L91 M99 L221 N222 S227	C89-F225 HydrophobicContact CB-CD1 4.43Å; C89-F225 HydrophobicContact CB-CE1 3.9Å; L91-F225 HydrophobicContact CD1-CE1 4.21Å; L91-F225 HydrophobicContact CD1-CZ 4.15Å; L91-F225 HydrophobicContact CD2-CD1 3.81Å; L91-F225 HydrophobicContact CD2-CE1 4Å; L91-F225 HydrophobicContact CD2-CG 4.36Å; L91-F225 HydrophobicContact CG-CE1 4.44Å; M99-F225 HydrophobicContact CE-CZ 4.42Å; M99-F225 HydrophobicContact CG-CE2 4Å; M99-F225 HydrophobicContact CG-CZ 4.36Å; M99-F225 HydrophobicContact SD-CE2 4.44Å; L221-F225 HydrophobicContact CD2-CE2 4.49Å; L221-F225 WeakPolarHBondContact O-CD2 3.47Å; L221-F225 PolarHBondContact O-N 2.89Å; N222-F225 PolarHBondContact O-N 3.43Å; F225-S227 VanDerWaalsContact C-N 3.29Å; F225-S227 PolarHBondContact O-N 3.02Å
226	K	92	Very high	92.6	Very high	28 Å²	28	56.6 Å²	56.6	12%	0.122	30%	0.296	C	S	.	.	S	Bend	trans	-65.9	-28.7	179.7	84.5	-171.4	174.4	173.4	0	113.4	N222 I223 Y232 H233 H236 A237	N222-K226 WeakPolarHBondContact O-CB 3.38Å; N222-K226 PolarHBondContact O-N 3.41Å; I223-K226 WeakPolarHBondContact O-CG 3.43Å; K226-Y232 HydrophobicContact CD-CE2 4.26Å; K226-Y232 HydrophobicContact CG-CE2 4.05Å; K226-Y232 CarbonylContact O-C 3.46Å; K226-Y232 WeakPolarHBondContact O-CA 3.5Å; K226-H233 PolarHBondContact O-N 2.89Å; K226-H236 HydrophobicContact CB-CB 3.97Å; K226-A237 HydrophobicContact CB-CB 4.38Å
227	S	87.8	Confident	92.4	Very high	35 Å²	35	55.9 Å²	55.9	25%	0.245	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	91.9	176.6	-170.9	0	0	0	0	109.4	Q92 F225	Q92-S227 PolarHBondContact NE2-OG 3.45Å; F225-S227 VanDerWaalsContact C-N 3.29Å; F225-S227 PolarHBondContact O-N 3.02Å
228	R	89.8	Confident	92.2	Very high	75 Å²	75	60.1 Å²	60.1	28%	0.283	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.5	-174.9	73.1	176.4	-178.4	164.4	-2.6	111.6	C89 L91 G230 S231 H233	C89-R228 WeakPolarHBondContact O-CB 3.3Å; L91-R228 HydrophobicContact CD2-CB 3.7Å; R228-G230 PolarHBondContact O-N 2.84Å; R228-S231 PolarHBondContact N-O 3.34Å; R228-S231 VanDerWaalsContact N-O 3.13Å; R228-S231 PolarHBondContact O-N 3.14Å; R228-S231 VanDerWaalsContact O-N 3.14Å; R228-S231 VanDerWaalsContact O-O 3.1Å; R228-H233 VanDerWaalsContact CG-CD2 3.44Å; R228-H233 WeakPolarHBondContact CG-CD2 3.35Å; R228-H233 VanDerWaalsContact CG-NE2 3.28Å; R228-H233 WeakPolarHBondContact CG-NE2 3.42Å; R228-H233 PolarHBondContact O-NE2 3.35Å
229	G	84.8	Confident	92.2	Very high	39 Å²	39	57.2 Å²	57.2	40%	0.402	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	23.8	179.2	0	0	0	0	0	114.9	R90 S231	R90-G229 PolarHBondContact O-N 2.92Å; G229-S231 VanDerWaalsContact C-N 3.26Å; G229-S231 PolarHBondContact O-N 3.44Å
230	G	84	Confident	92.1	Very high	85 Å²	85	56.8 Å²	56.8	88%	0.876	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	6.5	-176.3	0	0	0	0	0	114.4	R228	R228-G230 PolarHBondContact O-N 2.84Å
231	S	88.5	Confident	91.9	Very high	73 Å²	73	60 Å²	60	51%	0.51	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.7	178	-55.6	0	0	0	0	111.8	R228 G229 H233	R228-S231 PolarHBondContact N-O 3.34Å; R228-S231 VanDerWaalsContact N-O 3.13Å; R228-S231 PolarHBondContact O-N 3.14Å; R228-S231 VanDerWaalsContact O-N 3.14Å; R228-S231 VanDerWaalsContact O-O 3.1Å; G229-S231 VanDerWaalsContact C-N 3.26Å; G229-S231 PolarHBondContact O-N 3.44Å; S231-H233 PolarHBondContact O-CD2 3.45Å; S231-H233 VanDerWaalsContact O-CD2 3.27Å
232	Y	90	Very high	91.8	Very high	140 Å²	140	63.8 Å²	63.8	55%	0.549	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.4	176.6	-169.6	-98.7	0	0	0	111.1	K226 R234 A237	K226-Y232 HydrophobicContact CD-CE2 4.26Å; K226-Y232 HydrophobicContact CG-CE2 4.05Å; K226-Y232 CarbonylContact O-C 3.46Å; K226-Y232 WeakPolarHBondContact O-CA 3.5Å; Y232-R234 HydrophobicContact CD1-CG 4.26Å; Y232-R234 HydrophobicContact CE1-CG 4.39Å; Y232-A237 HydrophobicContact CE1-CB 3.94Å; Y232-A237 WeakPolarHBondContact OH-CB 3.37Å
233	H	92.4	Very high	91.8	Very high	59 Å²	59	63.4 Å²	63.4	27%	0.273	34%	0.342	S	S	.	.			trans	-101.7	100.6	-176.2	-64.7	-101.2	0	0	0	109.8	K226 R228 S231 L235 H236 A237	K226-H233 PolarHBondContact O-N 2.89Å; R228-H233 VanDerWaalsContact CG-CD2 3.44Å; R228-H233 WeakPolarHBondContact CG-CD2 3.35Å; R228-H233 VanDerWaalsContact CG-NE2 3.28Å; R228-H233 WeakPolarHBondContact CG-NE2 3.42Å; R228-H233 PolarHBondContact O-NE2 3.35Å; S231-H233 PolarHBondContact O-CD2 3.45Å; S231-H233 VanDerWaalsContact O-CD2 3.27Å; H233-L235 VanDerWaalsContact C-N 3.3Å; H233-L235 PolarHBondContact O-N 3Å; H233-H236 HydrophobicContact CB-CB 4.42Å; H233-H236 PolarHBondContact O-N 3.42Å; H233-A237 PolarHBondContact O-N 2.58Å
234	R	91.5	Very high	91.7	Very high	211 Å²	211	63.2 Å²	63.2	80%	0.796	34%	0.343	S	S	*	.	H	α-helix	trans	-59.8	-34.5	-175.4	-66.5	-175.4	180	-177.5	-0	114	Y232 A237 L238	Y232-R234 HydrophobicContact CD1-CG 4.26Å; Y232-R234 HydrophobicContact CE1-CG 4.39Å; R234-A237 WeakPolarHBondContact O-CB 3.46Å; R234-A237 PolarHBondContact O-N 3.3Å; R234-L238 PolarHBondContact O-N 2.93Å
235	L	93.6	Very high	91.8	Very high	146 Å²	146	68.8 Å²	68.8	76%	0.764	37%	0.374	S	S	*	.	H	α-helix	trans	-62.7	-44	178.2	-68.2	176.3	0	0	0	112	H233 A237 L238 A239	H233-L235 VanDerWaalsContact C-N 3.3Å; H233-L235 PolarHBondContact O-N 3Å; L235-A237 VanDerWaalsContact C-N 3.33Å; L235-L238 PolarHBondContact O-N 2.51Å; L235-A239 WeakPolarHBondContact O-CB 3.17Å; L235-A239 PolarHBondContact O-N 3.42Å
236	H	93.6	Very high	91.9	Very high	50 Å²	50	69.7 Å²	69.7	23%	0.231	38%	0.383	C	S	.	.	H	α-helix	trans	-68.1	-33.9	176	-76.6	-58.4	0	0	0	112	N222 K226 H233 A240	N222-H236 PolarHBondContact OD1-ND1 2.8Å; K226-H236 HydrophobicContact CB-CB 3.97Å; H233-H236 HydrophobicContact CB-CB 4.42Å; H233-H236 PolarHBondContact O-N 3.42Å; H236-A240 WeakPolarHBondContact O-CB 3.31Å; H236-A240 PolarHBondContact O-N 2.9Å
237	A	91.9	Very high	92.1	Very high	9 Å²	9	69.5 Å²	69.5	7%	0.074	38%	0.382	C	S	.	.	H	α-helix	trans	-62.7	-50.3	172.5	0	0	0	0	0	111.5	K226 Y232 H233 R234 L235 A239 A240 D241	K226-A237 HydrophobicContact CB-CB 4.38Å; Y232-A237 HydrophobicContact CE1-CB 3.94Å; Y232-A237 WeakPolarHBondContact OH-CB 3.37Å; H233-A237 PolarHBondContact O-N 2.58Å; R234-A237 WeakPolarHBondContact O-CB 3.46Å; R234-A237 PolarHBondContact O-N 3.3Å; L235-A237 VanDerWaalsContact C-N 3.33Å; A237-A239 VanDerWaalsContact C-N 3.34Å; A237-A239 PolarHBondContact O-N 3.49Å; A237-A240 WeakPolarHBondContact O-CB 3.42Å; A237-A240 PolarHBondContact O-N 2.9Å; A237-A240 VanDerWaalsContact O-N 3.14Å; A237-D241 PolarHBondContact O-N 3.37Å
238	L	93.6	Very high	92.5	Very high	97 Å²	97	68.6 Å²	68.6	51%	0.508	38%	0.378	S	S	.	.	H	α-helix	trans	-60.1	-43.4	176.9	179.1	63.6	0	0	0	111.9	R234 L235 A240 D241 L242	R234-L238 PolarHBondContact O-N 2.93Å; L235-L238 PolarHBondContact O-N 2.51Å; L238-A240 VanDerWaalsContact C-N 3.29Å; L238-A240 PolarHBondContact O-N 2.9Å; L238-D241 PolarHBondContact O-N 3.33Å; L238-L242 HydrophobicContact CD1-CD1 4.22Å; L238-L242 HydrophobicContact CD1-CG 4.21Å; L238-L242 HydrophobicContact CG-CD1 4.1Å; L238-L242 HydrophobicContact CG-CG 4.47Å; L238-L242 WeakPolarHBondContact O-CB 3.41Å; L238-L242 WeakPolarHBondContact O-CG 3.33Å; L238-L242 PolarHBondContact O-N 3.05Å
239	A	95.9	Very high	92.9	Very high	24 Å²	24	71 Å²	71	20%	0.198	39%	0.391	C	S	.	.	H	α-helix	trans	-63	-35.7	176.8	0	0	0	0	0	112.4	F218 N222 L235 A237 G243	F218-A239 HydrophobicContact CE1-CB 4.47Å; N222-A239 HydrophobicContact CB-CB 4.31Å; N222-A239 WeakPolarHBondContact OD1-CB 3.3Å; L235-A239 WeakPolarHBondContact O-CB 3.17Å; L235-A239 PolarHBondContact O-N 3.42Å; A237-A239 VanDerWaalsContact C-N 3.34Å; A237-A239 PolarHBondContact O-N 3.49Å; A239-G243 WeakPolarHBondContact O-CA 3.2Å; A239-G243 PolarHBondContact O-N 3.45Å
240	A	94.3	Very high	93.5	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.008	37%	0.372	C	S	.	.	H	α-helix	trans	-68.1	-41.7	174	0	0	0	0	0	112.2	T219 N222 I223 H236 A237 L238 G243 C244 L317	T219-A240 WeakPolarHBondContact CG2-O 3.27Å; N222-A240 HydrophobicContact CB-CB 3.98Å; I223-A240 HydrophobicContact CG1-CB 3.69Å; H236-A240 WeakPolarHBondContact O-CB 3.31Å; H236-A240 PolarHBondContact O-N 2.9Å; A237-A240 WeakPolarHBondContact O-CB 3.42Å; A237-A240 PolarHBondContact O-N 2.9Å; A237-A240 VanDerWaalsContact O-N 3.14Å; L238-A240 VanDerWaalsContact C-N 3.29Å; L238-A240 PolarHBondContact O-N 2.9Å; A240-G243 PolarHBondContact O-N 3.11Å; A240-C244 VanDerWaalsContact O-CB 3.32Å; A240-C244 WeakPolarHBondContact O-CB 3.21Å; A240-C244 PolarHBondContact O-N 2.89Å; A240-L317 HydrophobicContact CB-CD1 4.28Å
241	D	91.9	Very high	94.1	Very high	84 Å²	84	65.7 Å²	65.7	45%	0.449	33%	0.333	S	S	.	.	H	α-helix	trans	-64.7	-49.1	178	-65.2	-25	0	0	0	110.9	A237 L238 G243 C244 L245 L317	A237-D241 PolarHBondContact O-N 3.37Å; L238-D241 PolarHBondContact O-N 3.33Å; D241-G243 PolarHBondContact O-N 2.88Å; D241-C244 WeakPolarHBondContact O-CB 3.22Å; D241-C244 PolarHBondContact O-N 3.38Å; D241-L245 WeakPolarHBondContact O-CG 3.44Å; D241-L245 PolarHBondContact O-N 3.48Å; D241-L245 VanDerWaalsContact O-N 3.15Å; D241-L317 WeakPolarHBondContact OD1-CD1 3.29Å
242	L	94.9	Very high	94.6	Very high	102 Å²	102	66.6 Å²	66.6	53%	0.534	33%	0.327	S	S	.	.	H	α-helix	trans	-63.1	-40.8	175.9	-67.3	177.3	0	0	0	112.2	L238 C244 L245 S246	L238-L242 HydrophobicContact CD1-CD1 4.22Å; L238-L242 HydrophobicContact CD1-CG 4.21Å; L238-L242 HydrophobicContact CG-CD1 4.1Å; L238-L242 HydrophobicContact CG-CG 4.47Å; L238-L242 WeakPolarHBondContact O-CB 3.41Å; L238-L242 WeakPolarHBondContact O-CG 3.33Å; L238-L242 PolarHBondContact O-N 3.05Å; L242-C244 VanDerWaalsContact C-N 3.31Å; L242-C244 PolarHBondContact O-N 2.99Å; L242-L245 PolarHBondContact O-N 3.08Å; L242-S246 WeakPolarHBondContact O-CB 3.47Å; L242-S246 PolarHBondContact O-N 2.78Å
243	G	94.8	Very high	95	Very high	4 Å²	4	63.9 Å²	63.9	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-64.6	-35.2	176.7	0	0	0	0	0	112.6	T219 A239 A240 D241 S246 F247	T219-G243 VanDerWaalsContact OG1-CA 3.31Å; T219-G243 WeakPolarHBondContact OG1-CA 3.46Å; T219-G243 PolarHBondContact OG1-O 3.47Å; A239-G243 WeakPolarHBondContact O-CA 3.2Å; A239-G243 PolarHBondContact O-N 3.45Å; A240-G243 PolarHBondContact O-N 3.11Å; D241-G243 PolarHBondContact O-N 2.88Å; G243-S246 PolarHBondContact O-N 3.26Å; G243-S246 PolarHBondContact O-OG 3.13Å; G243-S246 VanDerWaalsContact O-OG 3.13Å; G243-F247 WeakPolarHBondContact O-CB 3.25Å; G243-F247 PolarHBondContact O-N 2.9Å
244	C	93.8	Very high	95.2	Very high	28 Å²	28	62.4 Å²	62.4	19%	0.189	31%	0.309	C	S	.	.	H	α-helix	trans	-67.3	-42.7	176.2	-172	0	0	0	0	111.7	T219 A240 D241 L242 G248 F305 L317	T219-C244 HydrophobicContact CG2-CB 4.21Å; T219-C244 PolarHBondContact OG1-N 3.22Å; A240-C244 VanDerWaalsContact O-CB 3.32Å; A240-C244 WeakPolarHBondContact O-CB 3.21Å; A240-C244 PolarHBondContact O-N 2.89Å; D241-C244 WeakPolarHBondContact O-CB 3.22Å; D241-C244 PolarHBondContact O-N 3.38Å; L242-C244 VanDerWaalsContact C-N 3.31Å; L242-C244 PolarHBondContact O-N 2.99Å; C244-G248 PolarHBondContact O-N 3.33Å; C244-F305 VanDerWaalsContact SG-CE1 3.56Å; C244-L317 HydrophobicContact CB-CD1 4.47Å
245	L	94.6	Very high	95.6	Very high	130 Å²	130	52.6 Å²	52.6	68%	0.681	27%	0.272	S	S	*	.	H	α-helix	trans	-65.1	-45.4	175.5	-65.2	175.2	0	0	0	111.2	D241 L242 F247 G248 F249	D241-L245 WeakPolarHBondContact O-CG 3.44Å; D241-L245 PolarHBondContact O-N 3.48Å; D241-L245 VanDerWaalsContact O-N 3.15Å; L242-L245 PolarHBondContact O-N 3.08Å; L245-F247 VanDerWaalsContact C-N 3.34Å; L245-F247 PolarHBondContact O-N 3.44Å; L245-G248 PolarHBondContact O-N 3.32Å; L245-F249 PolarHBondContact O-N 3.28Å; L245-F249 VanDerWaalsContact O-N 3.08Å
246	S	96.1	Very high	95.7	Very high	43 Å²	43	46.2 Å²	46.2	30%	0.301	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-39.7	179.2	81.2	0	0	0	0	111.8	Q215 L242 G243 G248 F249 S250	Q215-S246 PolarHBondContact OE1-O 3.16Å; L242-S246 WeakPolarHBondContact O-CB 3.47Å; L242-S246 PolarHBondContact O-N 2.78Å; G243-S246 PolarHBondContact O-N 3.26Å; G243-S246 PolarHBondContact O-OG 3.13Å; G243-S246 VanDerWaalsContact O-OG 3.13Å; S246-G248 PolarHBondContact O-N 3.03Å; S246-F249 PolarHBondContact O-N 3.29Å; S246-S250 WeakPolarHBondContact O-CB 3.3Å; S246-S250 PolarHBondContact O-N 3.37Å; S246-S250 PolarHBondContact O-OG 2.97Å
247	F	96.8	Very high	95.9	Very high	25 Å²	25	47.5 Å²	47.5	11%	0.11	24%	0.242	C	C	.	.	H	α-helix	trans	-57	-48.9	174.6	168.6	-112.1	0	0	0	112.3	S212 Q215 L216 G243 L245 F249 S250 W251 I302	S212-F247 VanDerWaalsContact O-CD2 3.26Å; S212-F247 WeakPolarHBondContact O-CD2 3.01Å; Q215-F247 HydrophobicContact CB-CB 4.17Å; Q215-F247 VanDerWaalsContact OE1-CA 3.23Å; L216-F247 HydrophobicContact CB-CD2 3.79Å; L216-F247 HydrophobicContact CB-CE2 3.69Å; L216-F247 HydrophobicContact CB-CZ 4.36Å; L216-F247 HydrophobicContact CD1-CD1 4.39Å; L216-F247 HydrophobicContact CD1-CD2 4.44Å; L216-F247 HydrophobicContact CD1-CE1 4.06Å; L216-F247 HydrophobicContact CD1-CE2 4.11Å; L216-F247 HydrophobicContact CD1-CZ 3.92Å; L216-F247 HydrophobicContact CD2-CE2 4.24Å; L216-F247 HydrophobicContact CD2-CZ 4.3Å; L216-F247 HydrophobicContact CG-CE2 4.22Å; L216-F247 HydrophobicContact CG-CZ 4.42Å; G243-F247 WeakPolarHBondContact O-CB 3.25Å; G243-F247 PolarHBondContact O-N 2.9Å; L245-F247 VanDerWaalsContact C-N 3.34Å; L245-F247 PolarHBondContact O-N 3.44Å; F247-F249 PolarHBondContact O-N 3.36Å; F247-S250 PolarHBondContact O-N 2.97Å; F247-S250 PolarHBondContact O-OG 3.1Å; F247-S250 VanDerWaalsContact O-OG 3.11Å; F247-W251 AromaticContact CE2-CE3 3.5Å; F247-W251 HydrophobicContact CE2-CE3 3.5Å; F247-W251 VanDerWaalsContact CE2-CE3 3.5Å; F247-W251 AromaticContact CE2-CZ3 3.9Å; F247-W251 HydrophobicContact CE2-CZ3 3.9Å; F247-W251 AromaticContact CZ-CE3 3.62Å; F247-W251 HydrophobicContact CZ-CE3 3.62Å; F247-W251 AromaticContact CZ-CZ3 3.93Å; F247-W251 HydrophobicContact CZ-CZ3 3.93Å; F247-W251 WeakPolarHBondContact O-CB 3.41Å; F247-W251 PolarHBondContact O-N 3.13Å; F247-I302 HydrophobicContact CD1-CD1 4.43Å; F247-I302 HydrophobicContact CE1-CD1 3.58Å; F247-I302 HydrophobicContact CE1-CG1 3.76Å; F247-I302 HydrophobicContact CZ-CD1 3.64Å; F247-I302 HydrophobicContact CZ-CG1 4.18Å
248	G	96.3	Very high	96.2	Very high	16 Å²	16	49.6 Å²	49.6	17%	0.165	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-42.5	178.4	0	0	0	0	0	112.4	C244 L245 S246 F252	C244-G248 PolarHBondContact O-N 3.33Å; L245-G248 PolarHBondContact O-N 3.32Å; S246-G248 PolarHBondContact O-N 3.03Å; G248-F252 PolarHBondContact O-N 2.93Å
249	F	97	Very high	96.4	Very high	126 Å²	126	45 Å²	45	55%	0.553	22%	0.224	S	C	*	.	H	α-helix	trans	-64.1	-47.1	176.6	175.4	-99	0	0	0	112.2	L245 S246 F247 W251 F252 W253	L245-F249 PolarHBondContact O-N 3.28Å; L245-F249 VanDerWaalsContact O-N 3.08Å; S246-F249 PolarHBondContact O-N 3.29Å; F247-F249 PolarHBondContact O-N 3.36Å; F249-W251 VanDerWaalsContact C-N 3.32Å; F249-W251 PolarHBondContact O-N 2.73Å; F249-F252 PolarHBondContact O-N 2.96Å; F249-W253 HydrophobicContact CE1-CB 4.32Å; F249-W253 HydrophobicContact CE1-CG 4.5Å; F249-W253 HydrophobicContact CE2-CE3 4.4Å; F249-W253 HydrophobicContact CZ-CB 4.31Å; F249-W253 HydrophobicContact CZ-CD2 4.26Å; F249-W253 HydrophobicContact CZ-CE3 4.22Å; F249-W253 HydrophobicContact CZ-CG 4.31Å; F249-W253 WeakPolarHBondContact O-CB 3.36Å; F249-W253 PolarHBondContact O-N 3.2Å
250	S	97.4	Very high	96.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-38	-179.4	73.7	0	0	0	0	111.8	S212 Q215 S246 F247 F252 W253 F254	S212-S250 PolarHBondContact OG-OG 3.06Å; Q215-S250 PolarHBondContact OE1-OG 3.44Å; S246-S250 WeakPolarHBondContact O-CB 3.3Å; S246-S250 PolarHBondContact O-N 3.37Å; S246-S250 PolarHBondContact O-OG 2.97Å; F247-S250 PolarHBondContact O-N 2.97Å; F247-S250 PolarHBondContact O-OG 3.1Å; F247-S250 VanDerWaalsContact O-OG 3.11Å; S250-F252 VanDerWaalsContact C-N 3.34Å; S250-F252 PolarHBondContact O-N 3.17Å; S250-W253 PolarHBondContact O-N 2.9Å; S250-F254 WeakPolarHBondContact O-CB 3.28Å; S250-F254 WeakPolarHBondContact O-CD2 3.4Å; S250-F254 PolarHBondContact O-N 3.32Å
251	W	98.2	Very high	96.5	Very high	11 Å²	11	44.3 Å²	44.3	4%	0.042	22%	0.217	C	C	.	.	I	π-helix	trans	-58.7	-48.8	176.6	-166	-72.6	0	0	0	111.1	S212 F247 F249 R255 L256 N295 W298 F299 I302	S212-W251 WeakPolarHBondContact OG-CA 3.23Å; S212-W251 PolarHBondContact OG-N 2.86Å; F247-W251 AromaticContact CE2-CE3 3.5Å; F247-W251 HydrophobicContact CE2-CE3 3.5Å; F247-W251 VanDerWaalsContact CE2-CE3 3.5Å; F247-W251 AromaticContact CE2-CZ3 3.9Å; F247-W251 HydrophobicContact CE2-CZ3 3.9Å; F247-W251 AromaticContact CZ-CE3 3.62Å; F247-W251 HydrophobicContact CZ-CE3 3.62Å; F247-W251 AromaticContact CZ-CZ3 3.93Å; F247-W251 HydrophobicContact CZ-CZ3 3.93Å; F247-W251 WeakPolarHBondContact O-CB 3.41Å; F247-W251 PolarHBondContact O-N 3.13Å; F249-W251 VanDerWaalsContact C-N 3.32Å; F249-W251 PolarHBondContact O-N 2.73Å; W251-R255 VanDerWaalsContact O-CB 3.31Å; W251-R255 WeakPolarHBondContact O-CB 3.43Å; W251-R255 PolarHBondContact O-N 2.87Å; W251-R255 VanDerWaalsContact O-N 3.14Å; W251-L256 PolarHBondContact O-N 2.95Å; W251-N295 PolarHBondContact NE1-O 2.94Å; W251-W298 HydrophobicContact CH2-CB 3.74Å; W251-W298 HydrophobicContact CH2-CD2 4.24Å; W251-W298 HydrophobicContact CH2-CE3 4.03Å; W251-W298 HydrophobicContact CH2-CG 4.16Å; W251-W298 HydrophobicContact CZ2-CB 3.37Å; W251-W298 HydrophobicContact CZ2-CD2 4.26Å; W251-W298 AromaticContact CZ2-CE3 3.88Å; W251-W298 HydrophobicContact CZ2-CE3 3.88Å; W251-W298 HydrophobicContact CZ2-CG 4.12Å; W251-F299 AromaticContact CD1-CD2 3.56Å; W251-F299 HydrophobicContact CG-CD2 4.29Å; W251-I302 HydrophobicContact CB-CD1 3.73Å; W251-I302 HydrophobicContact CD2-CD1 3.45Å; W251-I302 VanDerWaalsContact CD2-CD1 3.45Å; W251-I302 HydrophobicContact CE3-CD1 3.77Å; W251-I302 HydrophobicContact CG-CD1 3.42Å; W251-I302 VanDerWaalsContact CG-CD1 3.42Å
252	F	97.9	Very high	96.6	Very high	91 Å²	91	40.9 Å²	40.9	40%	0.399	20%	0.198	S	C	.	.	I	π-helix	trans	-61.1	-53.5	176	175.8	-97.1	0	0	0	111.2	G248 F249 S250 L256 Y257 F299	G248-F252 PolarHBondContact O-N 2.93Å; F249-F252 PolarHBondContact O-N 2.96Å; S250-F252 VanDerWaalsContact C-N 3.34Å; S250-F252 PolarHBondContact O-N 3.17Å; F252-L256 HydrophobicContact CD2-CB 4.38Å; F252-L256 HydrophobicContact CD2-CD1 4.23Å; F252-L256 CarbonylContact O-C 3.47Å; F252-L256 WeakPolarHBondContact O-CA 3.46Å; F252-L256 VanDerWaalsContact O-CB 3.3Å; F252-L256 WeakPolarHBondContact O-CB 3.37Å; F252-L256 PolarHBondContact O-N 3.03Å; F252-Y257 PolarHBondContact O-N 3.16Å; F252-F299 HydrophobicContact CB-CE2 3.95Å; F252-F299 HydrophobicContact CB-CZ 4.27Å; F252-F299 HydrophobicContact CD2-CE2 4.41Å; F252-F299 AromaticContact CD2-CZ 3.93Å; F252-F299 HydrophobicContact CD2-CZ 3.93Å
253	W	98	Very high	96.7	Very high	83 Å²	83	36 Å²	36	31%	0.314	17%	0.173	S	C	.	.	I	π-helix	trans	-67.2	-48.1	-171.1	-168.3	-95.9	0	0	0	113.1	F249 S250 Y257 W258	F249-W253 HydrophobicContact CE1-CB 4.32Å; F249-W253 HydrophobicContact CE1-CG 4.5Å; F249-W253 HydrophobicContact CE2-CE3 4.4Å; F249-W253 HydrophobicContact CZ-CB 4.31Å; F249-W253 HydrophobicContact CZ-CD2 4.26Å; F249-W253 HydrophobicContact CZ-CE3 4.22Å; F249-W253 HydrophobicContact CZ-CG 4.31Å; F249-W253 WeakPolarHBondContact O-CB 3.36Å; F249-W253 PolarHBondContact O-N 3.2Å; S250-W253 PolarHBondContact O-N 2.9Å; W253-Y257 HydrophobicContact CD2-CD1 4.24Å; W253-Y257 HydrophobicContact CE3-CD1 4.22Å; W253-Y257 HydrophobicContact CH2-CD1 4.18Å; W253-Y257 AromaticContact CH2-CE1 3.99Å; W253-Y257 HydrophobicContact CH2-CE1 3.99Å; W253-Y257 HydrophobicContact CZ2-CD1 4.19Å; W253-Y257 HydrophobicContact CZ2-CE1 4.14Å; W253-Y257 HydrophobicContact CZ3-CD1 4.19Å; W253-Y257 HydrophobicContact CZ3-CE1 4.34Å; W253-Y257 WeakPolarHBondContact O-CB 3.16Å; W253-W258 AromaticContact CD1-CD2 3.86Å; W253-W258 AromaticContact CD1-CE2 3.88Å; W253-W258 AromaticContact CE2-CE2 3.86Å; W253-W258 AromaticContact CE2-NE1 3.81Å; W253-W258 HydrophobicContact CZ2-CZ2 4.29Å; W253-W258 AromaticContact CZ2-NE1 3.91Å; W253-W258 AromaticContact NE1-CD2 3.54Å; W253-W258 AromaticContact NE1-CE2 3.07Å; W253-W258 AromaticContact NE1-CE3 3.96Å; W253-W258 AromaticContact NE1-CH2 3.61Å; W253-W258 AromaticContact NE1-CZ2 3.13Å; W253-W258 AromaticContact NE1-CZ3 3.99Å; W253-W258 AromaticContact NE1-NE1 3.47Å; W253-W258 PolarHBondContact O-N 3.35Å
254	F	98.1	Very high	96.8	Very high	29 Å²	29	36.2 Å²	36.2	13%	0.127	17%	0.173	C	C	.	.	I	π-helix	trans	-83.5	-43.4	-174.2	-69.8	-101.1	0	0	0	112.3	F207 L208 I211 S250 W258 F259	F207-F254 HydrophobicContact CE1-CD1 4.32Å; F207-F254 AromaticContact CE1-CE1 3.9Å; F207-F254 HydrophobicContact CE1-CE1 3.9Å; F207-F254 HydrophobicContact CZ-CE1 4.09Å; L208-F254 HydrophobicContact CD2-CB 4.43Å; L208-F254 HydrophobicContact CD2-CD1 3.78Å; L208-F254 WeakPolarHBondContact O-CB 3.42Å; I211-F254 HydrophobicContact CG2-CB 4.09Å; I211-F254 HydrophobicContact CG2-CD1 3.81Å; I211-F254 HydrophobicContact CG2-CD2 3.84Å; I211-F254 HydrophobicContact CG2-CE1 4.14Å; I211-F254 HydrophobicContact CG2-CE2 4.18Å; I211-F254 HydrophobicContact CG2-CG 3.65Å; I211-F254 HydrophobicContact CG2-CZ 4.33Å; S250-F254 WeakPolarHBondContact O-CB 3.28Å; S250-F254 WeakPolarHBondContact O-CD2 3.4Å; S250-F254 PolarHBondContact O-N 3.32Å; F254-W258 AromaticContact CD1-CE3 3.68Å; F254-W258 HydrophobicContact CD1-CE3 3.68Å; F254-W258 AromaticContact CD1-CZ3 3.9Å; F254-W258 HydrophobicContact CD1-CZ3 3.9Å; F254-W258 AromaticContact CE1-CE3 3.71Å; F254-W258 HydrophobicContact CE1-CE3 3.71Å; F254-W258 AromaticContact CE1-CZ3 3.4Å; F254-W258 HydrophobicContact CE1-CZ3 3.4Å; F254-W258 VanDerWaalsContact CE1-CZ3 3.4Å; F254-W258 HydrophobicContact CG-CE3 4.34Å; F254-W258 HydrophobicContact CZ-CE3 4.39Å; F254-W258 AromaticContact CZ-CZ3 3.86Å; F254-W258 HydrophobicContact CZ-CZ3 3.86Å; F254-F259 VanDerWaalsContact O-CB 3.27Å; F254-F259 WeakPolarHBondContact O-CB 3.24Å; F254-F259 PolarHBondContact O-N 3.31Å
255	R	98.2	Very high	96.9	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.015	17%	0.165	C	C	.	.	I	π-helix	trans	-92	-29.9	-173.6	-57.3	-175.7	176.7	-153.5	6	114.1	H209 D213 W251 N295	H209-R255 PolarHBondContact O-NE 3.42Å; H209-R255 PolarHBondContact O-NH2 3.37Å; D213-R255 VanDerWaalsContact CG-NH2 3.34Å; D213-R255 IonicContact OD1-NH2 3.09Å; D213-R255 PolarHBondContact OD1-NH2 3.45Å; D213-R255 IonicContact OD2-NH2 3.69Å; D213-R255 PolarHBondContact OD2-NH2 2.98Å; W251-R255 VanDerWaalsContact O-CB 3.31Å; W251-R255 WeakPolarHBondContact O-CB 3.43Å; W251-R255 PolarHBondContact O-N 2.87Å; W251-R255 VanDerWaalsContact O-N 3.14Å; R255-N295 HydrophobicContact CB-CB 4.42Å; R255-N295 WeakPolarHBondContact CD-OD1 3.37Å; R255-N295 PolarHBondContact NH1-OD1 2.96Å
256	L	97.6	Very high	96.9	Very high	13 Å²	13	29 Å²	29	7%	0.068	13%	0.133	C	C	.	.	I	π-helix	trans	-99.7	-34.7	179.4	-57.3	-175	0	0	0	112.7	Y19 W251 F252 P260 N295 L296 F299	Y19-L256 VanDerWaalsContact OH-C 3.28Å; Y19-L256 PolarHBondContact OH-O 2.53Å; W251-L256 PolarHBondContact O-N 2.95Å; F252-L256 HydrophobicContact CD2-CB 4.38Å; F252-L256 HydrophobicContact CD2-CD1 4.23Å; F252-L256 CarbonylContact O-C 3.47Å; F252-L256 WeakPolarHBondContact O-CA 3.46Å; F252-L256 VanDerWaalsContact O-CB 3.3Å; F252-L256 WeakPolarHBondContact O-CB 3.37Å; F252-L256 PolarHBondContact O-N 3.03Å; L256-P260 WeakPolarHBondContact O-CD 3.35Å; L256-P260 WeakPolarHBondContact O-CG 3.13Å; L256-N295 HydrophobicContact CD2-CB 4.25Å; L256-L296 HydrophobicContact CD1-CD2 4.34Å; L256-L296 HydrophobicContact CD2-CD2 3.75Å; L256-L296 HydrophobicContact CD2-CG 4.21Å; L256-F299 HydrophobicContact CD1-CB 3.9Å; L256-F299 HydrophobicContact CD1-CD1 3.44Å; L256-F299 VanDerWaalsContact CD1-CD1 3.44Å; L256-F299 HydrophobicContact CD1-CD2 3.85Å; L256-F299 HydrophobicContact CD1-CE1 3.83Å; L256-F299 HydrophobicContact CD1-CE2 4.21Å; L256-F299 HydrophobicContact CD1-CG 3.44Å; L256-F299 VanDerWaalsContact CD1-CG 3.44Å; L256-F299 HydrophobicContact CD1-CZ 4.2Å
257	Y	96.8	Very high	96.9	Very high	77 Å²	77	27 Å²	27	30%	0.302	12%	0.119	S	C	.	.	I	π-helix	trans	-93.8	-66.9	-179.9	-174.3	-111.1	0	0	0	113.2	Y19 F252 W253 L261	Y19-Y257 HydrophobicContact CE2-CD2 4.17Å; Y19-Y257 WeakPolarHBondContact OH-CA 3.25Å; F252-Y257 PolarHBondContact O-N 3.16Å; W253-Y257 HydrophobicContact CD2-CD1 4.24Å; W253-Y257 HydrophobicContact CE3-CD1 4.22Å; W253-Y257 HydrophobicContact CH2-CD1 4.18Å; W253-Y257 AromaticContact CH2-CE1 3.99Å; W253-Y257 HydrophobicContact CH2-CE1 3.99Å; W253-Y257 HydrophobicContact CZ2-CD1 4.19Å; W253-Y257 HydrophobicContact CZ2-CE1 4.14Å; W253-Y257 HydrophobicContact CZ3-CD1 4.19Å; W253-Y257 HydrophobicContact CZ3-CE1 4.34Å; W253-Y257 WeakPolarHBondContact O-CB 3.16Å; Y257-L261 HydrophobicContact CD2-CD1 3.69Å; Y257-L261 HydrophobicContact CE1-CD1 4.47Å; Y257-L261 HydrophobicContact CE2-CD1 3.36Å; Y257-L261 HydrophobicContact CG-CD1 4.37Å; Y257-L261 WeakPolarHBondContact O-CB 3.35Å; Y257-L261 VanDerWaalsContact O-CG 3.28Å; Y257-L261 WeakPolarHBondContact O-CG 3.26Å; Y257-L261 PolarHBondContact O-N 3.11Å
258	W	97.4	Very high	96.8	Very high	52 Å²	52	26.4 Å²	26.4	20%	0.197	12%	0.118	C	C	.	.	I	π-helix	trans	-67.1	-40.6	-176.5	-80.2	-4.8	0	0	0	114	F128 L208 W253 F254 L261 K262	F128-W258 HydrophobicContact CE2-CE3 4.34Å; F128-W258 HydrophobicContact CE2-CZ3 4.26Å; F128-W258 HydrophobicContact CZ-CE3 4.12Å; F128-W258 AromaticContact CZ-CH2 3.95Å; F128-W258 HydrophobicContact CZ-CH2 3.95Å; F128-W258 AromaticContact CZ-CZ3 3.71Å; F128-W258 HydrophobicContact CZ-CZ3 3.71Å; L208-W258 HydrophobicContact CD1-CB 4.47Å; L208-W258 HydrophobicContact CD2-CB 3.81Å; L208-W258 HydrophobicContact CD2-CD2 4.46Å; L208-W258 HydrophobicContact CD2-CE3 3.76Å; W253-W258 AromaticContact CD1-CD2 3.86Å; W253-W258 AromaticContact CD1-CE2 3.88Å; W253-W258 AromaticContact CE2-CE2 3.86Å; W253-W258 AromaticContact CE2-NE1 3.81Å; W253-W258 HydrophobicContact CZ2-CZ2 4.29Å; W253-W258 AromaticContact CZ2-NE1 3.91Å; W253-W258 AromaticContact NE1-CD2 3.54Å; W253-W258 AromaticContact NE1-CE2 3.07Å; W253-W258 AromaticContact NE1-CE3 3.96Å; W253-W258 AromaticContact NE1-CH2 3.61Å; W253-W258 AromaticContact NE1-CZ2 3.13Å; W253-W258 AromaticContact NE1-CZ3 3.99Å; W253-W258 AromaticContact NE1-NE1 3.47Å; W253-W258 PolarHBondContact O-N 3.35Å; F254-W258 AromaticContact CD1-CE3 3.68Å; F254-W258 HydrophobicContact CD1-CE3 3.68Å; F254-W258 AromaticContact CD1-CZ3 3.9Å; F254-W258 HydrophobicContact CD1-CZ3 3.9Å; F254-W258 AromaticContact CE1-CE3 3.71Å; F254-W258 HydrophobicContact CE1-CE3 3.71Å; F254-W258 AromaticContact CE1-CZ3 3.4Å; F254-W258 HydrophobicContact CE1-CZ3 3.4Å; F254-W258 VanDerWaalsContact CE1-CZ3 3.4Å; F254-W258 HydrophobicContact CG-CE3 4.34Å; F254-W258 HydrophobicContact CZ-CE3 4.39Å; F254-W258 AromaticContact CZ-CZ3 3.86Å; F254-W258 HydrophobicContact CZ-CZ3 3.86Å; W258-L261 PolarHBondContact O-N 3.15Å; W258-K262 HydrophobicContact CB-CD 4.35Å; W258-K262 HydrophobicContact CG-CD 4.42Å; W258-K262 VanDerWaalsContact O-CB 3.23Å; W258-K262 WeakPolarHBondContact O-CB 3.42Å; W258-K262 PolarHBondContact O-N 3.42Å
259	F	97.9	Very high	96.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	11%	0.114	C	C	.	.	I	π-helix	trans	-60.1	-50.9	-179.1	168.6	-112.1	0	0	0	112.8	V205 L208 H209 F254 L261 V263 L264 L288 L291 T292	V205-F259 HydrophobicContact CG2-CE2 3.98Å; L208-F259 HydrophobicContact CD1-CB 4.01Å; H209-F259 AromaticContact CE1-CD2 3.58Å; H209-F259 AromaticContact CE1-CE2 3.75Å; H209-F259 AromaticContact CE1-CG 3.77Å; F254-F259 VanDerWaalsContact O-CB 3.27Å; F254-F259 WeakPolarHBondContact O-CB 3.24Å; F254-F259 PolarHBondContact O-N 3.31Å; F259-L261 PolarHBondContact O-N 3.02Å; F259-V263 HydrophobicContact CD2-CB 3.67Å; F259-V263 HydrophobicContact CD2-CG1 4.16Å; F259-V263 HydrophobicContact CD2-CG2 3.76Å; F259-V263 HydrophobicContact CE2-CB 3.84Å; F259-V263 HydrophobicContact CE2-CG1 3.83Å; F259-V263 HydrophobicContact CE2-CG2 4.28Å; F259-V263 WeakPolarHBondContact O-CA 3.36Å; F259-V263 VanDerWaalsContact O-CB 3.23Å; F259-V263 WeakPolarHBondContact O-CB 3.34Å; F259-V263 PolarHBondContact O-N 3.42Å; F259-L264 HydrophobicContact CE1-CG 4.46Å; F259-L264 HydrophobicContact CZ-CD2 4.4Å; F259-L264 PolarHBondContact O-N 3.04Å; F259-L264 VanDerWaalsContact O-N 3.16Å; F259-L288 HydrophobicContact CE2-CD2 4.26Å; F259-L288 HydrophobicContact CZ-CB 4.46Å; F259-L288 HydrophobicContact CZ-CD2 4.2Å; F259-L291 HydrophobicContact CZ-CD2 4.22Å; F259-T292 WeakPolarHBondContact CE1-OG1 3.17Å
260	P	97.1	Very high	96.3	Very high	7 Å²	7	20.9 Å²	20.9	5%	0.045	9%	0.09	C	C	.	.	I	π-helix	trans	-62.6	-43.8	174.9	-30.3	41.5	0	0	0	113.8	Y19 L22 L256 L264 Y265	Y19-P260 HydrophobicContact CE1-CB 3.96Å; Y19-P260 HydrophobicContact CE1-CG 4.34Å; L22-P260 HydrophobicContact CD2-CB 3.76Å; L256-P260 WeakPolarHBondContact O-CD 3.35Å; L256-P260 WeakPolarHBondContact O-CG 3.13Å; P260-L264 HydrophobicContact CB-CD1 4.01Å; P260-L264 HydrophobicContact CG-CD1 4.28Å; P260-L264 WeakPolarHBondContact O-CB 3.23Å; P260-L264 PolarHBondContact O-N 3.18Å; P260-Y265 PolarHBondContact O-N 3.49Å
261	L	95.6	Very high	96.1	Very high	4 Å²	4	20.9 Å²	20.9	2%	0.021	9%	0.091	C	C	.	.	I	π-helix	trans	-79.1	-27.4	-171.9	-58.1	-176.6	0	0	0	113.7	M16 P17 Y19 L22 Y257 W258 F259 Y265	M16-L261 HydrophobicContact CG-CB 3.88Å; M16-L261 HydrophobicContact CG-CD1 4.38Å; M16-L261 HydrophobicContact SD-CB 3.97Å; M16-L261 HydrophobicContact SD-CD1 4.12Å; P17-L261 WeakPolarHBondContact CD-O 3.19Å; P17-L261 HydrophobicContact CG-CB 4.36Å; P17-L261 HydrophobicContact CG-CD2 4.35Å; P17-L261 WeakPolarHBondContact CG-O 3.43Å; P17-L261 WeakPolarHBondContact O-CD2 3.11Å; Y19-L261 HydrophobicContact CD1-CD2 4.1Å; Y19-L261 HydrophobicContact CD2-CD2 4.47Å; Y19-L261 HydrophobicContact CE1-CD2 4.29Å; Y19-L261 HydrophobicContact CG-CD2 4.21Å; L22-L261 HydrophobicContact CD2-CD2 4.35Å; Y257-L261 HydrophobicContact CD2-CD1 3.69Å; Y257-L261 HydrophobicContact CE1-CD1 4.47Å; Y257-L261 HydrophobicContact CE2-CD1 3.36Å; Y257-L261 HydrophobicContact CG-CD1 4.37Å; Y257-L261 WeakPolarHBondContact O-CB 3.35Å; Y257-L261 VanDerWaalsContact O-CG 3.28Å; Y257-L261 WeakPolarHBondContact O-CG 3.26Å; Y257-L261 PolarHBondContact O-N 3.11Å; W258-L261 PolarHBondContact O-N 3.15Å; F259-L261 PolarHBondContact O-N 3.02Å; L261-Y265 VanDerWaalsContact O-CB 3.28Å; L261-Y265 WeakPolarHBondContact O-CB 3.36Å
262	K	95.3	Very high	95.8	Very high	12 Å²	12	21.8 Å²	21.8	5%	0.052	10%	0.096	C	C	.	.	I	π-helix	trans	-93.5	-53.7	174.8	-64.2	-178	170.9	-76.9	0	111.4	M16 F128 P131 W258 A266	M16-K262 HydrophobicContact CE-CD 4.5Å; M16-K262 HydrophobicContact CE-CG 4.16Å; F128-K262 HydrophobicContact CE2-CD 4.45Å; F128-K262 PolarHBondContact O-NZ 2.87Å; P131-K262 HydrophobicContact CB-CB 4.12Å; P131-K262 HydrophobicContact CG-CB 3.94Å; P131-K262 HydrophobicContact CG-CD 4.37Å; P131-K262 HydrophobicContact CG-CG 3.81Å; W258-K262 HydrophobicContact CB-CD 4.35Å; W258-K262 HydrophobicContact CG-CD 4.42Å; W258-K262 VanDerWaalsContact O-CB 3.23Å; W258-K262 WeakPolarHBondContact O-CB 3.42Å; W258-K262 PolarHBondContact O-N 3.42Å; K262-A266 WeakPolarHBondContact O-CB 3.3Å; K262-A266 PolarHBondContact O-N 2.8Å
263	V	97.2	Very high	95.4	Very high	1 Å²	1	26 Å²	26	1%	0.006	11%	0.109	C	C	.	.	I	π-helix	trans	-85.3	-55.5	-170.6	-174	0	0	0	0	111.9	V201 L204 V205 L208 F259 Y265 A266 T267 L288	V201-V263 HydrophobicContact CG1-CG1 3.73Å; L204-V263 HydrophobicContact CB-CG2 3.88Å; L204-V263 HydrophobicContact CD1-CG2 4.45Å; V205-V263 HydrophobicContact CG2-CG1 3.76Å; V205-V263 HydrophobicContact CG2-CG2 4.38Å; L208-V263 HydrophobicContact CD1-CG2 3.78Å; F259-V263 HydrophobicContact CD2-CB 3.67Å; F259-V263 HydrophobicContact CD2-CG1 4.16Å; F259-V263 HydrophobicContact CD2-CG2 3.76Å; F259-V263 HydrophobicContact CE2-CB 3.84Å; F259-V263 HydrophobicContact CE2-CG1 3.83Å; F259-V263 HydrophobicContact CE2-CG2 4.28Å; F259-V263 WeakPolarHBondContact O-CA 3.36Å; F259-V263 VanDerWaalsContact O-CB 3.23Å; F259-V263 WeakPolarHBondContact O-CB 3.34Å; F259-V263 PolarHBondContact O-N 3.42Å; V263-Y265 VanDerWaalsContact C-N 3.28Å; V263-Y265 PolarHBondContact O-N 3.42Å; V263-A266 PolarHBondContact O-N 3.46Å; V263-T267 HydrophobicContact CG1-CG2 4.34Å; V263-T267 WeakPolarHBondContact O-CB 3.4Å; V263-T267 WeakPolarHBondContact O-CG2 3.38Å; V263-T267 PolarHBondContact O-N 3.14Å; V263-T267 PolarHBondContact O-OG1 3.07Å; V263-L288 HydrophobicContact CG1-CD1 4.25Å
264	L	96.8	Very high	95	Very high	8 Å²	8	24.3 Å²	24.3	4%	0.042	11%	0.113	C	C	.	.	I	π-helix	trans	-64	-37.2	-179	-66.5	179.1	0	0	0	111.4	L22 F259 P260 T267 C268 L288 L289	L22-L264 HydrophobicContact CD1-CB 4.1Å; L22-L264 HydrophobicContact CD2-CB 4.42Å; F259-L264 HydrophobicContact CE1-CG 4.46Å; F259-L264 HydrophobicContact CZ-CD2 4.4Å; F259-L264 PolarHBondContact O-N 3.04Å; F259-L264 VanDerWaalsContact O-N 3.16Å; P260-L264 HydrophobicContact CB-CD1 4.01Å; P260-L264 HydrophobicContact CG-CD1 4.28Å; P260-L264 WeakPolarHBondContact O-CB 3.23Å; P260-L264 PolarHBondContact O-N 3.18Å; L264-T267 WeakPolarHBondContact CA-OG1 3.35Å; L264-T267 PolarHBondContact O-N 3.01Å; L264-T267 PolarHBondContact O-OG1 3.01Å; L264-C268 WeakPolarHBondContact O-CB 3.42Å; L264-C268 PolarHBondContact O-N 3.17Å; L264-C268 PolarHBondContact O-SG 3.48Å; L264-C268 VanDerWaalsContact O-SG 3.33Å; L264-L288 HydrophobicContact CD2-CB 3.65Å; L264-L288 HydrophobicContact CD2-CD1 4.42Å; L264-L289 HydrophobicContact CD1-CD2 4.18Å; L264-L289 HydrophobicContact CD2-CD2 4.35Å
265	Y	95.1	Very high	94.6	Very high	5 Å²	5	24 Å²	24	2%	0.02	11%	0.114	C	C	.	.	H	α-helix	trans	-63.8	-47.9	175.9	-175.5	-111.3	0	0	0	112.5	E14 P17 L22 R25 P260 L261 V263 T267 H269 C270	E14-Y265 PolarHBondContact OE1-OH 3.28Å; E14-Y265 VanDerWaalsContact OE1-OH 3.07Å; P17-Y265 HydrophobicContact CB-CD1 4.38Å; P17-Y265 HydrophobicContact CB-CD2 3.95Å; P17-Y265 HydrophobicContact CB-CE1 4.37Å; P17-Y265 HydrophobicContact CB-CE2 3.94Å; P17-Y265 HydrophobicContact CB-CG 4.18Å; P17-Y265 HydrophobicContact CG-CD1 3.71Å; P17-Y265 HydrophobicContact CG-CD2 3.73Å; P17-Y265 HydrophobicContact CG-CE1 4.14Å; P17-Y265 HydrophobicContact CG-CE2 4.17Å; P17-Y265 HydrophobicContact CG-CG 3.48Å; P17-Y265 VanDerWaalsContact CG-CG 3.48Å; L22-Y265 HydrophobicContact CB-CD2 4.48Å; L22-Y265 VanDerWaalsContact CD1-CA 3.49Å; L22-Y265 HydrophobicContact CD1-CD2 4.12Å; R25-Y265 HydrophobicContact CB-CE2 4.42Å; R25-Y265 PolarHBondContact NH1-OH 3.49Å; P260-Y265 PolarHBondContact O-N 3.49Å; L261-Y265 VanDerWaalsContact O-CB 3.28Å; L261-Y265 WeakPolarHBondContact O-CB 3.36Å; V263-Y265 VanDerWaalsContact C-N 3.28Å; V263-Y265 PolarHBondContact O-N 3.42Å; Y265-T267 VanDerWaalsContact C-N 3.3Å; Y265-T267 PolarHBondContact O-N 3.08Å; Y265-H269 HydrophobicContact CD2-CB 4.21Å; Y265-H269 HydrophobicContact CE2-CB 4.03Å; Y265-H269 AromaticContact CE2-CD2 3.86Å; Y265-H269 AromaticContact CZ-CD2 3.68Å; Y265-H269 WeakPolarHBondContact O-CB 3.23Å; Y265-H269 PolarHBondContact O-N 3.29Å; Y265-H269 PolarHBondContact OH-CD2 3.42Å; Y265-C270 WeakPolarHBondContact CE1-SG 3.5Å; Y265-C270 PolarHBondContact O-N 2.96Å
266	A	94.6	Very high	94	Very high	1 Å²	1	28 Å²	28	1%	0.008	14%	0.14	C	C	.	.	I	π-helix	trans	-59.9	-43.5	177.9	0	0	0	0	0	111.1	V134 F135 K262 V263 C270 S271	V134-A266 HydrophobicContact CG2-CB 4.03Å; F135-A266 WeakPolarHBondContact CE2-O 3.48Å; K262-A266 WeakPolarHBondContact O-CB 3.3Å; K262-A266 PolarHBondContact O-N 2.8Å; V263-A266 PolarHBondContact O-N 3.46Å; A266-C270 CarbonylContact O-C 3.54Å; A266-C270 WeakPolarHBondContact O-CB 3.44Å; A266-C270 PolarHBondContact O-N 2.92Å; A266-S271 PolarHBondContact O-N 3.3Å
267	T	95.5	Very high	93.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	18%	0.176	C	C	.	.	I	π-helix	trans	-79.9	-32.8	-175.2	52	0	0	0	0	114.6	F135 V201 V263 L264 Y265 S271 Y281 F284 N285 L288	F135-T267 HydrophobicContact CE2-CG2 4.22Å; F135-T267 HydrophobicContact CZ-CG2 4.04Å; V201-T267 HydrophobicContact CG1-CG2 3.56Å; V201-T267 HydrophobicContact CG2-CG2 4.15Å; V263-T267 HydrophobicContact CG1-CG2 4.34Å; V263-T267 WeakPolarHBondContact O-CB 3.4Å; V263-T267 WeakPolarHBondContact O-CG2 3.38Å; V263-T267 PolarHBondContact O-N 3.14Å; V263-T267 PolarHBondContact O-OG1 3.07Å; L264-T267 WeakPolarHBondContact CA-OG1 3.35Å; L264-T267 PolarHBondContact O-N 3.01Å; L264-T267 PolarHBondContact O-OG1 3.01Å; Y265-T267 VanDerWaalsContact C-N 3.3Å; Y265-T267 PolarHBondContact O-N 3.08Å; T267-S271 WeakPolarHBondContact O-CB 3.33Å; T267-S271 PolarHBondContact O-OG 2.87Å; T267-Y281 WeakPolarHBondContact O-CE2 3.47Å; T267-F284 HydrophobicContact CG2-CE1 4.3Å; T267-N285 VanDerWaalsContact C-OD1 3.27Å; T267-N285 VanDerWaalsContact CB-OD1 3.24Å; T267-N285 WeakPolarHBondContact CB-OD1 3.36Å; T267-N285 PolarHBondContact O-ND2 2.86Å; T267-N285 VanDerWaalsContact O-ND2 3.07Å; T267-N285 PolarHBondContact O-OD1 3.49Å; T267-N285 PolarHBondContact OG1-OD1 2.93Å; T267-N285 VanDerWaalsContact OG1-OD1 3.11Å; T267-L288 HydrophobicContact CG2-CD1 3.87Å
268	C	94.1	Very high	93	Very high	13 Å²	13	31.6 Å²	31.6	9%	0.088	16%	0.164	C	C	.	.	I	π-helix	trans	-87.6	-26.7	178.5	-68	0	0	0	0	113.6	S29 L264 Y281 N285	S29-C268 VanDerWaalsContact CB-O 3.26Å; S29-C268 WeakPolarHBondContact CB-O 3.28Å; L264-C268 WeakPolarHBondContact O-CB 3.42Å; L264-C268 PolarHBondContact O-N 3.17Å; L264-C268 PolarHBondContact O-SG 3.48Å; L264-C268 VanDerWaalsContact O-SG 3.33Å; C268-Y281 PolarHBondContact O-OH 3.33Å; C268-N285 PolarHBondContact N-OD1 2.82Å; C268-N285 PolarHBondContact SG-OD1 3.39Å
269	H	92.3	Very high	92.7	Very high	16 Å²	16	29.6 Å²	29.6	7%	0.074	16%	0.158	C	C	.	.	I	π-helix	trans	-121.3	-55.8	-174.5	-175.8	60.1	0	0	0	113.2	R25 S29 Y265 S271 R273	R25-H269 HydrophobicContact CB-CB 4.44Å; S29-H269 PolarHBondContact OG-ND1 3.18Å; Y265-H269 HydrophobicContact CD2-CB 4.21Å; Y265-H269 HydrophobicContact CE2-CB 4.03Å; Y265-H269 AromaticContact CE2-CD2 3.86Å; Y265-H269 AromaticContact CZ-CD2 3.68Å; Y265-H269 WeakPolarHBondContact O-CB 3.23Å; Y265-H269 PolarHBondContact O-N 3.29Å; Y265-H269 PolarHBondContact OH-CD2 3.42Å; H269-S271 VanDerWaalsContact C-N 3.33Å; H269-S271 PolarHBondContact O-N 3.42Å; H269-R273 WeakPolarHBondContact NE2-CD 3.18Å
270	C	91.6	Very high	92.3	Very high	9 Å²	9	32 Å²	32	6%	0.061	17%	0.168	C	C	.	.	I	π-helix	trans	-69.6	-31.9	-173.2	-54.5	0	0	0	0	112.3	P132 Y265 A266 L272 R273 A274	P132-C270 HydrophobicContact CB-CB 4.11Å; P132-C270 HydrophobicContact CG-CB 4.47Å; Y265-C270 WeakPolarHBondContact CE1-SG 3.5Å; Y265-C270 PolarHBondContact O-N 2.96Å; A266-C270 CarbonylContact O-C 3.54Å; A266-C270 WeakPolarHBondContact O-CB 3.44Å; A266-C270 PolarHBondContact O-N 2.92Å; C270-L272 PolarHBondContact O-N 3.23Å; C270-R273 WeakPolarHBondContact O-CB 3.05Å; C270-R273 PolarHBondContact O-N 3.47Å; C270-R273 VanDerWaalsContact O-N 3.08Å; C270-A274 PolarHBondContact O-N 3.38Å
271	S	92.8	Very high	92.1	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-53.2	-53.1	178.1	61.3	0	0	0	0	112.3	F135 A266 T267 H269 R273 A274 V275	F135-S271 VanDerWaalsContact CE2-CB 3.49Å; A266-S271 PolarHBondContact O-N 3.3Å; T267-S271 WeakPolarHBondContact O-CB 3.33Å; T267-S271 PolarHBondContact O-OG 2.87Å; H269-S271 VanDerWaalsContact C-N 3.33Å; H269-S271 PolarHBondContact O-N 3.42Å; S271-R273 PolarHBondContact O-N 2.9Å; S271-A274 PolarHBondContact O-N 3.35Å; S271-V275 CarbonylContact O-C 3.56Å; S271-V275 WeakPolarHBondContact O-CA 3.39Å; S271-V275 PolarHBondContact O-N 2.95Å; S271-V275 VanDerWaalsContact O-O 3.11Å
272	L	91.1	Very high	92	Very high	30 Å²	30	36.9 Å²	36.9	16%	0.157	19%	0.189	C	C	.	.	H	α-helix	trans	-70.8	-16.4	180	-68.8	170.9	0	0	0	113.3	A33 C270 P276 I278 Y281	A33-L272 HydrophobicContact CB-CD1 3.94Å; C270-L272 PolarHBondContact O-N 3.23Å; L272-P276 WeakPolarHBondContact CD2-O 3.28Å; L272-P276 WeakPolarHBondContact O-CA 3.27Å; L272-I278 HydrophobicContact CD2-CG2 3.97Å; L272-Y281 HydrophobicContact CD1-CD1 4.41Å; L272-Y281 HydrophobicContact CD1-CD2 4.04Å; L272-Y281 HydrophobicContact CD1-CE1 4.01Å; L272-Y281 HydrophobicContact CD1-CE2 3.56Å; L272-Y281 HydrophobicContact CD1-CG 4.45Å; L272-Y281 HydrophobicContact CD2-CD2 4.05Å; L272-Y281 HydrophobicContact CD2-CE2 4.39Å; L272-Y281 HydrophobicContact CD2-CG 4.26Å; L272-Y281 HydrophobicContact CG-CD2 3.84Å; L272-Y281 HydrophobicContact CG-CE2 3.72Å; L272-Y281 HydrophobicContact CG-CG 4.45Å
273	R	90.3	Very high	91.9	Very high	178 Å²	178	40.5 Å²	40.5	67%	0.672	21%	0.205	S	C	*	.	H	α-helix	trans	-84.5	-39.5	173	-68.8	-174.4	62.2	146.4	3.1	112	H269 C270 S271	H269-R273 WeakPolarHBondContact NE2-CD 3.18Å; C270-R273 WeakPolarHBondContact O-CB 3.05Å; C270-R273 PolarHBondContact O-N 3.47Å; C270-R273 VanDerWaalsContact O-N 3.08Å; S271-R273 PolarHBondContact O-N 2.9Å
274	A	88.7	Confident	91.8	Very high	48 Å²	48	40.8 Å²	40.8	40%	0.397	21%	0.206	S	C	.	.	H	α-helix	trans	-76.5	-39.8	178	0	0	0	0	0	111.3	F135 C270 S271	F135-A274 HydrophobicContact CB-CB 3.95Å; C270-A274 PolarHBondContact O-N 3.38Å; S271-A274 PolarHBondContact O-N 3.35Å
275	V	90.1	Very high	91.8	Very high	23 Å²	23	40.8 Å²	40.8	14%	0.139	21%	0.206	C	C	.	.			trans	-137.9	90.6	-176.2	-172.7	0	0	0	0	108.4	W138 S271 D277 I278	W138-V275 HydrophobicContact CB-CG2 4.18Å; W138-V275 HydrophobicContact CD2-CG2 4.46Å; W138-V275 HydrophobicContact CE3-CB 4.39Å; W138-V275 HydrophobicContact CE3-CG1 3.66Å; W138-V275 HydrophobicContact CE3-CG2 3.92Å; W138-V275 HydrophobicContact CZ3-CG1 3.73Å; S271-V275 CarbonylContact O-C 3.56Å; S271-V275 WeakPolarHBondContact O-CA 3.39Å; S271-V275 PolarHBondContact O-N 2.95Å; S271-V275 VanDerWaalsContact O-O 3.11Å; V275-D277 VanDerWaalsContact C-N 3.29Å; V275-D277 PolarHBondContact O-N 3.11Å; V275-I278 HydrophobicContact CB-CB 3.96Å; V275-I278 HydrophobicContact CB-CD1 4.37Å; V275-I278 HydrophobicContact CB-CG1 4.18Å; V275-I278 HydrophobicContact CG1-CB 3.82Å; V275-I278 HydrophobicContact CG1-CG1 4.07Å; V275-I278 WeakPolarHBondContact O-CB 3.24Å; V275-I278 PolarHBondContact O-N 3.33Å
276	P	85.9	Confident	91.9	Very high	89 Å²	89	43.2 Å²	43.2	58%	0.578	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-38.5	-175.5	-30	37.3	0	0	0	114.9	L272	L272-P276 WeakPolarHBondContact CD2-O 3.28Å; L272-P276 WeakPolarHBondContact O-CA 3.27Å
277	D	84.7	Confident	92	Very high	151 Å²	151	44.2 Å²	44.2	81%	0.807	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	38.4	-178.7	-60	-51.5	0	0	0	112.3	V275	V275-D277 VanDerWaalsContact C-N 3.29Å; V275-D277 PolarHBondContact O-N 3.11Å
278	I	89.3	Confident	92.2	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.067	23%	0.232	C	C	.	.			trans	-61.7	127.8	-176.2	-159.3	176.8	0	0	0	111.6	F135 Y198 L272 V275 Y281	F135-I278 HydrophobicContact CD1-CD1 3.53Å; F135-I278 HydrophobicContact CE1-CD1 3.34Å; F135-I278 HydrophobicContact CG-CD1 4.42Å; F135-I278 HydrophobicContact CZ-CD1 4.12Å; Y198-I278 HydrophobicContact CE1-CD1 3.7Å; Y198-I278 HydrophobicContact CE1-CG1 3.91Å; Y198-I278 VanDerWaalsContact OH-CG1 3.28Å; Y198-I278 WeakPolarHBondContact OH-CG1 3.44Å; L272-I278 HydrophobicContact CD2-CG2 3.97Å; V275-I278 HydrophobicContact CB-CB 3.96Å; V275-I278 HydrophobicContact CB-CD1 4.37Å; V275-I278 HydrophobicContact CB-CG1 4.18Å; V275-I278 HydrophobicContact CG1-CB 3.82Å; V275-I278 HydrophobicContact CG1-CG1 4.07Å; V275-I278 WeakPolarHBondContact O-CB 3.24Å; V275-I278 PolarHBondContact O-N 3.33Å; I278-Y281 HydrophobicContact CG2-CD2 4.05Å; I278-Y281 HydrophobicContact CG2-CG 4.37Å
279	P	89.7	Confident	92.3	Very high	10 Å²	10	47.7 Å²	47.7	7%	0.065	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	144.7	-169.4	26.9	-34.5	0	0	0	112.3	H52 W138 Y198 Y281	H52-P279 HydrophobicContact CB-CB 4.05Å; H52-P279 HydrophobicContact CB-CG 4.08Å; W138-P279 HydrophobicContact CH2-CG 3.53Å; W138-P279 HydrophobicContact CZ2-CG 3.7Å; Y198-P279 VanDerWaalsContact OH-CD 3.3Å; Y198-P279 WeakPolarHBondContact OH-CD 3.35Å; Y198-P279 WeakPolarHBondContact OH-CG 3.47Å; Y198-P279 PolarHBondContact OH-O 2.81Å; P279-Y281 PolarHBondContact O-N 3.3Å
280	F	90.5	Very high	92.6	Very high	50 Å²	50	49.9 Å²	49.9	22%	0.219	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	26.3	176.1	-62.3	-82.8	0	0	0	115.5	A45 L49 F196 F282 F283 F284	A45-F280 WeakPolarHBondContact O-CZ 3.36Å; L49-F280 HydrophobicContact CB-CZ 3.89Å; L49-F280 HydrophobicContact CD1-CE2 4.37Å; L49-F280 HydrophobicContact CD1-CZ 4.02Å; F196-F280 AromaticContact CD1-CD2 3.87Å; F196-F280 HydrophobicContact CD1-CD2 3.87Å; F196-F280 HydrophobicContact CD1-CE2 4.26Å; F196-F280 HydrophobicContact CD2-CB 4.07Å; F196-F280 HydrophobicContact CD2-CD2 4.2Å; F196-F280 HydrophobicContact CD2-CG 4.37Å; F196-F280 AromaticContact CE1-CD2 3.31Å; F196-F280 HydrophobicContact CE1-CD2 3.31Å; F196-F280 AromaticContact CE1-CE2 3.43Å; F196-F280 HydrophobicContact CE1-CE2 3.43Å; F196-F280 VanDerWaalsContact CE1-CE2 3.43Å; F196-F280 HydrophobicContact CE1-CG 4.12Å; F196-F280 HydrophobicContact CE1-CZ 4.32Å; F196-F280 HydrophobicContact CE2-CB 3.64Å; F196-F280 HydrophobicContact CE2-CD1 4.41Å; F196-F280 AromaticContact CE2-CD2 3.67Å; F196-F280 HydrophobicContact CE2-CD2 3.67Å; F196-F280 HydrophobicContact CE2-CE2 4.45Å; F196-F280 AromaticContact CE2-CG 3.65Å; F196-F280 HydrophobicContact CE2-CG 3.65Å; F196-F280 HydrophobicContact CG-CD2 4.3Å; F196-F280 HydrophobicContact CZ-CB 4.06Å; F196-F280 HydrophobicContact CZ-CD1 4.1Å; F196-F280 AromaticContact CZ-CD2 3.19Å; F196-F280 HydrophobicContact CZ-CD2 3.19Å; F196-F280 HydrophobicContact CZ-CE1 4.39Å; F196-F280 AromaticContact CZ-CE2 3.55Å; F196-F280 HydrophobicContact CZ-CE2 3.55Å; F196-F280 AromaticContact CZ-CG 3.51Å; F196-F280 HydrophobicContact CZ-CG 3.51Å; F196-F280 HydrophobicContact CZ-CZ 4.14Å; F280-F282 PolarHBondContact O-N 2.7Å; F280-F283 HydrophobicContact CB-CB 4.28Å; F280-F283 HydrophobicContact CB-CD1 4.37Å; F280-F283 HydrophobicContact CD1-CB 4.45Å; F280-F283 PolarHBondContact O-N 3.38Å; F280-F284 PolarHBondContact O-N 3Å
281	Y	92.3	Very high	92.9	Very high	15 Å²	15	49.5 Å²	49.5	6%	0.059	26%	0.259	C	S	.	.	H	α-helix	trans	-45.7	-53.5	177.8	169.2	-95.7	0	0	0	113.3	A30 T267 C268 L272 I278 P279 N285	A30-Y281 HydrophobicContact CB-CE1 4.4Å; T267-Y281 WeakPolarHBondContact O-CE2 3.47Å; C268-Y281 PolarHBondContact O-OH 3.33Å; L272-Y281 HydrophobicContact CD1-CD1 4.41Å; L272-Y281 HydrophobicContact CD1-CD2 4.04Å; L272-Y281 HydrophobicContact CD1-CE1 4.01Å; L272-Y281 HydrophobicContact CD1-CE2 3.56Å; L272-Y281 HydrophobicContact CD1-CG 4.45Å; L272-Y281 HydrophobicContact CD2-CD2 4.05Å; L272-Y281 HydrophobicContact CD2-CE2 4.39Å; L272-Y281 HydrophobicContact CD2-CG 4.26Å; L272-Y281 HydrophobicContact CG-CD2 3.84Å; L272-Y281 HydrophobicContact CG-CE2 3.72Å; L272-Y281 HydrophobicContact CG-CG 4.45Å; I278-Y281 HydrophobicContact CG2-CD2 4.05Å; I278-Y281 HydrophobicContact CG2-CG 4.37Å; P279-Y281 PolarHBondContact O-N 3.3Å; Y281-N285 WeakPolarHBondContact CD2-ND2 3.42Å; Y281-N285 WeakPolarHBondContact CE2-ND2 3.46Å; Y281-N285 WeakPolarHBondContact O-CB 3.35Å; Y281-N285 PolarHBondContact O-N 2.92Å; Y281-N285 PolarHBondContact O-ND2 3.47Å
282	F	93.1	Very high	93.1	Very high	99 Å²	99	50.3 Å²	50.3	43%	0.434	26%	0.264	S	S	.	.	H	α-helix	trans	-66.9	-41.5	-176.8	-69.6	-72.3	0	0	0	112.4	A30 A33 A34 F280 A286	A30-F282 HydrophobicContact CB-CE1 4.41Å; A33-F282 HydrophobicContact CB-CE2 4.24Å; A33-F282 HydrophobicContact CB-CZ 3.76Å; A34-F282 HydrophobicContact CB-CE1 4.44Å; A34-F282 HydrophobicContact CB-CZ 4.01Å; F280-F282 PolarHBondContact O-N 2.7Å; F282-A286 WeakPolarHBondContact O-CB 3.35Å; F282-A286 PolarHBondContact O-N 3.32Å
283	F	93.9	Very high	93.5	Very high	88 Å²	88	54.2 Å²	54.2	39%	0.386	28%	0.284	S	S	.	.	H	α-helix	trans	-61.6	-49.7	179.2	167.6	-99.2	0	0	0	110.9	I188 F196 F280 A286 L287	I188-F283 HydrophobicContact CG2-CE1 4.43Å; I188-F283 HydrophobicContact CG2-CZ 3.71Å; F196-F283 HydrophobicContact CE2-CD1 4.33Å; F196-F283 HydrophobicContact CE2-CE1 4.39Å; F280-F283 HydrophobicContact CB-CB 4.28Å; F280-F283 HydrophobicContact CB-CD1 4.37Å; F280-F283 HydrophobicContact CD1-CB 4.45Å; F280-F283 PolarHBondContact O-N 3.38Å; F283-A286 PolarHBondContact O-N 2.93Å; F283-L287 HydrophobicContact CD1-CD1 4.32Å; F283-L287 HydrophobicContact CE1-CD1 3.71Å; F283-L287 HydrophobicContact CE2-CD1 3.99Å; F283-L287 HydrophobicContact CZ-CD1 3.54Å; F283-L287 WeakPolarHBondContact O-CG 3.38Å; F283-L287 PolarHBondContact O-N 3.39Å
284	F	95.5	Very high	93.8	Very high	7 Å²	7	46.2 Å²	46.2	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-66.8	-45.2	-177.3	-166.5	-105.7	0	0	0	111.9	L189 Y198 V201 T267 F280 A286 L287 L288	L189-F284 HydrophobicContact CD2-CD2 3.97Å; L189-F284 HydrophobicContact CD2-CE2 3.61Å; L189-F284 HydrophobicContact CD2-CZ 4.09Å; Y198-F284 AromaticContact CD2-CD1 3.94Å; Y198-F284 HydrophobicContact CD2-CD1 3.94Å; Y198-F284 HydrophobicContact CD2-CD2 4.13Å; Y198-F284 HydrophobicContact CD2-CE1 4.09Å; Y198-F284 HydrophobicContact CD2-CE2 4.3Å; Y198-F284 AromaticContact CD2-CG 3.95Å; Y198-F284 HydrophobicContact CD2-CG 3.95Å; Y198-F284 HydrophobicContact CD2-CZ 4.28Å; Y198-F284 HydrophobicContact CE2-CB 4.43Å; Y198-F284 HydrophobicContact CE2-CD1 4.45Å; Y198-F284 HydrophobicContact CE2-CG 4.27Å; V201-F284 HydrophobicContact CG1-CE1 4.04Å; V201-F284 HydrophobicContact CG1-CZ 4.43Å; T267-F284 HydrophobicContact CG2-CE1 4.3Å; F280-F284 PolarHBondContact O-N 3Å; F284-A286 PolarHBondContact O-N 3.48Å; F284-L287 PolarHBondContact O-N 2.93Å; F284-L288 HydrophobicContact CD1-CD1 3.92Å; F284-L288 HydrophobicContact CD1-CG 4.42Å; F284-L288 HydrophobicContact CE1-CD1 3.66Å; F284-L288 HydrophobicContact CE1-CG 4.2Å; F284-L288 HydrophobicContact CZ-CD1 4.46Å; F284-L288 PolarHBondContact O-N 3.16Å; F284-L288 VanDerWaalsContact O-N 3.09Å
285	N	96.6	Very high	94.2	Very high	9 Å²	9	44 Å²	44	5%	0.048	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-35.1	177.2	-78.1	-67.4	0	0	0	112.8	T267 C268 Y281 L287 L288 L289	T267-N285 VanDerWaalsContact C-OD1 3.27Å; T267-N285 VanDerWaalsContact CB-OD1 3.24Å; T267-N285 WeakPolarHBondContact CB-OD1 3.36Å; T267-N285 PolarHBondContact O-ND2 2.86Å; T267-N285 VanDerWaalsContact O-ND2 3.07Å; T267-N285 PolarHBondContact O-OD1 3.49Å; T267-N285 PolarHBondContact OG1-OD1 2.93Å; T267-N285 VanDerWaalsContact OG1-OD1 3.11Å; C268-N285 PolarHBondContact N-OD1 2.82Å; C268-N285 PolarHBondContact SG-OD1 3.39Å; Y281-N285 WeakPolarHBondContact CD2-ND2 3.42Å; Y281-N285 WeakPolarHBondContact CE2-ND2 3.46Å; Y281-N285 WeakPolarHBondContact O-CB 3.35Å; Y281-N285 PolarHBondContact O-N 2.92Å; Y281-N285 PolarHBondContact O-ND2 3.47Å; N285-L287 VanDerWaalsContact C-N 3.33Å; N285-L287 PolarHBondContact O-N 2.85Å; N285-L288 PolarHBondContact O-N 2.94Å; N285-L289 WeakPolarHBondContact O-CB 3.35Å; N285-L289 VanDerWaalsContact O-CG 3.29Å; N285-L289 WeakPolarHBondContact O-CG 3.43Å; N285-L289 PolarHBondContact O-N 3.3Å
286	A	97.1	Very high	94.6	Very high	56 Å²	56	46.7 Å²	46.7	46%	0.463	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-41	174.9	0	0	0	0	0	112	F282 F283 F284 L289 L290	F282-A286 WeakPolarHBondContact O-CB 3.35Å; F282-A286 PolarHBondContact O-N 3.32Å; F283-A286 PolarHBondContact O-N 2.93Å; F284-A286 PolarHBondContact O-N 3.48Å; A286-L289 PolarHBondContact O-N 3.44Å; A286-L290 WeakPolarHBondContact O-CB 3.27Å; A286-L290 PolarHBondContact O-N 2.89Å
287	L	97.9	Very high	95.1	Very high	22 Å²	22	46 Å²	46	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-40.1	175.6	-67.1	174.7	0	0	0	112.3	V185 I188 L189 F283 F284 N285 L290 L291	V185-L287 HydrophobicContact CG1-CD2 4.29Å; I188-L287 HydrophobicContact CB-CD1 4.47Å; I188-L287 HydrophobicContact CG2-CD1 3.59Å; L189-L287 HydrophobicContact CD1-CB 4.27Å; L189-L287 HydrophobicContact CD2-CB 3.53Å; L189-L287 HydrophobicContact CD2-CD1 4.13Å; L189-L287 HydrophobicContact CG-CB 3.81Å; L189-L287 HydrophobicContact CG-CD1 4.24Å; F283-L287 HydrophobicContact CD1-CD1 4.32Å; F283-L287 HydrophobicContact CE1-CD1 3.71Å; F283-L287 HydrophobicContact CE2-CD1 3.99Å; F283-L287 HydrophobicContact CZ-CD1 3.54Å; F283-L287 WeakPolarHBondContact O-CG 3.38Å; F283-L287 PolarHBondContact O-N 3.39Å; F284-L287 PolarHBondContact O-N 2.93Å; N285-L287 VanDerWaalsContact C-N 3.33Å; N285-L287 PolarHBondContact O-N 2.85Å; L287-L290 PolarHBondContact O-N 3.46Å; L287-L291 PolarHBondContact O-N 3.04Å
288	L	98.1	Very high	95.7	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-40	175.1	-68.5	177.7	0	0	0	112.2	L189 V205 F259 V263 L264 T267 F284 N285 L291 T292	L189-L288 HydrophobicContact CD1-CD2 4.2Å; L189-L288 HydrophobicContact CD2-CD2 3.83Å; L189-L288 HydrophobicContact CD2-CG 4.07Å; V205-L288 HydrophobicContact CG2-CD2 4.17Å; F259-L288 HydrophobicContact CE2-CD2 4.26Å; F259-L288 HydrophobicContact CZ-CB 4.46Å; F259-L288 HydrophobicContact CZ-CD2 4.2Å; V263-L288 HydrophobicContact CG1-CD1 4.25Å; L264-L288 HydrophobicContact CD2-CB 3.65Å; L264-L288 HydrophobicContact CD2-CD1 4.42Å; T267-L288 HydrophobicContact CG2-CD1 3.87Å; F284-L288 HydrophobicContact CD1-CD1 3.92Å; F284-L288 HydrophobicContact CD1-CG 4.42Å; F284-L288 HydrophobicContact CE1-CD1 3.66Å; F284-L288 HydrophobicContact CE1-CG 4.2Å; F284-L288 HydrophobicContact CZ-CD1 4.46Å; F284-L288 PolarHBondContact O-N 3.16Å; F284-L288 VanDerWaalsContact O-N 3.09Å; N285-L288 PolarHBondContact O-N 2.94Å; L288-L291 WeakPolarHBondContact O-CB 3.21Å; L288-L291 PolarHBondContact O-N 2.82Å; L288-T292 PolarHBondContact O-N 3.5Å; L288-T292 PolarHBondContact O-OG1 2.81Å
289	L	97.6	Very high	96	Very high	85 Å²	85	40.9 Å²	40.9	45%	0.445	21%	0.205	S	C	.	.	H	α-helix	trans	-65.4	-40.7	174.2	-72.1	171.1	0	0	0	111.6	L264 N285 A286 L291 T292 L293	L264-L289 HydrophobicContact CD1-CD2 4.18Å; L264-L289 HydrophobicContact CD2-CD2 4.35Å; N285-L289 WeakPolarHBondContact O-CB 3.35Å; N285-L289 VanDerWaalsContact O-CG 3.29Å; N285-L289 WeakPolarHBondContact O-CG 3.43Å; N285-L289 PolarHBondContact O-N 3.3Å; A286-L289 PolarHBondContact O-N 3.44Å; L289-L291 VanDerWaalsContact C-N 3.29Å; L289-L291 PolarHBondContact O-N 3.47Å; L289-T292 WeakPolarHBondContact O-CA 3.46Å; L289-T292 VanDerWaalsContact O-CB 3.29Å; L289-T292 WeakPolarHBondContact O-CB 3.43Å; L289-T292 PolarHBondContact O-N 3.28Å; L289-T292 VanDerWaalsContact O-N 3.11Å; L289-L293 WeakPolarHBondContact O-CG 3.39Å; L289-L293 PolarHBondContact O-N 2.85Å
290	L	98	Very high	96.2	Very high	62 Å²	62	46 Å²	46	33%	0.325	23%	0.232	S	C	.	.	H	α-helix	trans	-59.8	-41.7	173.1	178.8	59.2	0	0	0	111.1	V185 A286 L287 T292 L293 M294	V185-L290 HydrophobicContact CG1-CD2 4.36Å; V185-L290 HydrophobicContact CG2-CD2 3.61Å; V185-L290 HydrophobicContact CG2-CG 4.46Å; A286-L290 WeakPolarHBondContact O-CB 3.27Å; A286-L290 PolarHBondContact O-N 2.89Å; L287-L290 PolarHBondContact O-N 3.46Å; L290-T292 VanDerWaalsContact C-N 3.34Å; L290-T292 PolarHBondContact O-N 3.29Å; L290-L293 PolarHBondContact O-N 3.46Å; L290-M294 HydrophobicContact CD1-CE 4.1Å; L290-M294 HydrophobicContact CD2-CE 4.29Å; L290-M294 HydrophobicContact CG-CE 3.92Å; L290-M294 WeakPolarHBondContact O-CG 3.42Å; L290-M294 PolarHBondContact O-N 3.3Å; L290-M294 VanDerWaalsContact O-N 3.07Å
291	L	98	Very high	96.3	Very high	2 Å²	2	47 Å²	47	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-40.4	173	-176.1	62.4	0	0	0	111.7	T186 L189 V205 F259 L287 L288 L289 L293 M294 N295	T186-L291 HydrophobicContact CG2-CD1 4.19Å; L189-L291 HydrophobicContact CD1-CD2 4.09Å; V205-L291 HydrophobicContact CG1-CD2 4.12Å; F259-L291 HydrophobicContact CZ-CD2 4.22Å; L287-L291 PolarHBondContact O-N 3.04Å; L288-L291 WeakPolarHBondContact O-CB 3.21Å; L288-L291 PolarHBondContact O-N 2.82Å; L289-L291 VanDerWaalsContact C-N 3.29Å; L289-L291 PolarHBondContact O-N 3.47Å; L291-L293 PolarHBondContact O-N 3.14Å; L291-M294 PolarHBondContact O-N 3.48Å; L291-N295 PolarHBondContact O-N 2.97Å; L291-N295 PolarHBondContact O-ND2 2.88Å
292	T	97.8	Very high	96.4	Very high	19 Å²	19	47.5 Å²	47.5	12%	0.117	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-43.9	172.8	-49.1	0	0	0	0	112.3	F259 L288 L289 L290 M294 N295 L296	F259-T292 WeakPolarHBondContact CE1-OG1 3.17Å; L288-T292 PolarHBondContact O-N 3.5Å; L288-T292 PolarHBondContact O-OG1 2.81Å; L289-T292 WeakPolarHBondContact O-CA 3.46Å; L289-T292 VanDerWaalsContact O-CB 3.29Å; L289-T292 WeakPolarHBondContact O-CB 3.43Å; L289-T292 PolarHBondContact O-N 3.28Å; L289-T292 VanDerWaalsContact O-N 3.11Å; L290-T292 VanDerWaalsContact C-N 3.34Å; L290-T292 PolarHBondContact O-N 3.29Å; T292-M294 VanDerWaalsContact C-N 3.33Å; T292-M294 PolarHBondContact O-N 2.82Å; T292-N295 WeakPolarHBondContact O-CB 3.42Å; T292-N295 PolarHBondContact O-N 2.89Å; T292-L296 WeakPolarHBondContact O-CG 3.45Å; T292-L296 PolarHBondContact O-N 3.25Å
293	L	97.8	Very high	96.4	Very high	112 Å²	112	46.1 Å²	46.1	59%	0.586	24%	0.238	S	C	*	.	H	α-helix	trans	-62.2	-41.3	178.5	-67.4	176.8	0	0	0	111.6	L289 L290 L291 L296 Y297	L289-L293 WeakPolarHBondContact O-CG 3.39Å; L289-L293 PolarHBondContact O-N 2.85Å; L290-L293 PolarHBondContact O-N 3.46Å; L291-L293 PolarHBondContact O-N 3.14Å; L293-L296 PolarHBondContact O-N 2.86Å; L293-Y297 PolarHBondContact O-N 3.29Å
294	M	97.2	Very high	96.3	Very high	10 Å²	10	44 Å²	44	5%	0.049	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-42.2	173.8	-63.9	172.9	178.2	0	0	111.6	V178 L181 H182 V185 L290 L291 T292 L296 Y297 W298	V178-M294 HydrophobicContact CG1-CG 4.43Å; L181-M294 HydrophobicContact CB-CE 4.22Å; L181-M294 HydrophobicContact CD2-CE 3.57Å; L181-M294 HydrophobicContact CG-CE 3.54Å; H182-M294 HydrophobicContact CB-SD 3.78Å; V185-M294 HydrophobicContact CG2-CE 4.15Å; L290-M294 HydrophobicContact CD1-CE 4.1Å; L290-M294 HydrophobicContact CD2-CE 4.29Å; L290-M294 HydrophobicContact CG-CE 3.92Å; L290-M294 WeakPolarHBondContact O-CG 3.42Å; L290-M294 PolarHBondContact O-N 3.3Å; L290-M294 VanDerWaalsContact O-N 3.07Å; L291-M294 PolarHBondContact O-N 3.48Å; T292-M294 VanDerWaalsContact C-N 3.33Å; T292-M294 PolarHBondContact O-N 2.82Å; M294-L296 VanDerWaalsContact C-N 3.3Å; M294-L296 PolarHBondContact O-N 3.46Å; M294-Y297 WeakPolarHBondContact O-CB 3.5Å; M294-Y297 PolarHBondContact O-N 3.14Å; M294-Y297 VanDerWaalsContact O-N 3.15Å; M294-W298 VanDerWaalsContact C-CE3 3.44Å; M294-W298 HydrophobicContact CB-CE3 4.04Å; M294-W298 HydrophobicContact CB-CH2 3.93Å; M294-W298 HydrophobicContact CB-CZ3 3.48Å; M294-W298 VanDerWaalsContact CB-CZ3 3.48Å; M294-W298 PolarHBondContact O-N 2.96Å; M294-W298 HydrophobicContact SD-CH2 4.49Å
295	N	97.6	Very high	96	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-38.1	176.3	-74.5	-33.7	0	0	0	112.7	H209 W251 R255 L256 L291 T292 F299	H209-N295 PolarHBondContact NE2-ND2 2.91Å; W251-N295 PolarHBondContact NE1-O 2.94Å; R255-N295 HydrophobicContact CB-CB 4.42Å; R255-N295 WeakPolarHBondContact CD-OD1 3.37Å; R255-N295 PolarHBondContact NH1-OD1 2.96Å; L256-N295 HydrophobicContact CD2-CB 4.25Å; L291-N295 PolarHBondContact O-N 2.97Å; L291-N295 PolarHBondContact O-ND2 2.88Å; T292-N295 WeakPolarHBondContact O-CB 3.42Å; T292-N295 PolarHBondContact O-N 2.89Å; N295-F299 WeakPolarHBondContact O-CB 3.17Å; N295-F299 PolarHBondContact O-N 3.33Å
296	L	97.4	Very high	95.7	Very high	80 Å²	80	46.9 Å²	46.9	42%	0.419	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-45.9	172.4	-71.9	170.4	0	0	0	111.3	L256 T292 L293 M294 W298 F299 L300	L256-L296 HydrophobicContact CD1-CD2 4.34Å; L256-L296 HydrophobicContact CD2-CD2 3.75Å; L256-L296 HydrophobicContact CD2-CG 4.21Å; T292-L296 WeakPolarHBondContact O-CG 3.45Å; T292-L296 PolarHBondContact O-N 3.25Å; L293-L296 PolarHBondContact O-N 2.86Å; M294-L296 VanDerWaalsContact C-N 3.3Å; M294-L296 PolarHBondContact O-N 3.46Å; L296-W298 PolarHBondContact O-N 3.05Å; L296-F299 PolarHBondContact O-N 3.08Å; L296-F299 VanDerWaalsContact O-N 3.13Å; L296-L300 WeakPolarHBondContact O-CG 3.28Å; L296-L300 PolarHBondContact O-N 2.98Å
297	Y	96.5	Very high	95.3	Very high	75 Å²	75	46.5 Å²	46.5	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-53	-50.3	177	167.8	-93.5	0	0	0	112	D175 V178 L293 M294 L300 Y301	D175-Y297 HydrophobicContact CB-CE1 4.32Å; V178-Y297 HydrophobicContact CB-CE1 4.31Å; V178-Y297 HydrophobicContact CG1-CD1 4.14Å; V178-Y297 HydrophobicContact CG1-CE1 4.14Å; V178-Y297 HydrophobicContact CG2-CE1 4.11Å; L293-Y297 PolarHBondContact O-N 3.29Å; M294-Y297 WeakPolarHBondContact O-CB 3.5Å; M294-Y297 PolarHBondContact O-N 3.14Å; M294-Y297 VanDerWaalsContact O-N 3.15Å; Y297-L300 WeakPolarHBondContact O-CB 3.45Å; Y297-L300 PolarHBondContact O-N 3.27Å; Y297-Y301 HydrophobicContact CD1-CE2 4.39Å; Y297-Y301 HydrophobicContact CD2-CE2 4.5Å; Y297-Y301 HydrophobicContact CE1-CD2 4.26Å; Y297-Y301 AromaticContact CE1-CE2 3.72Å; Y297-Y301 HydrophobicContact CE1-CE2 3.72Å; Y297-Y301 AromaticContact CE2-CE2 3.87Å; Y297-Y301 HydrophobicContact CE2-CE2 3.87Å; Y297-Y301 AromaticContact CZ-CE2 3.43Å; Y297-Y301 VanDerWaalsContact CZ-CE2 3.43Å; Y297-Y301 WeakPolarHBondContact O-CD2 2.98Å; Y297-Y301 WeakPolarHBondContact OH-CE2 3.49Å; Y297-Y301 PolarHBondContact OH-OH 3.32Å
298	W	96.9	Very high	94.7	Very high	10 Å²	10	49.4 Å²	49.4	4%	0.038	27%	0.265	C	S	.	.	H	α-helix	trans	-71.8	-32	177.6	-69.8	-61.2	0	0	0	113.3	D175 V178 M179 H182 W251 M294 L296 L300 Y301 I302	D175-W298 PolarHBondContact OD2-NE1 3.22Å; V178-W298 HydrophobicContact CB-CZ2 4.43Å; V178-W298 HydrophobicContact CG1-CH2 4.27Å; V178-W298 HydrophobicContact CG1-CZ2 3.72Å; M179-W298 HydrophobicContact CG-CZ2 4.2Å; M179-W298 HydrophobicContact SD-CH2 4.08Å; M179-W298 HydrophobicContact SD-CZ2 3.39Å; M179-W298 WeakPolarHBondContact SD-CZ2 3.37Å; H182-W298 HydrophobicContact CB-CH2 3.68Å; H182-W298 HydrophobicContact CB-CZ2 4.42Å; H182-W298 AromaticContact CG-CH2 3.71Å; H182-W298 AromaticContact ND1-CH2 3.83Å; W251-W298 HydrophobicContact CH2-CB 3.74Å; W251-W298 HydrophobicContact CH2-CD2 4.24Å; W251-W298 HydrophobicContact CH2-CE3 4.03Å; W251-W298 HydrophobicContact CH2-CG 4.16Å; W251-W298 HydrophobicContact CZ2-CB 3.37Å; W251-W298 HydrophobicContact CZ2-CD2 4.26Å; W251-W298 AromaticContact CZ2-CE3 3.88Å; W251-W298 HydrophobicContact CZ2-CE3 3.88Å; W251-W298 HydrophobicContact CZ2-CG 4.12Å; M294-W298 VanDerWaalsContact C-CE3 3.44Å; M294-W298 HydrophobicContact CB-CE3 4.04Å; M294-W298 HydrophobicContact CB-CH2 3.93Å; M294-W298 HydrophobicContact CB-CZ3 3.48Å; M294-W298 VanDerWaalsContact CB-CZ3 3.48Å; M294-W298 PolarHBondContact O-N 2.96Å; M294-W298 HydrophobicContact SD-CH2 4.49Å; L296-W298 PolarHBondContact O-N 3.05Å; W298-L300 PolarHBondContact O-N 3.22Å; W298-Y301 WeakPolarHBondContact O-CB 3.46Å; W298-Y301 PolarHBondContact O-N 3.47Å; W298-I302 PolarHBondContact O-N 2.92Å; W298-I302 VanDerWaalsContact O-N 3.13Å
299	F	96.6	Very high	94.2	Very high	46 Å²	46	52.2 Å²	52.2	20%	0.202	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-35	174.6	-173.8	-113.7	0	0	0	111.9	W251 F252 L256 N295 L296 Y301 I302 V303	W251-F299 AromaticContact CD1-CD2 3.56Å; W251-F299 HydrophobicContact CG-CD2 4.29Å; F252-F299 HydrophobicContact CB-CE2 3.95Å; F252-F299 HydrophobicContact CB-CZ 4.27Å; F252-F299 HydrophobicContact CD2-CE2 4.41Å; F252-F299 AromaticContact CD2-CZ 3.93Å; F252-F299 HydrophobicContact CD2-CZ 3.93Å; L256-F299 HydrophobicContact CD1-CB 3.9Å; L256-F299 HydrophobicContact CD1-CD1 3.44Å; L256-F299 VanDerWaalsContact CD1-CD1 3.44Å; L256-F299 HydrophobicContact CD1-CD2 3.85Å; L256-F299 HydrophobicContact CD1-CE1 3.83Å; L256-F299 HydrophobicContact CD1-CE2 4.21Å; L256-F299 HydrophobicContact CD1-CG 3.44Å; L256-F299 VanDerWaalsContact CD1-CG 3.44Å; L256-F299 HydrophobicContact CD1-CZ 4.2Å; N295-F299 WeakPolarHBondContact O-CB 3.17Å; N295-F299 PolarHBondContact O-N 3.33Å; L296-F299 PolarHBondContact O-N 3.08Å; L296-F299 VanDerWaalsContact O-N 3.13Å; F299-Y301 VanDerWaalsContact C-N 3.28Å; F299-Y301 PolarHBondContact O-N 2.91Å; F299-I302 HydrophobicContact CD2-CB 4.43Å; F299-I302 HydrophobicContact CD2-CD1 4.41Å; F299-I302 WeakPolarHBondContact O-CB 3.36Å; F299-I302 PolarHBondContact O-N 3.26Å; F299-V303 HydrophobicContact CD1-CG2 4.01Å; F299-V303 HydrophobicContact CE1-CG2 3.61Å; F299-V303 HydrophobicContact CE2-CG2 4.3Å; F299-V303 HydrophobicContact CZ-CG2 3.78Å; F299-V303 WeakPolarHBondContact O-CG2 3.5Å; F299-V303 PolarHBondContact O-N 3.1Å
300	L	94.8	Very high	93.6	Very high	119 Å²	119	55.5 Å²	55.5	62%	0.623	30%	0.3	S	S	*	.	H	α-helix	trans	-60.8	-36.2	172.9	-64.1	173.5	0	0	0	112.1	L296 Y297 W298 V303 A304	L296-L300 WeakPolarHBondContact O-CG 3.28Å; L296-L300 PolarHBondContact O-N 2.98Å; Y297-L300 WeakPolarHBondContact O-CB 3.45Å; Y297-L300 PolarHBondContact O-N 3.27Å; W298-L300 PolarHBondContact O-N 3.22Å; L300-V303 PolarHBondContact O-N 3.24Å; L300-A304 VanDerWaalsContact O-CB 3.25Å; L300-A304 WeakPolarHBondContact O-CB 3.49Å; L300-A304 PolarHBondContact O-N 2.61Å
301	Y	92.4	Very high	93	Very high	70 Å²	70	56.9 Å²	56.9	28%	0.275	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-38.7	172	-80.3	-89.9	0	0	0	112.4	Y297 W298 F299 A304 F305 L320 R321	Y297-Y301 HydrophobicContact CD1-CE2 4.39Å; Y297-Y301 HydrophobicContact CD2-CE2 4.5Å; Y297-Y301 HydrophobicContact CE1-CD2 4.26Å; Y297-Y301 AromaticContact CE1-CE2 3.72Å; Y297-Y301 HydrophobicContact CE1-CE2 3.72Å; Y297-Y301 AromaticContact CE2-CE2 3.87Å; Y297-Y301 HydrophobicContact CE2-CE2 3.87Å; Y297-Y301 AromaticContact CZ-CE2 3.43Å; Y297-Y301 VanDerWaalsContact CZ-CE2 3.43Å; Y297-Y301 WeakPolarHBondContact O-CD2 2.98Å; Y297-Y301 WeakPolarHBondContact OH-CE2 3.49Å; Y297-Y301 PolarHBondContact OH-OH 3.32Å; W298-Y301 WeakPolarHBondContact O-CB 3.46Å; W298-Y301 PolarHBondContact O-N 3.47Å; F299-Y301 VanDerWaalsContact C-N 3.28Å; F299-Y301 PolarHBondContact O-N 2.91Å; Y301-A304 PolarHBondContact O-N 3.45Å; Y301-F305 VanDerWaalsContact O-CB 3.32Å; Y301-F305 WeakPolarHBondContact O-CB 3.24Å; Y301-F305 PolarHBondContact O-N 3.46Å; Y301-L320 HydrophobicContact CD1-CB 4.47Å; Y301-R321 HydrophobicContact CD1-CG 4.16Å; Y301-R321 HydrophobicContact CE1-CG 4.38Å
302	I	93.6	Very high	92.1	Very high	25 Å²	25	59.4 Å²	59.4	13%	0.128	34%	0.337	C	S	.	.	H	α-helix	trans	-64.3	-46.4	177.2	-61.4	174.6	0	0	0	110.1	F247 W251 W298 F299 F305 A306	F247-I302 HydrophobicContact CD1-CD1 4.43Å; F247-I302 HydrophobicContact CE1-CD1 3.58Å; F247-I302 HydrophobicContact CE1-CG1 3.76Å; F247-I302 HydrophobicContact CZ-CD1 3.64Å; F247-I302 HydrophobicContact CZ-CG1 4.18Å; W251-I302 HydrophobicContact CB-CD1 3.73Å; W251-I302 HydrophobicContact CD2-CD1 3.45Å; W251-I302 VanDerWaalsContact CD2-CD1 3.45Å; W251-I302 HydrophobicContact CE3-CD1 3.77Å; W251-I302 HydrophobicContact CG-CD1 3.42Å; W251-I302 VanDerWaalsContact CG-CD1 3.42Å; W298-I302 PolarHBondContact O-N 2.92Å; W298-I302 VanDerWaalsContact O-N 3.13Å; F299-I302 HydrophobicContact CD2-CB 4.43Å; F299-I302 HydrophobicContact CD2-CD1 4.41Å; F299-I302 WeakPolarHBondContact O-CB 3.36Å; F299-I302 PolarHBondContact O-N 3.26Å; I302-F305 WeakPolarHBondContact O-CB 2.97Å; I302-F305 PolarHBondContact O-N 3.04Å; I302-A306 WeakPolarHBondContact O-CB 3.46Å; I302-A306 PolarHBondContact O-N 3.25Å
303	V	93.9	Very high	91	Very high	71 Å²	71	65.2 Å²	65.2	43%	0.43	36%	0.363	S	S	.	.	H	α-helix	trans	-64.2	-44.6	177.1	173.5	0	0	0	0	111.1	F299 L300 F305 A306 A307	F299-V303 HydrophobicContact CD1-CG2 4.01Å; F299-V303 HydrophobicContact CE1-CG2 3.61Å; F299-V303 HydrophobicContact CE2-CG2 4.3Å; F299-V303 HydrophobicContact CZ-CG2 3.78Å; F299-V303 WeakPolarHBondContact O-CG2 3.5Å; F299-V303 PolarHBondContact O-N 3.1Å; L300-V303 PolarHBondContact O-N 3.24Å; V303-F305 VanDerWaalsContact C-N 3.27Å; V303-F305 PolarHBondContact O-N 3.29Å; V303-A306 PolarHBondContact O-N 3.45Å; V303-A307 WeakPolarHBondContact O-CB 3.42Å; V303-A307 PolarHBondContact O-N 2.81Å
304	A	91.1	Very high	89.8	Confident	44 Å²	44	61.7 Å²	61.7	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-60.6	-38.3	176.1	0	0	0	0	0	111.9	L300 Y301 K308 L320	L300-A304 VanDerWaalsContact O-CB 3.25Å; L300-A304 WeakPolarHBondContact O-CB 3.49Å; L300-A304 PolarHBondContact O-N 2.61Å; Y301-A304 PolarHBondContact O-N 3.45Å; A304-K308 WeakPolarHBondContact O-CG 3.35Å; A304-K308 PolarHBondContact O-N 3.35Å; A304-K308 VanDerWaalsContact O-N 3.09Å; A304-L320 HydrophobicContact CB-CD1 4.45Å
305	F	89.4	Confident	88	Confident	31 Å²	31	73.2 Å²	73.2	14%	0.136	39%	0.389	C	S	.	.	H	α-helix	trans	-65.1	-49.2	173.5	-178.7	-106.4	0	0	0	112.1	C244 Y301 I302 V303 A307 K308 V309 V314 L317 K318 L320	C244-F305 VanDerWaalsContact SG-CE1 3.56Å; Y301-F305 VanDerWaalsContact O-CB 3.32Å; Y301-F305 WeakPolarHBondContact O-CB 3.24Å; Y301-F305 PolarHBondContact O-N 3.46Å; I302-F305 WeakPolarHBondContact O-CB 2.97Å; I302-F305 PolarHBondContact O-N 3.04Å; V303-F305 VanDerWaalsContact C-N 3.27Å; V303-F305 PolarHBondContact O-N 3.29Å; F305-A307 VanDerWaalsContact C-N 3.31Å; F305-A307 PolarHBondContact O-N 2.77Å; F305-K308 PolarHBondContact O-N 2.96Å; F305-K308 VanDerWaalsContact O-N 3.13Å; F305-V309 HydrophobicContact CD1-CG2 4.3Å; F305-V309 HydrophobicContact CE1-CG2 3.87Å; F305-V309 HydrophobicContact CE2-CG2 4.19Å; F305-V309 HydrophobicContact CZ-CG2 3.85Å; F305-V309 WeakPolarHBondContact O-CG2 3.5Å; F305-V309 PolarHBondContact O-N 3.28Å; F305-V314 HydrophobicContact CE2-CG1 4.39Å; F305-L317 HydrophobicContact CE1-CD2 3.85Å; F305-L317 HydrophobicContact CZ-CB 4.47Å; F305-L317 HydrophobicContact CZ-CD2 3.5Å; F305-L317 VanDerWaalsContact CZ-CD2 3.5Å; F305-K318 WeakPolarHBondContact CE2-O 3.35Å; F305-L320 HydrophobicContact CB-CD1 3.62Å; F305-L320 HydrophobicContact CB-CG 4.13Å; F305-L320 HydrophobicContact CD2-CD1 4.06Å; F305-L320 HydrophobicContact CD2-CD2 4.08Å; F305-L320 HydrophobicContact CD2-CG 3.73Å; F305-L320 HydrophobicContact CG-CD1 4.35Å; F305-L320 HydrophobicContact CG-CG 4.39Å
306	A	90.1	Very high	86.7	Confident	45 Å²	45	79.8 Å²	79.8	37%	0.372	42%	0.419	S	S	.	.	H	α-helix	trans	-57.6	-43.9	177.1	0	0	0	0	0	111.6	I302 V303 K308 V309 L310	I302-A306 WeakPolarHBondContact O-CB 3.46Å; I302-A306 PolarHBondContact O-N 3.25Å; V303-A306 PolarHBondContact O-N 3.45Å; A306-K308 PolarHBondContact O-N 3.39Å; A306-V309 PolarHBondContact O-N 3.25Å; A306-L310 VanDerWaalsContact O-CG 3.3Å; A306-L310 WeakPolarHBondContact O-CG 3.14Å; A306-L310 PolarHBondContact O-N 3.44Å
307	A	88.7	Confident	85.4	Confident	47 Å²	47	77.4 Å²	77.4	39%	0.388	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-41.7	176.1	0	0	0	0	0	112.4	V303 F305 V309 L310 T311	V303-A307 WeakPolarHBondContact O-CB 3.42Å; V303-A307 PolarHBondContact O-N 2.81Å; F305-A307 VanDerWaalsContact C-N 3.31Å; F305-A307 PolarHBondContact O-N 2.77Å; A307-V309 VanDerWaalsContact C-N 3.35Å; A307-L310 PolarHBondContact O-N 3.2Å; A307-T311 WeakPolarHBondContact O-CB 3.43Å; A307-T311 VanDerWaalsContact O-CG2 3.26Å; A307-T311 WeakPolarHBondContact O-CG2 3.18Å; A307-T311 PolarHBondContact O-N 3.05Å; A307-T311 PolarHBondContact O-OG1 3.26Å
308	K	86.2	Confident	84.2	Confident	84 Å²	84	77.6 Å²	77.6	37%	0.365	41%	0.409	S	S	.	.	H	α-helix	trans	-66.4	-34.4	176	-76.3	-177.1	177.8	-174.6	0	113.3	A304 F305 A306 T311 G312 Q313 V314 L320	A304-K308 WeakPolarHBondContact O-CG 3.35Å; A304-K308 PolarHBondContact O-N 3.35Å; A304-K308 VanDerWaalsContact O-N 3.09Å; F305-K308 PolarHBondContact O-N 2.96Å; F305-K308 VanDerWaalsContact O-N 3.13Å; A306-K308 PolarHBondContact O-N 3.39Å; K308-T311 WeakPolarHBondContact CA-OG1 3.37Å; K308-T311 PolarHBondContact O-OG1 3.33Å; K308-G312 PolarHBondContact O-N 2.7Å; K308-Q313 PolarHBondContact O-N 2.91Å; K308-V314 HydrophobicContact CB-CG2 3.76Å; K308-V314 HydrophobicContact CD-CG2 4.41Å; K308-V314 PolarHBondContact O-N 2.87Å; K308-L320 HydrophobicContact CD-CD1 4.38Å; K308-L320 HydrophobicContact CD-CD2 4.14Å
309	V	86	Confident	83.1	Confident	60 Å²	60	78.7 Å²	78.7	36%	0.364	42%	0.416	S	S	.	.	H	α-helix	trans	-68.6	-46.9	173.8	172.1	0	0	0	0	110.3	F305 A306 A307 T311 G312 V314	F305-V309 HydrophobicContact CD1-CG2 4.3Å; F305-V309 HydrophobicContact CE1-CG2 3.87Å; F305-V309 HydrophobicContact CE2-CG2 4.19Å; F305-V309 HydrophobicContact CZ-CG2 3.85Å; F305-V309 WeakPolarHBondContact O-CG2 3.5Å; F305-V309 PolarHBondContact O-N 3.28Å; A306-V309 PolarHBondContact O-N 3.25Å; A307-V309 VanDerWaalsContact C-N 3.35Å; V309-T311 VanDerWaalsContact C-N 3.35Å; V309-T311 PolarHBondContact O-N 3.36Å; V309-G312 PolarHBondContact O-N 3.32Å; V309-G312 VanDerWaalsContact O-N 3.14Å; V309-V314 HydrophobicContact CG2-CB 4.4Å; V309-V314 HydrophobicContact CG2-CG1 4.49Å
310	L	85.4	Confident	82.3	Confident	154 Å²	154	78.7 Å²	78.7	81%	0.806	42%	0.418	S	S	*	.	H	α-helix	trans	-66.1	-33.9	-180	-68.7	173.1	0	0	0	113.4	A306 A307 G312	A306-L310 VanDerWaalsContact O-CG 3.3Å; A306-L310 WeakPolarHBondContact O-CG 3.14Å; A306-L310 PolarHBondContact O-N 3.44Å; A307-L310 PolarHBondContact O-N 3.2Å; L310-G312 PolarHBondContact O-N 3.27Å
311	T	85.9	Confident	81.5	Confident	91 Å²	91	74.8 Å²	74.8	56%	0.558	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	1	176.2	53	0	0	0	0	113.4	A307 K308 V309 Q313	A307-T311 WeakPolarHBondContact O-CB 3.43Å; A307-T311 VanDerWaalsContact O-CG2 3.26Å; A307-T311 WeakPolarHBondContact O-CG2 3.18Å; A307-T311 PolarHBondContact O-N 3.05Å; A307-T311 PolarHBondContact O-OG1 3.26Å; K308-T311 WeakPolarHBondContact CA-OG1 3.37Å; K308-T311 PolarHBondContact O-OG1 3.33Å; V309-T311 VanDerWaalsContact C-N 3.35Å; V309-T311 PolarHBondContact O-N 3.36Å; T311-Q313 PolarHBondContact O-N 3.19Å
312	G	79.4	Confident	80.9	Confident	54 Å²	54	72.9 Å²	72.9	56%	0.557	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	8.5	179.1	0	0	0	0	0	114.7	K308 V309 L310 V314	K308-G312 PolarHBondContact O-N 2.7Å; V309-G312 PolarHBondContact O-N 3.32Å; V309-G312 VanDerWaalsContact O-N 3.14Å; L310-G312 PolarHBondContact O-N 3.27Å; G312-V314 PolarHBondContact O-N 3.13Å
313	Q	73.1	Confident	79.9	Confident	142 Å²	142	74.8 Å²	74.8	66%	0.664	39%	0.394	S	S	*	.			trans	-71.7	-18.2	179.5	-67.1	-176	-8.6	0	0	112.7	K308 T311	K308-Q313 PolarHBondContact O-N 2.91Å; T311-Q313 PolarHBondContact O-N 3.19Å
314	V	72.6	Confident	78.8	Confident	37 Å²	37	75.2 Å²	75.2	22%	0.224	39%	0.394	C	S	.	.			trans	-121	107	-178.9	176.5	0	0	0	0	109.4	F305 K308 V309 G312 E316	F305-V314 HydrophobicContact CE2-CG1 4.39Å; K308-V314 HydrophobicContact CB-CG2 3.76Å; K308-V314 HydrophobicContact CD-CG2 4.41Å; K308-V314 PolarHBondContact O-N 2.87Å; V309-V314 HydrophobicContact CG2-CB 4.4Å; V309-V314 HydrophobicContact CG2-CG1 4.49Å; G312-V314 PolarHBondContact O-N 3.13Å; V314-E316 WeakPolarHBondContact CG1-O 3.49Å
315	R	61.3	Low	77.3	Confident	253 Å²	253	78.5 Å²	78.5	96%	0.955	41%	0.409	S	S	*	.	S	Bend	trans	-82.8	-20.1	173.9	-82	-179	162.2	178.4	-4.5	113.7
316	E	69	Low	75.6	Confident	137 Å²	137	80.7 Å²	80.7	64%	0.64	43%	0.433	S	S	*	.	S	Bend	trans	-131.4	131.6	177.9	-66.7	-163.2	142.9	0	0	111.4	V314 K318	V314-E316 WeakPolarHBondContact CG1-O 3.49Å; E316-K318 PolarHBondContact O-N 3.26Å
317	L	70.9	Confident	74.2	Confident	31 Å²	31	82.5 Å²	82.5	16%	0.162	43%	0.434	C	S	.	.			trans	-57.7	101.4	173.8	-63	173.9	0	0	0	110.5	I223 A240 D241 C244 F305	I223-L317 HydrophobicContact CD1-CB 3.83Å; I223-L317 HydrophobicContact CD1-CD1 4.32Å; I223-L317 HydrophobicContact CG1-CB 4.47Å; A240-L317 HydrophobicContact CB-CD1 4.28Å; D241-L317 WeakPolarHBondContact OD1-CD1 3.29Å; C244-L317 HydrophobicContact CB-CD1 4.47Å; F305-L317 HydrophobicContact CE1-CD2 3.85Å; F305-L317 HydrophobicContact CZ-CB 4.47Å; F305-L317 HydrophobicContact CZ-CD2 3.5Å; F305-L317 VanDerWaalsContact CZ-CD2 3.5Å
318	K	69.9	Low	72.7	Confident	78 Å²	78	82 Å²	82	34%	0.339	43%	0.43	S	S	.	.			trans	-122.4	137.9	174.3	-175.4	-173.7	169.9	-164.5	0	109	F305 E316 L320 D324	F305-K318 WeakPolarHBondContact CE2-O 3.35Å; E316-K318 PolarHBondContact O-N 3.26Å; K318-L320 PolarHBondContact O-N 3.44Å; K318-D324 IonicContact NZ-OD1 3.74Å; K318-D324 PolarHBondContact NZ-OD1 3.06Å; K318-D324 VanDerWaalsContact NZ-OD1 3.12Å
319	D	75.1	Confident	71.4	Confident	34 Å²	34	84.9 Å²	84.9	18%	0.182	45%	0.445	C	S	.	.			trans	-64.3	119.4	175.3	-171.8	-21.7	0	0	0	110.6	R321 E322	D319-R321 PolarHBondContact O-N 2.77Å; D319-R321 WeakPolarHBondContact OD1-CB 3.48Å; D319-R321 WeakPolarHBondContact OD1-CG 3.49Å; D319-R321 IonicContact OD1-CZ 2.72Å; D319-R321 PolarHBondContact OD1-N 3.42Å; D319-R321 IonicContact OD1-NE 3.53Å; D319-R321 PolarHBondContact OD1-NE 3.32Å; D319-R321 IonicContact OD1-NH2 2.97Å; D319-R321 IonicContact OD2-CZ 2.82Å; D319-R321 IonicContact OD2-NE 2.77Å; D319-R321 PolarHBondContact OD2-NE 2.63Å; D319-R321 IonicContact OD2-NH2 2.66Å; D319-R321 PolarHBondContact OD2-NH2 3.47Å; D319-E322 HydrophobicContact CB-CG 4.17Å; D319-E322 PolarHBondContact O-N 3.12Å
320	L	78.9	Confident	69.8	Low	46 Å²	46	86.7 Å²	86.7	24%	0.241	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.9	-177.3	-68.2	-172.1	0	0	0	114.2	Y301 A304 F305 K308 K318	Y301-L320 HydrophobicContact CD1-CB 4.47Å; A304-L320 HydrophobicContact CB-CD1 4.45Å; F305-L320 HydrophobicContact CB-CD1 3.62Å; F305-L320 HydrophobicContact CB-CG 4.13Å; F305-L320 HydrophobicContact CD2-CD1 4.06Å; F305-L320 HydrophobicContact CD2-CD2 4.08Å; F305-L320 HydrophobicContact CD2-CG 3.73Å; F305-L320 HydrophobicContact CG-CD1 4.35Å; F305-L320 HydrophobicContact CG-CG 4.39Å; K308-L320 HydrophobicContact CD-CD1 4.38Å; K308-L320 HydrophobicContact CD-CD2 4.14Å; K318-L320 PolarHBondContact O-N 3.44Å
321	R	79.3	Confident	68.4	Low	36 Å²	36	84.1 Å²	84.1	14%	0.136	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-13.4	-176.8	-54.6	170.5	-64.3	172.5	-7.1	112.2	R173 K174 D175 Y301 D319	R173-R321 HydrophobicContact CB-CB 4.34Å; R173-R321 WeakPolarHBondContact CB-O 3.39Å; K174-R321 WeakPolarHBondContact CB-O 3.48Å; K174-R321 WeakPolarHBondContact CG-O 3.41Å; K174-R321 PolarHBondContact N-O 3.24Å; D175-R321 VanDerWaalsContact OD2-CD 3.3Å; D175-R321 WeakPolarHBondContact OD2-CD 3.18Å; D175-R321 IonicContact OD2-CZ 2.64Å; D175-R321 IonicContact OD2-NE 3.64Å; D175-R321 IonicContact OD2-NH1 3.18Å; D175-R321 PolarHBondContact OD2-NH1 3Å; D175-R321 VanDerWaalsContact OD2-NH1 3.09Å; Y301-R321 HydrophobicContact CD1-CG 4.16Å; Y301-R321 HydrophobicContact CE1-CG 4.38Å; D319-R321 PolarHBondContact O-N 2.77Å; D319-R321 WeakPolarHBondContact OD1-CB 3.48Å; D319-R321 WeakPolarHBondContact OD1-CG 3.49Å; D319-R321 IonicContact OD1-CZ 2.72Å; D319-R321 PolarHBondContact OD1-N 3.42Å; D319-R321 IonicContact OD1-NE 3.53Å; D319-R321 PolarHBondContact OD1-NE 3.32Å; D319-R321 IonicContact OD1-NH2 2.97Å; D319-R321 IonicContact OD2-CZ 2.82Å; D319-R321 IonicContact OD2-NE 2.77Å; D319-R321 PolarHBondContact OD2-NE 2.63Å; D319-R321 IonicContact OD2-NH2 2.66Å; D319-R321 PolarHBondContact OD2-NH2 3.47Å
322	E	80	Confident	66.3	Low	30 Å²	30	87.4 Å²	87.4	14%	0.14	45%	0.453	C	S	.	.	S	Bend	trans	-63.4	137.4	174.3	-67	-173.2	179.3	0	0	110.2	R94 K98 D319	R94-E322 IonicContact NH2-OE2 3.09Å; R94-E322 PolarHBondContact NH2-OE2 3.45Å; K98-E322 IonicContact NZ-OE1 4Å; K98-E322 PolarHBondContact NZ-OE1 3.06Å; K98-E322 IonicContact NZ-OE2 3.44Å; K98-E322 PolarHBondContact NZ-OE2 2.89Å; D319-E322 HydrophobicContact CB-CG 4.17Å; D319-E322 PolarHBondContact O-N 3.12Å
323	Y	71.9	Confident	64.4	Low	66 Å²	66	90.2 Å²	90.2	26%	0.259	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-63.6	139.4	167.2	-63.9	-72.1	0	0	0	109.5	W172 R173 K174 E327 L331	W172-Y323 WeakPolarHBondContact O-CD2 2.95Å; W172-Y323 WeakPolarHBondContact O-CE2 3.33Å; R173-Y323 VanDerWaalsContact C-CE2 3.42Å; R173-Y323 VanDerWaalsContact CA-CE2 3.49Å; R173-Y323 PolarHBondContact O-OH 3.23Å; K174-Y323 HydrophobicContact CB-CE1 4.44Å; K174-Y323 HydrophobicContact CG-CD1 3.76Å; K174-Y323 HydrophobicContact CG-CE1 3.59Å; K174-Y323 HydrophobicContact CG-CG 4.5Å; Y323-E327 HydrophobicContact CD1-CB 4.47Å; Y323-L331 HydrophobicContact CD1-CD1 3.53Å; Y323-L331 HydrophobicContact CD2-CD1 4.2Å; Y323-L331 HydrophobicContact CE1-CD1 3.35Å; Y323-L331 HydrophobicContact CE2-CD1 4.02Å; Y323-L331 HydrophobicContact CG-CD1 3.96Å
324	D	69.4	Low	62.7	Low	80 Å²	80	88.8 Å²	88.8	43%	0.428	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-70	155.8	169.7	-71.1	-44.9	0	0	0	110	K318 A326 E327 A328	K318-D324 IonicContact NZ-OD1 3.74Å; K318-D324 PolarHBondContact NZ-OD1 3.06Å; K318-D324 VanDerWaalsContact NZ-OD1 3.12Å; D324-A326 PolarHBondContact O-N 3.32Å; D324-A326 VanDerWaalsContact O-N 3.08Å; D324-E327 PolarHBondContact O-N 3.2Å; D324-A328 PolarHBondContact O-N 3.42Å
325	V	60.1	Low	61.2	Low	112 Å²	112	96.3 Å²	96.3	68%	0.679	50%	0.497	S	S	*	.	H	α-helix	trans	-55.6	-35	-170.3	-179.7	0	0	0	0	111.9	Q329	V325-Q329 WeakPolarHBondContact O-CG 3.38Å; V325-Q329 PolarHBondContact O-N 2.94Å
326	A	54	Low	60	Low	78 Å²	78	88.1 Å²	88.1	65%	0.645	48%	0.484	S	S	*	.	H	α-helix	trans	-70.6	-42.6	176.3	0	0	0	0	0	113	D324 Q329	D324-A326 PolarHBondContact O-N 3.32Å; D324-A326 VanDerWaalsContact O-N 3.08Å; A326-Q329 PolarHBondContact O-N 3.11Å
327	E	60.7	Low	58.4	Low	82 Å²	82	90.5 Å²	90.5	38%	0.383	50%	0.495	S	S	.	.	H	α-helix	trans	-69.1	-34	177.3	-63.3	179.4	156.8	0	0	111.8	K174 Y323 D324 Q329 S330 L331	K174-E327 WeakPolarHBondContact CE-OE2 3.48Å; K174-E327 IonicContact NZ-OE1 2.97Å; K174-E327 IonicContact NZ-OE2 3.93Å; K174-E327 PolarHBondContact NZ-OE2 2.59Å; Y323-E327 HydrophobicContact CD1-CB 4.47Å; D324-E327 PolarHBondContact O-N 3.2Å; E327-Q329 VanDerWaalsContact C-N 3.26Å; E327-Q329 PolarHBondContact O-N 2.95Å; E327-S330 PolarHBondContact O-N 2.86Å; E327-S330 PolarHBondContact O-OG 3.08Å; E327-L331 PolarHBondContact O-N 3.07Å
328	A	58.3	Low	56.5	Low	38 Å²	38	97.9 Å²	97.9	31%	0.314	53%	0.526	S	S	.	.	H	α-helix	trans	-68.7	-24.5	178.3	0	0	0	0	0	113.2	D324	D324-A328 PolarHBondContact O-N 3.42Å
329	Q	57	Low	54.6	Low	144 Å²	144	100 Å²	100	67%	0.673	55%	0.548	S	S	*	.	H	α-helix	trans	-78.8	-32.5	176.2	-72.9	176.1	1.4	0	0	112.2	V325 A326 E327	V325-Q329 WeakPolarHBondContact O-CG 3.38Å; V325-Q329 PolarHBondContact O-N 2.94Å; A326-Q329 PolarHBondContact O-N 3.11Å; E327-Q329 VanDerWaalsContact C-N 3.26Å; E327-Q329 PolarHBondContact O-N 2.95Å
330	S	54.1	Low	52.7	Low	97 Å²	97	106.6 Å²	106.6	68%	0.678	58%	0.582	S	S	*	*	H	α-helix	trans	-77.2	-26.7	178.4	65.4	0	0	0	0	113.6	E327	E327-S330 PolarHBondContact O-N 2.86Å; E327-S330 PolarHBondContact O-OG 3.08Å
331	L	55.7	Low	50.6	Low	100 Å²	100	115.5 Å²	115.5	52%	0.524	61%	0.612	S	S	.	*	S	Bend	trans	-80.5	-16.5	178.2	-74.3	164	0	0	0	114.1	Y323 E327 P333	Y323-L331 HydrophobicContact CD1-CD1 3.53Å; Y323-L331 HydrophobicContact CD2-CD1 4.2Å; Y323-L331 HydrophobicContact CE1-CD1 3.35Å; Y323-L331 HydrophobicContact CE2-CD1 4.02Å; Y323-L331 HydrophobicContact CG-CD1 3.96Å; E327-L331 PolarHBondContact O-N 3.07Å; L331-P333 VanDerWaalsContact O-CD 3.28Å; L331-P333 WeakPolarHBondContact O-CD 3.25Å
332	K	42.3	Very low	48.3	Very low	160 Å²	160	120.7 Å²	120.7	70%	0.696	64%	0.643	S	S	*	*	S	Bend	trans	-73.6	117	168.5	-73.9	-178.6	-178.7	177.5	0	106.8	S334	K332-S334 PolarHBondContact O-N 2.74Å; K332-S334 VanDerWaalsContact O-N 3.07Å
333	P	38.9	Very low	46.4	Very low	114 Å²	114	123.1 Å²	123.1	74%	0.74	68%	0.676	S	S	*	*			trans	-55.8	125.9	167.9	23.2	-30.2	0	0	0	106.6	L331 K335	L331-P333 VanDerWaalsContact O-CD 3.28Å; L331-P333 WeakPolarHBondContact O-CD 3.25Å; P333-K335 PolarHBondContact O-N 3.2Å
334	S	37.9	Very low	44.4	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	71%	0.706	S	S	*	*			trans	-46.1	106.6	168.3	169.2	0	0	0	0	106.7	K332 A336	K332-S334 PolarHBondContact O-N 2.74Å; K332-S334 VanDerWaalsContact O-N 3.07Å; S334-A336 PolarHBondContact O-N 2.9Å
335	K	39.3	Very low	42.7	Very low	194 Å²	194	130.9 Å²	130.9	84%	0.843	73%	0.726	S	S	*	*			trans	-68.9	83.4	165.5	-78.8	-171.5	177.2	-175.1	0	105.1	P333 E337	P333-K335 PolarHBondContact O-N 3.2Å; K335-E337 PolarHBondContact O-N 2.94Å
336	A	37.3	Very low	41.4	Very low	82 Å²	82	135.2 Å²	135.2	68%	0.678	74%	0.735	S	S	*	*			trans	-57.1	102.2	146.7	0	0	0	0	0	104.9	S334 K338	S334-A336 PolarHBondContact O-N 2.9Å; A336-K338 VanDerWaalsContact C-N 3.29Å; A336-K338 PolarHBondContact O-N 3.38Å
337	E	35.5	Very low	40.4	Very low	186 Å²	186	137.5 Å²	137.5	87%	0.869	74%	0.737	S	S	*	*			trans	-53.2	99	166.6	-80.7	179.3	143.9	0	0	107.3	K335	K335-E337 PolarHBondContact O-N 2.94Å
338	K	31.2	Very low	39.4	Very low	186 Å²	186	142.9 Å²	142.9	81%	0.809	76%	0.759	S	S	*	*			trans	-66.5	124.6	155.5	-75.2	-175.8	178.1	-178.8	0	105.5	A336 L340	A336-K338 VanDerWaalsContact C-N 3.29Å; A336-K338 PolarHBondContact O-N 3.38Å; K338-L340 PolarHBondContact O-N 3.09Å
339	P	29	Very low	38.3	Very low	124 Å²	124	150.9 Å²	150.9	81%	0.805	78%	0.781	S	S	*	*			trans	-61.2	118.2	179.6	24.9	-31.6	0	0	0	107.8	R341	P339-R341 PolarHBondContact O-N 3.2Å
340	L	34.9	Very low	37.3	Very low	171 Å²	171	157.2 Å²	157.2	90%	0.895	81%	0.807	S	S	*	*			trans	-63.4	101.7	168.4	-84.2	157.1	0	0	0	106.9	K338 N342	K338-L340 PolarHBondContact O-N 3.09Å; L340-N342 PolarHBondContact O-N 3.06Å
341	R	35.4	Very low	36.5	Very low	234 Å²	234	160.2 Å²	160.2	88%	0.883	81%	0.813	S	S	*	*	S	Bend	trans	-66.7	89	162.5	-163.5	-178.6	-173.7	-166.9	2.3	106.4	P339	P339-R341 PolarHBondContact O-N 3.2Å
342	N	31.5	Very low	35.5	Very low	144 Å²	144	163.4 Å²	163.4	77%	0.77	83%	0.828	S	S	*	*	S	Bend	trans	168.2	109.4	144	-79.8	-9	0	0	0	107.4	L340 L344	L340-N342 PolarHBondContact O-N 3.06Å; N342-L344 PolarHBondContact O-N 3.4Å
343	G	39.8	Very low	35.1	Very low	81 Å²	81	163.6 Å²	163.6	84%	0.835	84%	0.836	S	S	*	*			trans	-63.4	123.9	-176.6	0	0	0	0	0	111.5
344	L	31	Very low	34.9	Very low	172 Å²	172	166.5 Å²	166.5	90%	0.901	84%	0.841	S	S	*	*			trans	-151.2	110	146.9	-100.1	164.7	0	0	0	106.4	N342 K346	N342-L344 PolarHBondContact O-N 3.4Å; L344-K346 PolarHBondContact O-N 3.31Å
345	V	32.8	Very low	34.7	Very low	138 Å²	138	169.9 Å²	169.9	84%	0.836	85%	0.845	S	S	*	*			trans	-60.2	121.3	-179.4	174.6	0	0	0	0	108.9	D347	V345-D347 PolarHBondContact O-N 3.21Å
346	K	33.3	Very low	34.4	Very low	202 Å²	202	168.3 Å²	168.3	88%	0.878	85%	0.845	S	S	*	*			trans	-82.4	95.7	168.8	-133.6	-179.6	-172	177.9	0	107.6	L344 K348	L344-K346 PolarHBondContact O-N 3.31Å; K346-K348 PolarHBondContact O-N 2.95Å
347	D	31.6	Very low	34.2	Very low	127 Å²	127	174.4 Å²	174.4	68%	0.679	86%	0.857	S	S	*	*			trans	-62.5	122.7	173.5	-150.3	-9.4	0	0	0	109.1	V345	V345-D347 PolarHBondContact O-N 3.21Å
348	K	41.3	Very low	34.1	Very low	195 Å²	195	173.5 Å²	173.5	85%	0.848	86%	0.856	S	S	*	*			trans	-94.1	108.5	174.8	-82.7	-178.8	177.3	174.9	0	107.2	K346	K346-K348 PolarHBondContact O-N 2.95Å
349	R	34.4	Very low	34.3	Very low	206 Å²	206	172.5 Å²	172.5	78%	0.777	86%	0.86	S	S	*	*			trans	-144.7	116.9	156.9	-94.6	-177.3	-118.6	-143.6	0	111.4
350	F	37.2	Very low	34.8	Very low	276 Å²	276	176.9 Å²	176.9	100%	1.211	87%	0.865	S	S	*	*			trans	60.6	0	156.3	-64.1	-79.4	0	0	0	120.8

Retrieved 350 of 350 residues in 1494.3 ms (Link to these results)

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