G4VQM4_SCHMA Loading...

Protein jagunal 1

AlphaFold DB , UniProt , Accession G4VQM4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 190 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	45.1	Very low	64.2	Low	245 Å²	245	139.2 Å²	139.2	100%	1.207	77%	0.773	S	S	*	*				0	103.5	0	-78.4	168.8	150.4	0	0	108.5
2	A	50.1	Low	64.9	Low	96 Å²	96	129.8 Å²	129.8	79%	0.793	72%	0.722	S	S	*	*			trans	-74.3	129.7	167.9	0	0	0	0	0	107.7	R4	A2-R4 PolarHBondContact O-N 3.44Å; A2-R4 VanDerWaalsContact O-N 3.14Å
3	S	59.7	Low	65.8	Low	94 Å²	94	129.3 Å²	129.3	66%	0.657	72%	0.717	S	S	*	*			trans	-57.2	119.1	-178.1	59.5	0	0	0	0	109.8	V5 G6	S3-V5 PolarHBondContact O-N 2.88Å; S3-G6 PolarHBondContact O-N 3.19Å
4	R	60.1	Low	66.2	Low	231 Å²	231	121.7 Å²	121.7	87%	0.872	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-14.1	175.4	-74.4	-175.2	173.9	-170.4	-1.3	112.9	A2	A2-R4 PolarHBondContact O-N 3.44Å; A2-R4 VanDerWaalsContact O-N 3.14Å
5	V	65.1	Low	66.5	Low	139 Å²	139	117.6 Å²	117.6	84%	0.842	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	23.5	-170.7	-154.9	0	0	0	0	112.9	S3	S3-V5 PolarHBondContact O-N 2.88Å
6	G	69.8	Low	66.8	Low	36 Å²	36	113.1 Å²	113.1	37%	0.371	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-66	138.8	171	0	0	0	0	0	110.7	S3 R8	S3-G6 PolarHBondContact O-N 3.19Å; G6-R8 PolarHBondContact O-N 2.97Å
7	H	70.3	Confident	66.9	Low	190 Å²	190	113.4 Å²	113.4	88%	0.88	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-50.3	121.5	174.1	-177.2	75.5	0	0	0	109.9
8	R	67	Low	66.8	Low	133 Å²	133	117.4 Å²	117.4	50%	0.502	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-103.7	140	175.5	-64.3	-177	-173.1	164.6	5.4	107.8	G6 T12	G6-R8 PolarHBondContact O-N 2.97Å; R8-T12 HydrophobicContact CB-CG2 4.46Å
9	P	69.5	Low	66.9	Low	75 Å²	75	120.5 Å²	120.5	49%	0.487	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-52.2	144.9	169.5	-18.6	27.6	0	0	0	110.2	T12	P9-T12 HydrophobicContact CB-CG2 3.93Å; P9-T12 HydrophobicContact CG-CG2 4.04Å; P9-T12 WeakPolarHBondContact O-CG2 3.44Å
10	E	74.5	Confident	66.9	Low	199 Å²	199	120 Å²	120	93%	0.93	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	139.8	174.2	-66.2	-176	170.9	0	0	110.1
11	G	75.2	Confident	66.9	Low	93 Å²	93	123.7 Å²	123.7	96%	0.959	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	87.1	1.9	178.6	0	0	0	0	0	116.6
12	T	72.7	Confident	67.9	Low	26 Å²	26	120.9 Å²	120.9	16%	0.16	63%	0.627	C	S	.	*			trans	-111.1	129.5	172.5	173.9	0	0	0	0	112.7	R8 P9 G14 D16	R8-T12 HydrophobicContact CB-CG2 4.46Å; P9-T12 HydrophobicContact CB-CG2 3.93Å; P9-T12 HydrophobicContact CG-CG2 4.04Å; P9-T12 WeakPolarHBondContact O-CG2 3.44Å; T12-G14 PolarHBondContact O-N 2.83Å; T12-G14 PolarHBondContact OG1-N 3.27Å; T12-D16 VanDerWaalsContact CB-OD2 3.26Å; T12-D16 WeakPolarHBondContact CB-OD2 3.48Å; T12-D16 PolarHBondContact OG1-OD1 3.06Å; T12-D16 VanDerWaalsContact OG1-OD1 3.12Å; T12-D16 PolarHBondContact OG1-OD2 3.47Å
13	D	76.2	Confident	68.6	Low	124 Å²	124	121.6 Å²	121.6	66%	0.663	62%	0.622	S	S	*	*			trans	-78	-6.2	174.6	66.2	-6	0	0	0	112.9	A15	D13-A15 VanDerWaalsContact C-N 3.34Å; D13-A15 VanDerWaalsContact OD1-CB 3.26Å; D13-A15 WeakPolarHBondContact OD1-CB 3.42Å; D13-A15 PolarHBondContact OD1-N 3.17Å
14	G	71.4	Confident	68.9	Low	23 Å²	23	120.3 Å²	120.3	24%	0.237	61%	0.611	C	S	.	*	S	Bend	trans	84.5	-3.1	-174.6	0	0	0	0	0	114.9	T12	T12-G14 PolarHBondContact O-N 2.83Å; T12-G14 PolarHBondContact OG1-N 3.27Å
15	A	70.8	Confident	69.3	Low	60 Å²	60	114.4 Å²	114.4	50%	0.496	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-76	-15.8	171.1	0	0	0	0	0	112	D13 F17	D13-A15 VanDerWaalsContact C-N 3.34Å; D13-A15 VanDerWaalsContact OD1-CB 3.26Å; D13-A15 WeakPolarHBondContact OD1-CB 3.42Å; D13-A15 PolarHBondContact OD1-N 3.17Å; A15-F17 WeakPolarHBondContact O-CD1 3.21Å; A15-F17 PolarHBondContact O-N 3.47Å; A15-F17 VanDerWaalsContact O-N 3.08Å
16	D	70.8	Confident	69.6	Low	46 Å²	46	109.6 Å²	109.6	25%	0.246	57%	0.57	C	S	.	*	G	3₁₀ helix	trans	-66	-2.7	175.3	74.9	-9.4	0	0	0	114.8	T12 R18 H19 R20	T12-D16 VanDerWaalsContact CB-OD2 3.26Å; T12-D16 WeakPolarHBondContact CB-OD2 3.48Å; T12-D16 PolarHBondContact OG1-OD1 3.06Å; T12-D16 VanDerWaalsContact OG1-OD1 3.12Å; T12-D16 PolarHBondContact OG1-OD2 3.47Å; D16-R18 PolarHBondContact O-N 2.92Å; D16-H19 CarbonylContact O-C 3.48Å; D16-H19 WeakPolarHBondContact O-CA 3.34Å; D16-H19 PolarHBondContact O-N 3.1Å; D16-R20 PolarHBondContact O-N 3.09Å; D16-R20 IonicContact OD1-CZ 2.69Å; D16-R20 IonicContact OD1-NE 3.84Å; D16-R20 PolarHBondContact OD1-NE 3.45Å; D16-R20 IonicContact OD1-NH2 3.36Å; D16-R20 PolarHBondContact OD1-NH2 3.38Å; D16-R20 IonicContact OD2-NE 3.06Å; D16-R20 IonicContact OD2-NH2 2.92Å
17	F	68.5	Low	69.5	Low	117 Å²	117	113.9 Å²	113.9	51%	0.513	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-55.8	-24.1	-176.9	76.9	-86.8	0	0	0	113.7	A15	A15-F17 WeakPolarHBondContact O-CD1 3.21Å; A15-F17 PolarHBondContact O-N 3.47Å; A15-F17 VanDerWaalsContact O-N 3.08Å
18	R	65.6	Low	69.9	Low	187 Å²	187	108.7 Å²	108.7	71%	0.706	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-74.3	-30	172.9	-65.9	-169.3	178.9	-165.6	1.7	113.1	D16	D16-R18 PolarHBondContact O-N 2.92Å
19	H	68.3	Low	70.9	Confident	175 Å²	175	106.2 Å²	106.2	81%	0.81	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-16.9	178.1	-65.4	94.2	0	0	0	113.1	D16 E21	D16-H19 CarbonylContact O-C 3.48Å; D16-H19 WeakPolarHBondContact O-CA 3.34Å; D16-H19 PolarHBondContact O-N 3.1Å; H19-E21 PolarHBondContact O-N 3.32Å
20	R	68.4	Low	71.9	Confident	110 Å²	110	103.2 Å²	103.2	42%	0.415	54%	0.537	S	S	.	.	S	Bend	trans	-57.2	139.2	172.8	-72	-175.8	-168.3	-158.7	-4.1	110.6	D16 R22	D16-R20 PolarHBondContact O-N 3.09Å; D16-R20 IonicContact OD1-CZ 2.69Å; D16-R20 IonicContact OD1-NE 3.84Å; D16-R20 PolarHBondContact OD1-NE 3.45Å; D16-R20 IonicContact OD1-NH2 3.36Å; D16-R20 PolarHBondContact OD1-NH2 3.38Å; D16-R20 IonicContact OD2-NE 3.06Å; D16-R20 IonicContact OD2-NH2 2.92Å; R20-R22 PolarHBondContact O-N 3.11Å
21	E	66.7	Low	72.7	Confident	199 Å²	199	97.5 Å²	97.5	93%	0.93	52%	0.518	S	S	*	.			trans	-54.4	107.2	171.8	-68.8	-170.3	165.4	0	0	109.7	H19 V23	H19-E21 PolarHBondContact O-N 3.32Å; E21-V23 PolarHBondContact O-N 3.23Å
22	R	65.5	Low	73.6	Confident	185 Å²	185	95.9 Å²	95.9	70%	0.698	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-73.4	130.5	171.7	-66.2	-176.6	-178.1	-178.4	0.7	107.3	R20 C24	R20-R22 PolarHBondContact O-N 3.11Å; R22-C24 PolarHBondContact O-N 3.37Å
23	V	63.7	Low	74.7	Confident	112 Å²	112	95.3 Å²	95.3	68%	0.679	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-48.6	117.4	166.6	174.9	0	0	0	0	107.5	E21 T25 Y27	E21-V23 PolarHBondContact O-N 3.23Å; V23-T25 PolarHBondContact O-N 3.36Å; V23-Y27 HydrophobicContact CG1-CD2 4.07Å; V23-Y27 HydrophobicContact CG1-CG 4.24Å
24	C	66.1	Low	75.6	Confident	66 Å²	66	91.5 Å²	91.5	45%	0.446	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-53.1	135.6	-176.4	-58	0	0	0	0	109.3	R22 Q26 Y27	R22-C24 PolarHBondContact O-N 3.37Å; C24-Q26 HydrophobicContact CB-CG 3.69Å; C24-Q26 PolarHBondContact O-N 3.37Å; C24-Y27 HydrophobicContact CB-CD2 3.83Å; C24-Y27 HydrophobicContact CB-CE2 4.06Å; C24-Y27 PolarHBondContact O-N 3.35Å
25	T	70	Confident	76.8	Confident	107 Å²	107	99 Å²	99	66%	0.656	48%	0.482	S	S	*	.	H	α-helix	trans	-50.2	-29.6	-177.1	51.1	0	0	0	0	113.4	V23 Y27 S28 L29	V23-T25 PolarHBondContact O-N 3.36Å; T25-Y27 VanDerWaalsContact C-N 3.27Å; T25-Y27 PolarHBondContact O-N 2.89Å; T25-S28 PolarHBondContact O-N 3.28Å; T25-S28 PolarHBondContact O-OG 2.92Å; T25-L29 WeakPolarHBondContact O-CB 3.44Å; T25-L29 WeakPolarHBondContact O-CG 3.36Å; T25-L29 PolarHBondContact O-N 3.43Å
26	Q	69.8	Low	78.1	Confident	38 Å²	38	101.9 Å²	101.9	18%	0.178	48%	0.48	C	S	.	.	H	α-helix	trans	-55.9	-34.3	173.2	60.4	179	-29.7	0	0	114.8	C24 S30 I181	C24-Q26 HydrophobicContact CB-CG 3.69Å; C24-Q26 PolarHBondContact O-N 3.37Å; Q26-S30 PolarHBondContact O-N 3.26Å; Q26-S30 VanDerWaalsContact O-N 3.1Å; Q26-I181 HydrophobicContact CB-CG2 4.06Å
27	Y	69	Low	79.4	Confident	127 Å²	127	99.7 Å²	99.7	50%	0.498	47%	0.468	S	S	.	.	H	α-helix	trans	-75.3	-32.1	-178.3	-68.8	-69.5	0	0	0	112.1	V23 C24 T25 P31	V23-Y27 HydrophobicContact CG1-CD2 4.07Å; V23-Y27 HydrophobicContact CG1-CG 4.24Å; C24-Y27 HydrophobicContact CB-CD2 3.83Å; C24-Y27 HydrophobicContact CB-CE2 4.06Å; C24-Y27 PolarHBondContact O-N 3.35Å; T25-Y27 VanDerWaalsContact C-N 3.27Å; T25-Y27 PolarHBondContact O-N 2.89Å; Y27-P31 WeakPolarHBondContact O-CD 3.42Å; Y27-P31 WeakPolarHBondContact O-CG 3.36Å
28	S	77.8	Confident	80.8	Confident	80 Å²	80	99.2 Å²	99.2	56%	0.559	47%	0.466	S	S	*	.	H	α-helix	trans	-80.8	-31.1	173.4	58.7	0	0	0	0	112.4	T25	T25-S28 PolarHBondContact O-N 3.28Å; T25-S28 PolarHBondContact O-OG 2.92Å
29	L	88.2	Confident	82.4	Confident	81 Å²	81	96.5 Å²	96.5	42%	0.424	46%	0.459	S	S	.	.	H	α-helix	trans	-75.5	-38.7	-178.9	-71.9	172.4	0	0	0	113.7	T25 L32 L33 I181	T25-L29 WeakPolarHBondContact O-CB 3.44Å; T25-L29 WeakPolarHBondContact O-CG 3.36Å; T25-L29 PolarHBondContact O-N 3.43Å; L29-L32 PolarHBondContact O-N 3.49Å; L29-L33 WeakPolarHBondContact O-CG 3.47Å; L29-L33 PolarHBondContact O-N 3.29Å; L29-I181 HydrophobicContact CB-CD1 4.22Å
30	S	90.1	Very high	83.8	Confident	12 Å²	12	88.4 Å²	88.4	8%	0.084	42%	0.422	C	S	.	.	H	α-helix	trans	-61	-46.3	-174.8	-170.9	0	0	0	0	113.6	Q26 L32 L33 K34 W182	Q26-S30 PolarHBondContact O-N 3.26Å; Q26-S30 VanDerWaalsContact O-N 3.1Å; S30-L32 VanDerWaalsContact C-N 3.35Å; S30-L32 PolarHBondContact O-N 3.19Å; S30-L33 PolarHBondContact O-N 3.3Å; S30-K34 WeakPolarHBondContact O-CG 3.19Å; S30-K34 PolarHBondContact O-N 2.98Å; S30-W182 PolarHBondContact OG-NE1 3.19Å; S30-W182 VanDerWaalsContact OG-NE1 3.1Å
31	P	92	Very high	85.2	Confident	80 Å²	80	83.8 Å²	83.8	52%	0.519	41%	0.405	S	S	.	.	H	α-helix	trans	-60.5	-41.8	176.8	-24.2	34.8	0	0	0	113.2	Y27 K34 R35	Y27-P31 WeakPolarHBondContact O-CD 3.42Å; Y27-P31 WeakPolarHBondContact O-CG 3.36Å; P31-K34 PolarHBondContact O-N 3.47Å; P31-R35 PolarHBondContact O-N 3.3Å
32	L	93.8	Very high	86.7	Confident	58 Å²	58	79.4 Å²	79.4	30%	0.304	38%	0.382	S	S	.	.	H	α-helix	trans	-63.7	-44.8	178.7	176.1	148.9	0	0	0	111.5	L29 S30 R35 R36	L29-L32 PolarHBondContact O-N 3.49Å; S30-L32 VanDerWaalsContact C-N 3.35Å; S30-L32 PolarHBondContact O-N 3.19Å; L32-R35 PolarHBondContact O-N 2.86Å; L32-R36 WeakPolarHBondContact O-CG 3.4Å; L32-R36 PolarHBondContact O-N 3.24Å
33	L	95.6	Very high	88.3	Confident	14 Å²	14	73.2 Å²	73.2	7%	0.073	36%	0.363	C	S	.	.	H	α-helix	trans	-65.8	-39.2	176.3	-70.5	171.2	0	0	0	112	L29 S30 R35 R36 I37 F174 K177 L178 I181	L29-L33 WeakPolarHBondContact O-CG 3.47Å; L29-L33 PolarHBondContact O-N 3.29Å; S30-L33 PolarHBondContact O-N 3.3Å; L33-R35 VanDerWaalsContact C-N 3.29Å; L33-R35 PolarHBondContact O-N 3.33Å; L33-R36 PolarHBondContact O-N 2.64Å; L33-I37 WeakPolarHBondContact O-CG2 3.25Å; L33-I37 PolarHBondContact O-N 2.96Å; L33-F174 HydrophobicContact CD2-CD1 3.65Å; L33-F174 HydrophobicContact CD2-CE1 4.37Å; L33-K177 HydrophobicContact CD1-CB 3.69Å; L33-K177 HydrophobicContact CD2-CB 4.38Å; L33-L178 HydrophobicContact CB-CD1 4.29Å; L33-L178 HydrophobicContact CB-CD2 3.52Å; L33-L178 HydrophobicContact CB-CG 3.78Å; L33-L178 HydrophobicContact CD1-CD2 4.14Å; L33-L178 HydrophobicContact CD1-CG 4.4Å; L33-I181 HydrophobicContact CD1-CD1 3.81Å
34	K	96.3	Very high	89.9	Confident	44 Å²	44	67.9 Å²	67.9	19%	0.191	33%	0.331	C	S	.	.	H	α-helix	trans	-58.4	-40.4	172.6	-77.3	-174.1	-178.4	-168.3	0	111.7	S30 P31 I37 K38 L101 S104 L178 W182	S30-K34 WeakPolarHBondContact O-CG 3.19Å; S30-K34 PolarHBondContact O-N 2.98Å; P31-K34 PolarHBondContact O-N 3.47Å; K34-I37 WeakPolarHBondContact O-CG2 3.46Å; K34-K38 WeakPolarHBondContact O-CB 3.31Å; K34-K38 VanDerWaalsContact O-CG 3.24Å; K34-K38 WeakPolarHBondContact O-CG 3.45Å; K34-K38 PolarHBondContact O-N 2.96Å; K34-K38 VanDerWaalsContact O-N 3.14Å; K34-L101 WeakPolarHBondContact CE-O 3.09Å; K34-L101 PolarHBondContact NZ-O 3.01Å; K34-S104 PolarHBondContact NZ-OG 3.38Å; K34-L178 HydrophobicContact CG-CD1 4.28Å; K34-L178 HydrophobicContact CG-CD2 4.21Å; K34-W182 HydrophobicContact CD-CZ2 4.33Å; K34-W182 HydrophobicContact CG-CZ2 4.09Å
35	R	96.7	Very high	91.5	Very high	182 Å²	182	68.7 Å²	68.7	69%	0.687	33%	0.33	S	S	*	.	H	α-helix	trans	-65.5	-45.2	176.3	-173.4	175.1	66.9	177.4	1.8	111.7	P31 L32 L33 K38 F39	P31-R35 PolarHBondContact O-N 3.3Å; L32-R35 PolarHBondContact O-N 2.86Å; L33-R35 VanDerWaalsContact C-N 3.29Å; L33-R35 PolarHBondContact O-N 3.33Å; R35-K38 PolarHBondContact O-N 2.76Å; R35-F39 PolarHBondContact O-N 3.24Å
36	R	97.9	Very high	92.8	Very high	120 Å²	120	67.6 Å²	67.6	45%	0.453	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-47.2	179.3	-70.5	-179.9	178	179.2	-1.1	112.3	L32 L33 K38 F39 V40 F174	L32-R36 WeakPolarHBondContact O-CG 3.4Å; L32-R36 PolarHBondContact O-N 3.24Å; L33-R36 PolarHBondContact O-N 2.64Å; R36-K38 VanDerWaalsContact C-N 3.33Å; R36-K38 PolarHBondContact O-N 2.9Å; R36-F39 WeakPolarHBondContact O-CB 3.39Å; R36-F39 PolarHBondContact O-N 2.86Å; R36-F39 VanDerWaalsContact O-N 3.15Å; R36-V40 WeakPolarHBondContact O-CG2 3.19Å; R36-V40 PolarHBondContact O-N 3.04Å; R36-F174 HydrophobicContact CB-CD1 4.38Å; R36-F174 HydrophobicContact CB-CD2 4.09Å; R36-F174 HydrophobicContact CB-CE1 4.32Å; R36-F174 HydrophobicContact CB-CE2 4.02Å; R36-F174 HydrophobicContact CB-CG 4.29Å; R36-F174 HydrophobicContact CB-CZ 4.15Å
37	I	97.5	Very high	94.2	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.1	-31.9	-179.7	-159.2	174.4	0	0	0	112.3	L33 K34 F39 V40 Y41 L101 M109 F174 L178	L33-I37 WeakPolarHBondContact O-CG2 3.25Å; L33-I37 PolarHBondContact O-N 2.96Å; K34-I37 WeakPolarHBondContact O-CG2 3.46Å; I37-F39 VanDerWaalsContact C-N 3.32Å; I37-F39 PolarHBondContact O-N 3.29Å; I37-V40 WeakPolarHBondContact O-CB 3.25Å; I37-V40 PolarHBondContact O-N 3.01Å; I37-Y41 HydrophobicContact CD1-CE1 4.33Å; I37-Y41 HydrophobicContact CD1-CE2 4.21Å; I37-Y41 VanDerWaalsContact CD1-OH 3.25Å; I37-Y41 WeakPolarHBondContact CD1-OH 3.42Å; I37-Y41 HydrophobicContact CG1-CE1 4.01Å; I37-Y41 HydrophobicContact CG1-CE2 3.96Å; I37-Y41 HydrophobicContact CG2-CE2 4.47Å; I37-Y41 PolarHBondContact O-N 2.8Å; I37-L101 HydrophobicContact CG2-CD1 3.74Å; I37-L101 HydrophobicContact CG2-CD2 3.7Å; I37-L101 HydrophobicContact CG2-CG 4.39Å; I37-M109 HydrophobicContact CD1-CE 3.96Å; I37-M109 HydrophobicContact CD1-SD 4.42Å; I37-F174 HydrophobicContact CB-CB 4.09Å; I37-F174 HydrophobicContact CD1-CB 4.44Å; I37-F174 HydrophobicContact CG1-CB 4.34Å; I37-L178 HydrophobicContact CD1-CD1 4.35Å; I37-L178 HydrophobicContact CG2-CD1 3.85Å
38	K	98.1	Very high	95.5	Very high	107 Å²	107	62 Å²	62	47%	0.465	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-41.1	170.7	-78.4	178.3	-179.3	-171.1	0	112.1	K34 R35 R36 V40 Y41 F42 L101	K34-K38 WeakPolarHBondContact O-CB 3.31Å; K34-K38 VanDerWaalsContact O-CG 3.24Å; K34-K38 WeakPolarHBondContact O-CG 3.45Å; K34-K38 PolarHBondContact O-N 2.96Å; K34-K38 VanDerWaalsContact O-N 3.14Å; R35-K38 PolarHBondContact O-N 2.76Å; R36-K38 VanDerWaalsContact C-N 3.33Å; R36-K38 PolarHBondContact O-N 2.9Å; K38-V40 VanDerWaalsContact C-N 3.34Å; K38-Y41 PolarHBondContact O-N 2.67Å; K38-F42 PolarHBondContact O-N 2.85Å; K38-L101 HydrophobicContact CD-CD1 4.43Å; K38-L101 HydrophobicContact CG-CD1 3.56Å
39	F	98.4	Very high	96.5	Very high	129 Å²	129	62.2 Å²	62.2	57%	0.566	29%	0.294	S	S	*	.	H	α-helix	trans	-63.9	-40.8	174	179	-103.6	0	0	0	111.5	R35 R36 I37 Y41 F42 L43	R35-F39 PolarHBondContact O-N 3.24Å; R36-F39 WeakPolarHBondContact O-CB 3.39Å; R36-F39 PolarHBondContact O-N 2.86Å; R36-F39 VanDerWaalsContact O-N 3.15Å; I37-F39 VanDerWaalsContact C-N 3.32Å; I37-F39 PolarHBondContact O-N 3.29Å; F39-Y41 PolarHBondContact O-N 2.85Å; F39-F42 HydrophobicContact CE2-CD1 4.46Å; F39-F42 WeakPolarHBondContact O-CB 3.38Å; F39-F42 PolarHBondContact O-N 3.34Å; F39-F42 VanDerWaalsContact O-N 3.16Å; F39-L43 HydrophobicContact CD1-CD1 4.2Å; F39-L43 HydrophobicContact CE1-CD1 3.74Å; F39-L43 HydrophobicContact CE1-CD2 4.44Å; F39-L43 HydrophobicContact CE1-CG 4.15Å; F39-L43 HydrophobicContact CZ-CD1 4.3Å; F39-L43 HydrophobicContact CZ-CD2 4.18Å; F39-L43 HydrophobicContact CZ-CG 4.33Å; F39-L43 PolarHBondContact O-N 3Å
40	V	98.6	Very high	96.8	Very high	5 Å²	5	63 Å²	63	3%	0.03	30%	0.298	C	S	.	.	H	α-helix	trans	-61.6	-41.3	173.5	178.1	0	0	0	0	111.9	R36 I37 K38 F42 L43 H44 V167 F170 F174	R36-V40 WeakPolarHBondContact O-CG2 3.19Å; R36-V40 PolarHBondContact O-N 3.04Å; I37-V40 WeakPolarHBondContact O-CB 3.25Å; I37-V40 PolarHBondContact O-N 3.01Å; K38-V40 VanDerWaalsContact C-N 3.34Å; V40-F42 VanDerWaalsContact C-N 3.3Å; V40-F42 PolarHBondContact O-N 3.39Å; V40-L43 WeakPolarHBondContact O-CA 3.16Å; V40-L43 WeakPolarHBondContact O-CB 3.46Å; V40-L43 PolarHBondContact O-N 3.21Å; V40-H44 PolarHBondContact O-CD2 3.23Å; V40-H44 PolarHBondContact O-N 3.16Å; V40-V167 HydrophobicContact CG1-CG1 3.95Å; V40-V167 VanDerWaalsContact CG1-O 3.25Å; V40-V167 WeakPolarHBondContact CG1-O 3.28Å; V40-F170 HydrophobicContact CG1-CB 4.37Å; V40-F170 HydrophobicContact CG2-CB 3.88Å; V40-F174 HydrophobicContact CG2-CD2 4Å; V40-F174 HydrophobicContact CG2-CE2 4.08Å
41	Y	98.2	Very high	97.1	Very high	14 Å²	14	62.7 Å²	62.7	6%	0.055	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-32.1	174.4	-64.2	-26.8	0	0	0	113.2	I37 K38 F39 H44 L45 T94 G97 Y98 L101	I37-Y41 HydrophobicContact CD1-CE1 4.33Å; I37-Y41 HydrophobicContact CD1-CE2 4.21Å; I37-Y41 VanDerWaalsContact CD1-OH 3.25Å; I37-Y41 WeakPolarHBondContact CD1-OH 3.42Å; I37-Y41 HydrophobicContact CG1-CE1 4.01Å; I37-Y41 HydrophobicContact CG1-CE2 3.96Å; I37-Y41 HydrophobicContact CG2-CE2 4.47Å; I37-Y41 PolarHBondContact O-N 2.8Å; K38-Y41 PolarHBondContact O-N 2.67Å; F39-Y41 PolarHBondContact O-N 2.85Å; Y41-H44 AromaticContact CD1-CD2 3.92Å; Y41-H44 WeakPolarHBondContact O-CB 3.37Å; Y41-H44 PolarHBondContact O-N 2.93Å; Y41-L45 PolarHBondContact O-N 3.23Å; Y41-L45 VanDerWaalsContact O-N 3.14Å; Y41-T94 HydrophobicContact CD1-CG2 3.74Å; Y41-T94 HydrophobicContact CE1-CG2 4.34Å; Y41-T94 HydrophobicContact CG-CG2 4.08Å; Y41-G97 WeakPolarHBondContact OH-CA 3.49Å; Y41-Y98 HydrophobicContact CD2-CD2 4.06Å; Y41-L101 HydrophobicContact CD2-CD1 4.3Å; Y41-L101 HydrophobicContact CE2-CD1 4.01Å; Y41-L101 HydrophobicContact CE2-CG 4.41Å
42	F	98	Very high	97.3	Very high	106 Å²	106	63.4 Å²	63.4	47%	0.465	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-40.1	168.6	171.4	-97.8	0	0	0	111.7	K38 F39 V40 L45 M46	K38-F42 PolarHBondContact O-N 2.85Å; F39-F42 HydrophobicContact CE2-CD1 4.46Å; F39-F42 WeakPolarHBondContact O-CB 3.38Å; F39-F42 PolarHBondContact O-N 3.34Å; F39-F42 VanDerWaalsContact O-N 3.16Å; V40-F42 VanDerWaalsContact C-N 3.3Å; V40-F42 PolarHBondContact O-N 3.39Å; F42-L45 WeakPolarHBondContact O-CB 3.42Å; F42-L45 PolarHBondContact O-N 3.04Å; F42-M46 HydrophobicContact CD2-CE 4.48Å; F42-M46 HydrophobicContact CE1-CG 4.12Å; F42-M46 HydrophobicContact CE2-CE 3.81Å; F42-M46 HydrophobicContact CE2-SD 4.46Å; F42-M46 HydrophobicContact CZ-CE 3.97Å; F42-M46 HydrophobicContact CZ-CG 4.18Å; F42-M46 HydrophobicContact CZ-SD 4.01Å; F42-M46 PolarHBondContact O-N 2.77Å; F42-M46 VanDerWaalsContact O-N 3.16Å
43	L	98.5	Very high	97.3	Very high	55 Å²	55	62.8 Å²	62.8	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-65.3	-36.7	173.5	-63	178.1	0	0	0	112.6	F39 V40 L45 M46 L47 V167	F39-L43 HydrophobicContact CD1-CD1 4.2Å; F39-L43 HydrophobicContact CE1-CD1 3.74Å; F39-L43 HydrophobicContact CE1-CD2 4.44Å; F39-L43 HydrophobicContact CE1-CG 4.15Å; F39-L43 HydrophobicContact CZ-CD1 4.3Å; F39-L43 HydrophobicContact CZ-CD2 4.18Å; F39-L43 HydrophobicContact CZ-CG 4.33Å; F39-L43 PolarHBondContact O-N 3Å; V40-L43 WeakPolarHBondContact O-CA 3.16Å; V40-L43 WeakPolarHBondContact O-CB 3.46Å; V40-L43 PolarHBondContact O-N 3.21Å; L43-L45 VanDerWaalsContact C-N 3.28Å; L43-L45 PolarHBondContact O-N 3.04Å; L43-M46 PolarHBondContact O-N 3.41Å; L43-L47 PolarHBondContact O-N 3.45Å; L43-V167 HydrophobicContact CB-CG1 4.03Å; L43-V167 HydrophobicContact CB-CG2 3.97Å; L43-V167 HydrophobicContact CD1-CG2 4.23Å
44	H	98.2	Very high	97.1	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.4	-44.3	170.5	-81.9	-69.7	0	0	0	111.6	V40 Y41 M46 L47 W48 T94 H168	V40-H44 PolarHBondContact O-CD2 3.23Å; V40-H44 PolarHBondContact O-N 3.16Å; Y41-H44 AromaticContact CD1-CD2 3.92Å; Y41-H44 WeakPolarHBondContact O-CB 3.37Å; Y41-H44 PolarHBondContact O-N 2.93Å; H44-M46 VanDerWaalsContact C-N 3.31Å; H44-M46 PolarHBondContact O-N 2.9Å; H44-L47 PolarHBondContact O-N 2.74Å; H44-W48 HydrophobicContact CB-CZ2 4.31Å; H44-W48 VanDerWaalsContact O-CG 3.26Å; H44-W48 PolarHBondContact O-N 3.3Å; H44-T94 HydrophobicContact CB-CG2 4.18Å; H44-H168 AromaticContact CE1-CE1 3.31Å; H44-H168 PolarHBondContact CE1-CE1 3.24Å; H44-H168 AromaticContact CE1-CG 3.81Å; H44-H168 AromaticContact CE1-ND1 3.23Å; H44-H168 PolarHBondContact CE1-ND1 2.93Å; H44-H168 AromaticContact CE1-NE2 3.92Å; H44-H168 AromaticContact ND1-CE1 3.74Å
45	L	97.8	Very high	97	Very high	83 Å²	83	62.6 Å²	62.6	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-59.2	-42.6	176.9	-177.8	66.7	0	0	0	111.6	Y41 F42 L43 W48 V49	Y41-L45 PolarHBondContact O-N 3.23Å; Y41-L45 VanDerWaalsContact O-N 3.14Å; F42-L45 WeakPolarHBondContact O-CB 3.42Å; F42-L45 PolarHBondContact O-N 3.04Å; L43-L45 VanDerWaalsContact C-N 3.28Å; L43-L45 PolarHBondContact O-N 3.04Å; L45-W48 HydrophobicContact CD1-CE3 4.16Å; L45-W48 PolarHBondContact O-N 3.11Å; L45-V49 WeakPolarHBondContact O-CG2 3.17Å; L45-V49 PolarHBondContact O-N 3.31Å
46	M	98.3	Very high	96.7	Very high	85 Å²	85	56.7 Å²	56.7	42%	0.419	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176.7	-61.9	-62.8	100	0	0	112	F42 L43 H44 W48 V49 L50	F42-M46 HydrophobicContact CD2-CE 4.48Å; F42-M46 HydrophobicContact CE1-CG 4.12Å; F42-M46 HydrophobicContact CE2-CE 3.81Å; F42-M46 HydrophobicContact CE2-SD 4.46Å; F42-M46 HydrophobicContact CZ-CE 3.97Å; F42-M46 HydrophobicContact CZ-CG 4.18Å; F42-M46 HydrophobicContact CZ-SD 4.01Å; F42-M46 PolarHBondContact O-N 2.77Å; F42-M46 VanDerWaalsContact O-N 3.16Å; L43-M46 PolarHBondContact O-N 3.41Å; H44-M46 VanDerWaalsContact C-N 3.31Å; H44-M46 PolarHBondContact O-N 2.9Å; M46-W48 VanDerWaalsContact C-N 3.33Å; M46-W48 PolarHBondContact O-N 3.08Å; M46-V49 PolarHBondContact O-N 2.63Å; M46-L50 PolarHBondContact O-N 2.69Å
47	L	98.1	Very high	96.4	Very high	12 Å²	12	51.1 Å²	51.1	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-35.2	176.2	-66.5	177.6	0	0	0	112.3	L43 H44 L50 M51 W86 F160 L163 V167	L43-L47 PolarHBondContact O-N 3.45Å; H44-L47 PolarHBondContact O-N 2.74Å; L47-L50 PolarHBondContact O-N 2.92Å; L47-M51 PolarHBondContact O-N 3.17Å; L47-W86 HydrophobicContact CB-CH2 3.81Å; L47-W86 HydrophobicContact CB-CZ2 4.43Å; L47-F160 HydrophobicContact CB-CE2 4.4Å; L47-F160 HydrophobicContact CD2-CD2 4.31Å; L47-F160 HydrophobicContact CD2-CE2 4.06Å; L47-L163 HydrophobicContact CD2-CB 4.18Å; L47-V167 HydrophobicContact CD1-CB 3.94Å; L47-V167 HydrophobicContact CD1-CG1 4.2Å; L47-V167 HydrophobicContact CD1-CG2 3.84Å
48	W	97.5	Very high	96	Very high	35 Å²	35	52.9 Å²	52.9	13%	0.133	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-42.2	173.2	-67	-24.4	0	0	0	112.3	H44 L45 M46 L50 M51 F52 W86 F87 S90 I91 T94	H44-W48 HydrophobicContact CB-CZ2 4.31Å; H44-W48 VanDerWaalsContact O-CG 3.26Å; H44-W48 PolarHBondContact O-N 3.3Å; L45-W48 HydrophobicContact CD1-CE3 4.16Å; L45-W48 PolarHBondContact O-N 3.11Å; M46-W48 VanDerWaalsContact C-N 3.33Å; M46-W48 PolarHBondContact O-N 3.08Å; W48-L50 VanDerWaalsContact C-N 3.26Å; W48-L50 PolarHBondContact O-N 3.3Å; W48-M51 PolarHBondContact O-N 3.37Å; W48-F52 WeakPolarHBondContact O-CB 3.17Å; W48-F52 PolarHBondContact O-N 2.91Å; W48-W86 AromaticContact CD1-CH2 3.7Å; W48-W86 AromaticContact CD1-CZ3 3.69Å; W48-F87 HydrophobicContact CB-CE2 4.12Å; W48-F87 WeakPolarHBondContact O-CE2 3.49Å; W48-S90 WeakPolarHBondContact CZ2-O 3.31Å; W48-S90 PolarHBondContact NE1-OG 3.29Å; W48-I91 HydrophobicContact CD2-CG1 4.07Å; W48-I91 HydrophobicContact CE3-CG1 4.26Å; W48-I91 HydrophobicContact CH2-CB 4.21Å; W48-I91 HydrophobicContact CH2-CG1 3.99Å; W48-I91 HydrophobicContact CH2-CG2 4.38Å; W48-I91 VanDerWaalsContact CZ2-CA 3.4Å; W48-I91 HydrophobicContact CZ2-CB 4.2Å; W48-I91 HydrophobicContact CZ2-CG1 3.83Å; W48-I91 HydrophobicContact CZ3-CG1 4.21Å; W48-T94 VanDerWaalsContact CH2-CB 3.49Å; W48-T94 HydrophobicContact CH2-CG2 3.46Å; W48-T94 VanDerWaalsContact CH2-CG2 3.46Å; W48-T94 HydrophobicContact CZ2-CG2 3.94Å; W48-T94 HydrophobicContact CZ3-CG2 4.34Å
49	V	97.8	Very high	95.6	Very high	85 Å²	85	49 Å²	49	52%	0.515	24%	0.244	S	C	.	.	H	α-helix	trans	-59.4	-42	175.1	169.9	0	0	0	0	110.3	L45 M46 F52 A53	L45-V49 WeakPolarHBondContact O-CG2 3.17Å; L45-V49 PolarHBondContact O-N 3.31Å; M46-V49 PolarHBondContact O-N 2.63Å; V49-F52 PolarHBondContact O-N 3.24Å; V49-A53 WeakPolarHBondContact O-CB 3.43Å; V49-A53 PolarHBondContact O-N 3.4Å
50	L	95.9	Very high	95.1	Very high	98 Å²	98	44 Å²	44	51%	0.513	23%	0.225	S	C	.	.	H	α-helix	trans	-62.8	-48.1	176.3	-176.6	65.7	0	0	0	112.2	M46 L47 W48 A53 R54 F160	M46-L50 PolarHBondContact O-N 2.69Å; L47-L50 PolarHBondContact O-N 2.92Å; W48-L50 VanDerWaalsContact C-N 3.26Å; W48-L50 PolarHBondContact O-N 3.3Å; L50-A53 PolarHBondContact O-N 2.85Å; L50-R54 PolarHBondContact O-N 3.4Å; L50-F160 HydrophobicContact CD2-CD2 3.93Å; L50-F160 HydrophobicContact CD2-CE2 4.32Å
51	M	95.8	Very high	94.6	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-68.1	-35.8	178.6	-173.9	58.3	71.2	0	0	112.1	L47 W48 R54 L55 W82 E83 W86 F87 F160	L47-M51 PolarHBondContact O-N 3.17Å; W48-M51 PolarHBondContact O-N 3.37Å; M51-R54 WeakPolarHBondContact O-CB 3.39Å; M51-R54 PolarHBondContact O-N 3.16Å; M51-L55 HydrophobicContact CG-CD1 3.98Å; M51-L55 HydrophobicContact CG-CG 4.42Å; M51-L55 WeakPolarHBondContact O-CG 3.4Å; M51-L55 PolarHBondContact O-N 3.02Å; M51-L55 HydrophobicContact SD-CD1 4.11Å; M51-L55 HydrophobicContact SD-CG 4.13Å; M51-W82 HydrophobicContact CE-CH2 4.32Å; M51-W82 HydrophobicContact CE-CZ3 4.33Å; M51-E83 HydrophobicContact SD-CB 4.21Å; M51-W86 HydrophobicContact CB-CE3 4.33Å; M51-W86 HydrophobicContact CB-CZ3 3.8Å; M51-W86 HydrophobicContact CE-CE3 4.39Å; M51-W86 HydrophobicContact CG-CE3 4.08Å; M51-W86 HydrophobicContact CG-CZ3 4.07Å; M51-F87 HydrophobicContact CB-CD2 4.06Å; M51-F87 HydrophobicContact CG-CB 3.99Å; M51-F87 HydrophobicContact CG-CD2 4.01Å; M51-F87 HydrophobicContact CG-CG 4.3Å; M51-F160 HydrophobicContact CE-CD1 4.05Å; M51-F160 HydrophobicContact CE-CE1 3.26Å; M51-F160 HydrophobicContact CE-CE2 4.09Å; M51-F160 HydrophobicContact CE-CZ 3.29Å
52	F	95.6	Very high	94.1	Very high	94 Å²	94	54 Å²	54	41%	0.412	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-49.8	173.8	-179.4	-108.7	0	0	0	110.4	W48 V49 R54 L55 L56 L59 F87	W48-F52 WeakPolarHBondContact O-CB 3.17Å; W48-F52 PolarHBondContact O-N 2.91Å; V49-F52 PolarHBondContact O-N 3.24Å; F52-R54 PolarHBondContact O-N 3.38Å; F52-L55 CarbonylContact O-C 3.57Å; F52-L55 PolarHBondContact O-N 3.22Å; F52-L55 VanDerWaalsContact O-N 3.16Å; F52-L56 HydrophobicContact CE1-CD1 3.84Å; F52-L56 HydrophobicContact CE2-CD1 4.28Å; F52-L56 HydrophobicContact CZ-CD1 3.62Å; F52-L56 WeakPolarHBondContact O-CA 3.48Å; F52-L56 WeakPolarHBondContact O-CB 3.43Å; F52-L56 PolarHBondContact O-N 2.65Å; F52-L59 HydrophobicContact CD2-CD1 4.26Å; F52-L59 HydrophobicContact CE2-CD1 4.22Å; F52-F87 HydrophobicContact CB-CE2 3.75Å; F52-F87 HydrophobicContact CB-CZ 3.83Å; F52-F87 HydrophobicContact CD2-CE1 4.23Å; F52-F87 HydrophobicContact CD2-CE2 4.46Å; F52-F87 AromaticContact CD2-CZ 3.69Å; F52-F87 HydrophobicContact CD2-CZ 3.69Å; F52-F87 HydrophobicContact CG-CZ 4.19Å
53	A	93.4	Very high	93.7	Very high	46 Å²	46	55.1 Å²	55.1	38%	0.38	28%	0.278	S	S	.	.	H	α-helix	trans	-56.7	-36.8	175.4	0	0	0	0	0	111.8	V49 L50	V49-A53 WeakPolarHBondContact O-CB 3.43Å; V49-A53 PolarHBondContact O-N 3.4Å; L50-A53 PolarHBondContact O-N 2.85Å
54	R	92.5	Very high	93.3	Very high	51 Å²	51	55.7 Å²	55.7	19%	0.192	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-43.1	176.6	-176.9	166.6	168.7	-77.2	-3.5	113.9	L50 M51 F52 W74 E83	L50-R54 PolarHBondContact O-N 3.4Å; M51-R54 WeakPolarHBondContact O-CB 3.39Å; M51-R54 PolarHBondContact O-N 3.16Å; F52-R54 PolarHBondContact O-N 3.38Å; R54-W74 PolarHBondContact O-NE1 3.49Å; R54-E83 IonicContact CZ-OE1 2.77Å; R54-E83 IonicContact CZ-OE2 2.64Å; R54-E83 IonicContact NH1-OE1 2.63Å; R54-E83 PolarHBondContact NH1-OE1 3.02Å; R54-E83 IonicContact NH1-OE2 3.31Å; R54-E83 PolarHBondContact NH1-OE2 3.32Å; R54-E83 VanDerWaalsContact NH2-CD 3.32Å; R54-E83 IonicContact NH2-OE1 3.13Å; R54-E83 PolarHBondContact NH2-OE1 2.82Å; R54-E83 IonicContact NH2-OE2 3.43Å; R54-E83 PolarHBondContact NH2-OE2 3.48Å
55	L	93.7	Very high	92.6	Very high	3 Å²	3	61.7 Å²	61.7	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-87.1	-11.1	-179.1	-64.1	175.5	0	0	0	113.2	M51 F52 E58 L59 E83 Y84 F87	M51-L55 HydrophobicContact CG-CD1 3.98Å; M51-L55 HydrophobicContact CG-CG 4.42Å; M51-L55 WeakPolarHBondContact O-CG 3.4Å; M51-L55 PolarHBondContact O-N 3.02Å; M51-L55 HydrophobicContact SD-CD1 4.11Å; M51-L55 HydrophobicContact SD-CG 4.13Å; F52-L55 CarbonylContact O-C 3.57Å; F52-L55 PolarHBondContact O-N 3.22Å; F52-L55 VanDerWaalsContact O-N 3.16Å; L55-E58 PolarHBondContact O-N 3.08Å; L55-L59 HydrophobicContact CB-CD1 3.95Å; L55-L59 HydrophobicContact CB-CG 4.24Å; L55-L59 WeakPolarHBondContact O-CG 3.32Å; L55-L59 PolarHBondContact O-N 3.38Å; L55-E83 HydrophobicContact CD1-CB 4.41Å; L55-E83 HydrophobicContact CD2-CB 4.33Å; L55-Y84 HydrophobicContact CD1-CD1 4.14Å; L55-Y84 HydrophobicContact CD1-CE1 4.15Å; L55-Y84 HydrophobicContact CD2-CE1 4.22Å; L55-Y84 HydrophobicContact CD2-CE2 4.37Å; L55-F87 HydrophobicContact CD1-CB 4.25Å; L55-F87 HydrophobicContact CD1-CG 4.46Å
56	L	91.6	Very high	91.9	Very high	58 Å²	58	69.7 Å²	69.7	30%	0.304	35%	0.348	S	S	.	.	H	α-helix	trans	-54.8	-48.2	-171.2	178.1	64.5	0	0	0	113.4	F52 E58 L59 C60 M70	F52-L56 HydrophobicContact CE1-CD1 3.84Å; F52-L56 HydrophobicContact CE2-CD1 4.28Å; F52-L56 HydrophobicContact CZ-CD1 3.62Å; F52-L56 WeakPolarHBondContact O-CA 3.48Å; F52-L56 WeakPolarHBondContact O-CB 3.43Å; F52-L56 PolarHBondContact O-N 2.65Å; L56-E58 VanDerWaalsContact C-N 3.29Å; L56-E58 PolarHBondContact O-N 3.18Å; L56-L59 PolarHBondContact O-N 3Å; L56-C60 WeakPolarHBondContact O-CB 3.34Å; L56-C60 PolarHBondContact O-N 2.99Å; L56-C60 PolarHBondContact O-SG 2.92Å; L56-M70 HydrophobicContact CG-CE 4.39Å
57	P	90.1	Very high	91	Very high	3 Å²	3	67 Å²	67	2%	0.019	34%	0.336	C	S	.	.	H	α-helix	trans	-60	-40.8	-179.3	-20.2	31.3	0	0	0	113.1	L61 M70 V71 W74	P57-L61 PolarHBondContact O-N 3.39Å; P57-L61 VanDerWaalsContact O-N 3.11Å; P57-M70 HydrophobicContact CB-CE 3.71Å; P57-M70 HydrophobicContact CB-CG 4.25Å; P57-M70 HydrophobicContact CG-CE 3.85Å; P57-M70 HydrophobicContact CG-CG 4.37Å; P57-V71 HydrophobicContact CB-CG2 3.81Å; P57-V71 VanDerWaalsContact O-CG2 3.25Å; P57-V71 WeakPolarHBondContact O-CG2 3.38Å; P57-W74 HydrophobicContact CB-CG 4.41Å; P57-W74 HydrophobicContact CG-CD2 3.56Å; P57-W74 HydrophobicContact CG-CE3 3.73Å; P57-W74 HydrophobicContact CG-CG 3.9Å; P57-W74 HydrophobicContact CG-CZ2 4.42Å; P57-W74 HydrophobicContact CG-CZ3 4.22Å
58	E	89	Confident	90.1	Very high	36 Å²	36	75.7 Å²	75.7	17%	0.168	37%	0.368	C	S	.	.	H	α-helix	trans	-71.8	-42	179.4	-169.4	175.7	-179.7	0	0	111.6	L55 L56 C60 L61 R62 G79 Y84	L55-E58 PolarHBondContact O-N 3.08Å; L56-E58 VanDerWaalsContact C-N 3.29Å; L56-E58 PolarHBondContact O-N 3.18Å; E58-C60 PolarHBondContact O-N 3.39Å; E58-L61 PolarHBondContact O-N 3.35Å; E58-R62 VanDerWaalsContact O-CG 3.31Å; E58-R62 WeakPolarHBondContact O-CG 3.48Å; E58-R62 PolarHBondContact O-N 3.33Å; E58-R62 IonicContact OE1-CZ 2.8Å; E58-R62 VanDerWaalsContact OE1-CZ 3.29Å; E58-R62 IonicContact OE1-NE 3.29Å; E58-R62 PolarHBondContact OE1-NE 3.41Å; E58-R62 IonicContact OE1-NH2 3.69Å; E58-R62 PolarHBondContact OE1-NH2 3.28Å; E58-G79 WeakPolarHBondContact OE2-CA 3.48Å; E58-G79 PolarHBondContact OE2-N 3.3Å; E58-Y84 WeakPolarHBondContact CG-OH 3.39Å; E58-Y84 PolarHBondContact OE1-OH 3.45Å; E58-Y84 PolarHBondContact OE2-OH 2.99Å
59	L	89.9	Confident	89.3	Confident	26 Å²	26	80 Å²	80	14%	0.136	39%	0.393	C	S	.	.	H	α-helix	trans	-61.1	-43.9	174.5	-72	173.3	0	0	0	111.6	F52 L55 L56 L61 R62 L63 Y84 F88	F52-L59 HydrophobicContact CD2-CD1 4.26Å; F52-L59 HydrophobicContact CE2-CD1 4.22Å; L55-L59 HydrophobicContact CB-CD1 3.95Å; L55-L59 HydrophobicContact CB-CG 4.24Å; L55-L59 WeakPolarHBondContact O-CG 3.32Å; L55-L59 PolarHBondContact O-N 3.38Å; L56-L59 PolarHBondContact O-N 3Å; L59-L61 VanDerWaalsContact C-N 3.32Å; L59-L61 PolarHBondContact O-N 3.05Å; L59-R62 PolarHBondContact O-N 3.09Å; L59-L63 WeakPolarHBondContact O-CB 3.4Å; L59-L63 VanDerWaalsContact O-CG 3.25Å; L59-L63 WeakPolarHBondContact O-CG 3.41Å; L59-L63 PolarHBondContact O-N 3.3Å; L59-Y84 HydrophobicContact CD2-CE1 3.97Å; L59-F88 HydrophobicContact CD2-CZ 4.4Å
60	C	89.2	Confident	88.5	Confident	24 Å²	24	79.7 Å²	79.7	16%	0.162	39%	0.387	C	S	.	.	H	α-helix	trans	-59.5	-43.5	175.7	-74.2	0	0	0	0	111.7	L56 E58 L63 G64 F65 T67	L56-C60 WeakPolarHBondContact O-CB 3.34Å; L56-C60 PolarHBondContact O-N 2.99Å; L56-C60 PolarHBondContact O-SG 2.92Å; E58-C60 PolarHBondContact O-N 3.39Å; C60-L63 PolarHBondContact O-N 2.95Å; C60-G64 PolarHBondContact O-N 3.4Å; C60-F65 HydrophobicContact CB-CB 4.29Å; C60-F65 HydrophobicContact CB-CD2 4.36Å; C60-F65 WeakPolarHBondContact O-CB 3.49Å; C60-F65 WeakPolarHBondContact O-CD2 3.41Å; C60-F65 PolarHBondContact O-N 3.05Å; C60-T67 HydrophobicContact CB-CG2 3.82Å; C60-T67 WeakPolarHBondContact CB-OG1 3.3Å
61	L	88.1	Confident	87.8	Confident	79 Å²	79	77.4 Å²	77.4	41%	0.414	38%	0.377	S	S	.	.	H	α-helix	trans	-64	-43.8	177.7	-173.7	68.3	0	0	0	111.4	P57 E58 L59 L63 G64 T67 V71	P57-L61 PolarHBondContact O-N 3.39Å; P57-L61 VanDerWaalsContact O-N 3.11Å; E58-L61 PolarHBondContact O-N 3.35Å; L59-L61 VanDerWaalsContact C-N 3.32Å; L59-L61 PolarHBondContact O-N 3.05Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 2.9Å; L61-G64 PolarHBondContact O-N 2.82Å; L61-G64 VanDerWaalsContact O-N 3.09Å; L61-T67 PolarHBondContact N-OG1 2.92Å; L61-V71 HydrophobicContact CB-CG2 4.12Å; L61-V71 HydrophobicContact CD2-CG2 4.2Å
62	R	87.5	Confident	87.2	Confident	149 Å²	149	84.1 Å²	84.1	56%	0.562	41%	0.409	S	S	*	.	H	α-helix	trans	-65.8	-31.6	177.7	-70.6	175.9	-177.3	-162.4	2.8	113	E58 L59 G64 Y84	E58-R62 VanDerWaalsContact O-CG 3.31Å; E58-R62 WeakPolarHBondContact O-CG 3.48Å; E58-R62 PolarHBondContact O-N 3.33Å; E58-R62 IonicContact OE1-CZ 2.8Å; E58-R62 VanDerWaalsContact OE1-CZ 3.29Å; E58-R62 IonicContact OE1-NE 3.29Å; E58-R62 PolarHBondContact OE1-NE 3.41Å; E58-R62 IonicContact OE1-NH2 3.69Å; E58-R62 PolarHBondContact OE1-NH2 3.28Å; L59-R62 PolarHBondContact O-N 3.09Å; R62-G64 PolarHBondContact O-N 3.42Å; R62-Y84 PolarHBondContact NH2-OH 3.37Å
63	L	89.9	Confident	86.7	Confident	131 Å²	131	88.1 Å²	88.1	69%	0.686	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	0.9	174.1	-69.3	172.7	0	0	0	113.2	L59 C60 L61 F65	L59-L63 WeakPolarHBondContact O-CB 3.4Å; L59-L63 VanDerWaalsContact O-CG 3.25Å; L59-L63 WeakPolarHBondContact O-CG 3.41Å; L59-L63 PolarHBondContact O-N 3.3Å; C60-L63 PolarHBondContact O-N 2.95Å; L61-L63 VanDerWaalsContact C-N 3.32Å; L61-L63 PolarHBondContact O-N 2.9Å; L63-F65 HydrophobicContact CB-CD2 3.8Å; L63-F65 HydrophobicContact CB-CE2 3.82Å; L63-F65 HydrophobicContact CD1-CE2 4.23Å
64	G	88.1	Confident	86.4	Confident	67 Å²	67	89.9 Å²	89.9	69%	0.691	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	8.7	176.5	0	0	0	0	0	114.6	C60 L61 R62	C60-G64 PolarHBondContact O-N 3.4Å; L61-G64 PolarHBondContact O-N 2.82Å; L61-G64 VanDerWaalsContact O-N 3.09Å; R62-G64 PolarHBondContact O-N 3.42Å
65	F	85.2	Confident	86	Confident	125 Å²	125	89.8 Å²	89.8	55%	0.548	43%	0.428	S	S	.	.			trans	-71.2	143.9	172.6	-64.2	-77.7	0	0	0	110.5	C60 L63 T67	C60-F65 HydrophobicContact CB-CB 4.29Å; C60-F65 HydrophobicContact CB-CD2 4.36Å; C60-F65 WeakPolarHBondContact O-CB 3.49Å; C60-F65 WeakPolarHBondContact O-CD2 3.41Å; C60-F65 PolarHBondContact O-N 3.05Å; L63-F65 HydrophobicContact CB-CD2 3.8Å; L63-F65 HydrophobicContact CB-CE2 3.82Å; L63-F65 HydrophobicContact CD1-CE2 4.23Å; F65-T67 HydrophobicContact CB-CG2 4Å; F65-T67 PolarHBondContact O-N 3.31Å
66	R	82.7	Confident	85.6	Confident	251 Å²	251	91.2 Å²	91.2	95%	0.947	44%	0.435	S	S	*	.	S	Bend	trans	-76.9	63	177	-168.8	-179.2	-90.3	-162.9	-4.7	111
67	T	79.1	Confident	85.4	Confident	28 Å²	28	90.7 Å²	90.7	17%	0.172	43%	0.434	C	S	.	.			trans	-105.4	20.6	-179.1	53.6	0	0	0	0	113.1	C60 L61 F65 L69 M70 V71	C60-T67 HydrophobicContact CB-CG2 3.82Å; C60-T67 WeakPolarHBondContact CB-OG1 3.3Å; L61-T67 PolarHBondContact N-OG1 2.92Å; F65-T67 HydrophobicContact CB-CG2 4Å; F65-T67 PolarHBondContact O-N 3.31Å; T67-L69 PolarHBondContact O-N 3.24Å; T67-M70 HydrophobicContact CG2-CE 4.46Å; T67-M70 WeakPolarHBondContact O-CA 3.48Å; T67-M70 WeakPolarHBondContact O-CB 3.37Å; T67-M70 PolarHBondContact O-N 3.45Å; T67-V71 PolarHBondContact O-N 3.43Å
68	R	79.2	Confident	85.3	Confident	195 Å²	195	98.6 Å²	98.6	74%	0.736	47%	0.471	S	S	*	.	H	α-helix	trans	-52.4	-40.8	-179.3	-171.2	176.1	-177.3	164.6	1.7	112.8	M70 V71 E72	R68-M70 VanDerWaalsContact C-N 3.32Å; R68-M70 PolarHBondContact O-N 2.97Å; R68-V71 PolarHBondContact O-N 2.83Å; R68-E72 WeakPolarHBondContact O-CB 3.42Å; R68-E72 PolarHBondContact O-N 2.89Å
69	L	80.2	Confident	85.2	Confident	126 Å²	126	97.6 Å²	97.6	66%	0.66	47%	0.471	S	S	*	.	H	α-helix	trans	-64.9	-33.7	176.2	-67.6	173.4	0	0	0	113.1	T67 K73	T67-L69 PolarHBondContact O-N 3.24Å; L69-K73 WeakPolarHBondContact O-CG 3.33Å; L69-K73 PolarHBondContact O-N 3.3Å
70	M	80.8	Confident	85.4	Confident	78 Å²	78	99.9 Å²	99.9	38%	0.384	48%	0.481	S	S	.	.	H	α-helix	trans	-71	-37.7	176.8	-168.7	168.9	85.2	0	0	110.9	L56 P57 T67 R68 W74	L56-M70 HydrophobicContact CG-CE 4.39Å; P57-M70 HydrophobicContact CB-CE 3.71Å; P57-M70 HydrophobicContact CB-CG 4.25Å; P57-M70 HydrophobicContact CG-CE 3.85Å; P57-M70 HydrophobicContact CG-CG 4.37Å; T67-M70 HydrophobicContact CG2-CE 4.46Å; T67-M70 WeakPolarHBondContact O-CA 3.48Å; T67-M70 WeakPolarHBondContact O-CB 3.37Å; T67-M70 PolarHBondContact O-N 3.45Å; R68-M70 VanDerWaalsContact C-N 3.32Å; R68-M70 PolarHBondContact O-N 2.97Å; M70-W74 WeakPolarHBondContact O-CB 3.42Å; M70-W74 PolarHBondContact O-N 3.24Å
71	V	82.5	Confident	85.6	Confident	50 Å²	50	105.9 Å²	105.9	30%	0.303	51%	0.51	S	S	.	.	H	α-helix	trans	-68.7	-41.8	175.7	177.1	0	0	0	0	111.2	P57 L61 T67 R68 K73 W74	P57-V71 HydrophobicContact CB-CG2 3.81Å; P57-V71 VanDerWaalsContact O-CG2 3.25Å; P57-V71 WeakPolarHBondContact O-CG2 3.38Å; L61-V71 HydrophobicContact CB-CG2 4.12Å; L61-V71 HydrophobicContact CD2-CG2 4.2Å; T67-V71 PolarHBondContact O-N 3.43Å; R68-V71 PolarHBondContact O-N 2.83Å; V71-K73 VanDerWaalsContact C-N 3.35Å; V71-K73 PolarHBondContact O-N 2.94Å; V71-W74 WeakPolarHBondContact O-CB 3.44Å; V71-W74 PolarHBondContact O-N 2.84Å; V71-W74 VanDerWaalsContact O-N 3.1Å
72	E	82.7	Confident	86	Confident	147 Å²	147	103 Å²	103	69%	0.687	49%	0.494	S	S	*	.	H	α-helix	trans	-65.3	-37.2	179.5	-174.8	178	177.7	0	0	112.7	R68 W74	R68-E72 WeakPolarHBondContact O-CB 3.42Å; R68-E72 PolarHBondContact O-N 2.89Å; E72-W74 PolarHBondContact O-N 3.48Å
73	K	85.3	Confident	86.4	Confident	177 Å²	177	96 Å²	96	77%	0.77	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-4.2	174.7	-67.3	-176.8	-179.9	-174.8	0	113.3	L69 V71 P75	L69-K73 WeakPolarHBondContact O-CG 3.33Å; L69-K73 PolarHBondContact O-N 3.3Å; V71-K73 VanDerWaalsContact C-N 3.35Å; V71-K73 PolarHBondContact O-N 2.94Å; K73-P75 WeakPolarHBondContact O-CD 3.38Å
74	W	87.1	Confident	86.7	Confident	84 Å²	84	91 Å²	91	32%	0.318	44%	0.44	S	S	.	.			trans	-75.9	121.5	-175.4	-164.8	-119.7	0	0	0	110.1	R54 P57 M70 V71 E72 F76	R54-W74 PolarHBondContact O-NE1 3.49Å; P57-W74 HydrophobicContact CB-CG 4.41Å; P57-W74 HydrophobicContact CG-CD2 3.56Å; P57-W74 HydrophobicContact CG-CE3 3.73Å; P57-W74 HydrophobicContact CG-CG 3.9Å; P57-W74 HydrophobicContact CG-CZ2 4.42Å; P57-W74 HydrophobicContact CG-CZ3 4.22Å; M70-W74 WeakPolarHBondContact O-CB 3.42Å; M70-W74 PolarHBondContact O-N 3.24Å; V71-W74 WeakPolarHBondContact O-CB 3.44Å; V71-W74 PolarHBondContact O-N 2.84Å; V71-W74 VanDerWaalsContact O-N 3.1Å; E72-W74 PolarHBondContact O-N 3.48Å; W74-F76 VanDerWaalsContact C-N 3.28Å; W74-F76 HydrophobicContact CD2-CD2 4.35Å; W74-F76 AromaticContact CE2-CD2 3.56Å; W74-F76 HydrophobicContact CH2-CD2 4.41Å; W74-F76 HydrophobicContact CH2-CE2 4.48Å; W74-F76 AromaticContact CZ2-CD2 3.55Å; W74-F76 HydrophobicContact CZ2-CD2 3.55Å; W74-F76 AromaticContact CZ2-CE2 3.94Å; W74-F76 HydrophobicContact CZ2-CE2 3.94Å; W74-F76 AromaticContact NE1-CD2 3.64Å; W74-F76 AromaticContact NE1-CG 3.98Å; W74-F76 PolarHBondContact O-N 3.39Å
75	P	83.1	Confident	87.2	Confident	48 Å²	48	91 Å²	91	31%	0.312	43%	0.426	S	S	.	.			trans	-78.1	-11.6	-172.3	29.6	-35.1	0	0	0	113.9	K73 F148	K73-P75 WeakPolarHBondContact O-CD 3.38Å; P75-F148 HydrophobicContact CB-CD2 4.25Å; P75-F148 HydrophobicContact CG-CD2 3.5Å; P75-F148 HydrophobicContact CG-CE2 3.9Å
76	F	86	Confident	87.8	Confident	34 Å²	34	85 Å²	85	15%	0.149	40%	0.4	C	S	.	.	S	Bend	trans	-88.6	148.7	-179.2	-65.1	-91.3	0	0	0	111.1	W74 F148 V153	W74-F76 VanDerWaalsContact C-N 3.28Å; W74-F76 HydrophobicContact CD2-CD2 4.35Å; W74-F76 AromaticContact CE2-CD2 3.56Å; W74-F76 HydrophobicContact CH2-CD2 4.41Å; W74-F76 HydrophobicContact CH2-CE2 4.48Å; W74-F76 AromaticContact CZ2-CD2 3.55Å; W74-F76 HydrophobicContact CZ2-CD2 3.55Å; W74-F76 AromaticContact CZ2-CE2 3.94Å; W74-F76 HydrophobicContact CZ2-CE2 3.94Å; W74-F76 AromaticContact NE1-CD2 3.64Å; W74-F76 AromaticContact NE1-CG 3.98Å; W74-F76 PolarHBondContact O-N 3.39Å; F76-F148 AromaticContact CE2-CD2 3.6Å; F76-F148 HydrophobicContact CE2-CD2 3.6Å; F76-F148 AromaticContact CE2-CE2 3.8Å; F76-F148 HydrophobicContact CE2-CE2 3.8Å; F76-F148 HydrophobicContact CE2-CG 4.22Å; F76-F148 HydrophobicContact CZ-CB 4.26Å; F76-F148 HydrophobicContact CZ-CD1 4.46Å; F76-F148 AromaticContact CZ-CD2 3.79Å; F76-F148 HydrophobicContact CZ-CD2 3.79Å; F76-F148 HydrophobicContact CZ-CE2 4.21Å; F76-F148 AromaticContact CZ-CG 3.92Å; F76-F148 HydrophobicContact CZ-CG 3.92Å; F76-V153 HydrophobicContact CD1-CG1 3.57Å; F76-V153 HydrophobicContact CD1-CG2 4.09Å; F76-V153 HydrophobicContact CE1-CG1 3.82Å; F76-V153 HydrophobicContact CE1-CG2 4.06Å
77	P	87.2	Confident	88.5	Confident	46 Å²	46	73.9 Å²	73.9	30%	0.299	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-61.3	167	170.4	28.3	-35.2	0	0	0	111.3
78	Q	88	Confident	89.3	Confident	170 Å²	170	77.2 Å²	77.2	79%	0.794	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-56.1	146.1	173.9	-67.3	-179.5	-14.3	0	0	111.2	E80	Q78-E80 PolarHBondContact O-N 2.96Å
79	G	88.3	Confident	90.1	Very high	15 Å²	15	68.3 Å²	68.3	16%	0.155	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-65.6	128.9	-175.7	0	0	0	0	0	112.2	E58 E83 Y84	E58-G79 WeakPolarHBondContact OE2-CA 3.48Å; E58-G79 PolarHBondContact OE2-N 3.3Å; G79-E83 WeakPolarHBondContact CA-OE2 3.39Å; G79-Y84 WeakPolarHBondContact O-CE2 3.35Å
80	E	92.6	Very high	90.9	Very high	74 Å²	74	62.4 Å²	62.4	35%	0.346	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-79	154.2	176.6	-63.7	-171.4	159.4	0	0	110.8	Q78 W82 E83 Y84 N131	Q78-E80 PolarHBondContact O-N 2.96Å; E80-W82 PolarHBondContact O-N 2.85Å; E80-W82 PolarHBondContact OE2-NE1 3.49Å; E80-E83 HydrophobicContact CB-CG 4.27Å; E80-E83 PolarHBondContact N-OE2 2.79Å; E80-E83 WeakPolarHBondContact O-CB 3.18Å; E80-E83 PolarHBondContact O-N 3.24Å; E80-Y84 VanDerWaalsContact O-CD2 3.31Å; E80-Y84 WeakPolarHBondContact O-CD2 3.29Å; E80-N131 PolarHBondContact OE2-ND2 3.19Å
81	L	94.5	Very high	91.7	Very high	149 Å²	149	61.2 Å²	61.2	78%	0.78	30%	0.304	S	S	*	.	H	α-helix	trans	-55.9	-38.4	-177.9	-70.8	176	0	0	0	113	E83 Y84 V85	L81-E83 PolarHBondContact O-N 2.93Å; L81-Y84 PolarHBondContact O-N 2.83Å; L81-V85 VanDerWaalsContact O-CG2 3.3Å; L81-V85 WeakPolarHBondContact O-CG2 3.31Å; L81-V85 PolarHBondContact O-N 2.97Å
82	W	96.1	Very high	92.4	Very high	18 Å²	18	64.9 Å²	64.9	7%	0.068	32%	0.316	C	S	.	.	H	α-helix	trans	-63.1	-27.4	-179.1	71.5	-96.9	0	0	0	112.4	M51 E80 V85 W86 V126 F160 F161	M51-W82 HydrophobicContact CE-CH2 4.32Å; M51-W82 HydrophobicContact CE-CZ3 4.33Å; E80-W82 PolarHBondContact O-N 2.85Å; E80-W82 PolarHBondContact OE2-NE1 3.49Å; W82-V85 PolarHBondContact O-N 3.31Å; W82-W86 HydrophobicContact CE3-CB 4.45Å; W82-W86 WeakPolarHBondContact O-CB 3.38Å; W82-W86 PolarHBondContact O-N 2.98Å; W82-V126 HydrophobicContact CB-CG1 4.3Å; W82-F160 HydrophobicContact CZ3-CE1 4.4Å; W82-F161 HydrophobicContact CE3-CE1 4.27Å; W82-F161 HydrophobicContact CH2-CD1 4.31Å; W82-F161 AromaticContact CH2-CE1 3.23Å; W82-F161 HydrophobicContact CH2-CE1 3.23Å; W82-F161 AromaticContact CH2-CZ 3.66Å; W82-F161 HydrophobicContact CH2-CZ 3.66Å; W82-F161 AromaticContact CZ2-CE1 3.64Å; W82-F161 HydrophobicContact CZ2-CE1 3.64Å; W82-F161 AromaticContact CZ2-CZ 3.57Å; W82-F161 HydrophobicContact CZ2-CZ 3.57Å; W82-F161 HydrophobicContact CZ3-CD1 4.49Å; W82-F161 AromaticContact CZ3-CE1 3.58Å; W82-F161 HydrophobicContact CZ3-CE1 3.58Å; W82-F161 HydrophobicContact CZ3-CZ 4.36Å
83	E	96.3	Very high	93.1	Very high	4 Å²	4	58 Å²	58	2%	0.019	28%	0.284	C	S	.	.	H	α-helix	trans	-72	-43.5	-178.5	-58.7	172	164.7	0	0	110.6	M51 R54 L55 G79 E80 L81 W86 F87	M51-E83 HydrophobicContact SD-CB 4.21Å; R54-E83 IonicContact CZ-OE1 2.77Å; R54-E83 IonicContact CZ-OE2 2.64Å; R54-E83 IonicContact NH1-OE1 2.63Å; R54-E83 PolarHBondContact NH1-OE1 3.02Å; R54-E83 IonicContact NH1-OE2 3.31Å; R54-E83 PolarHBondContact NH1-OE2 3.32Å; R54-E83 VanDerWaalsContact NH2-CD 3.32Å; R54-E83 IonicContact NH2-OE1 3.13Å; R54-E83 PolarHBondContact NH2-OE1 2.82Å; R54-E83 IonicContact NH2-OE2 3.43Å; R54-E83 PolarHBondContact NH2-OE2 3.48Å; L55-E83 HydrophobicContact CD1-CB 4.41Å; L55-E83 HydrophobicContact CD2-CB 4.33Å; G79-E83 WeakPolarHBondContact CA-OE2 3.39Å; E80-E83 HydrophobicContact CB-CG 4.27Å; E80-E83 PolarHBondContact N-OE2 2.79Å; E80-E83 WeakPolarHBondContact O-CB 3.18Å; E80-E83 PolarHBondContact O-N 3.24Å; L81-E83 PolarHBondContact O-N 2.93Å; E83-W86 PolarHBondContact O-N 3.46Å; E83-F87 WeakPolarHBondContact O-CB 3.12Å; E83-F87 PolarHBondContact O-N 3.13Å
84	Y	96.3	Very high	93.7	Very high	24 Å²	24	50 Å²	50	9%	0.094	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-46.1	172.9	-68.3	-73.7	0	0	0	111.4	L55 E58 L59 R62 G79 E80 L81 W86 F87 F88	L55-Y84 HydrophobicContact CD1-CD1 4.14Å; L55-Y84 HydrophobicContact CD1-CE1 4.15Å; L55-Y84 HydrophobicContact CD2-CE1 4.22Å; L55-Y84 HydrophobicContact CD2-CE2 4.37Å; E58-Y84 WeakPolarHBondContact CG-OH 3.39Å; E58-Y84 PolarHBondContact OE1-OH 3.45Å; E58-Y84 PolarHBondContact OE2-OH 2.99Å; L59-Y84 HydrophobicContact CD2-CE1 3.97Å; R62-Y84 PolarHBondContact NH2-OH 3.37Å; G79-Y84 WeakPolarHBondContact O-CE2 3.35Å; E80-Y84 VanDerWaalsContact O-CD2 3.31Å; E80-Y84 WeakPolarHBondContact O-CD2 3.29Å; L81-Y84 PolarHBondContact O-N 2.83Å; Y84-W86 VanDerWaalsContact C-N 3.35Å; Y84-F87 PolarHBondContact O-N 3.29Å; Y84-F88 HydrophobicContact CD1-CE2 4.14Å; Y84-F88 WeakPolarHBondContact O-CD2 3.18Å; Y84-F88 PolarHBondContact O-N 3.03Å
85	V	97.6	Very high	94.1	Very high	68 Å²	68	50.1 Å²	50.1	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-65	-40.8	178.9	-179.5	0	0	0	0	110.6	L81 W82 G89 F119 T123	L81-V85 VanDerWaalsContact O-CG2 3.3Å; L81-V85 WeakPolarHBondContact O-CG2 3.31Å; L81-V85 PolarHBondContact O-N 2.97Å; W82-V85 PolarHBondContact O-N 3.31Å; V85-G89 WeakPolarHBondContact O-CA 3.43Å; V85-G89 PolarHBondContact O-N 3.48Å; V85-F119 HydrophobicContact CG1-CD1 4.15Å; V85-T123 HydrophobicContact CB-CG2 4.19Å; V85-T123 HydrophobicContact CG1-CG2 3.53Å
86	W	98	Very high	94.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-48.9	175	-177.2	94.2	0	0	0	111.1	L47 W48 M51 W82 E83 Y84 S90 T123 F160 C164 H168	L47-W86 HydrophobicContact CB-CH2 3.81Å; L47-W86 HydrophobicContact CB-CZ2 4.43Å; W48-W86 AromaticContact CD1-CH2 3.7Å; W48-W86 AromaticContact CD1-CZ3 3.69Å; M51-W86 HydrophobicContact CB-CE3 4.33Å; M51-W86 HydrophobicContact CB-CZ3 3.8Å; M51-W86 HydrophobicContact CE-CE3 4.39Å; M51-W86 HydrophobicContact CG-CE3 4.08Å; M51-W86 HydrophobicContact CG-CZ3 4.07Å; W82-W86 HydrophobicContact CE3-CB 4.45Å; W82-W86 WeakPolarHBondContact O-CB 3.38Å; W82-W86 PolarHBondContact O-N 2.98Å; E83-W86 PolarHBondContact O-N 3.46Å; Y84-W86 VanDerWaalsContact C-N 3.35Å; W86-S90 WeakPolarHBondContact O-CB 3.23Å; W86-S90 PolarHBondContact O-N 3.46Å; W86-S90 PolarHBondContact O-OG 2.87Å; W86-T123 VanDerWaalsContact CD1-OG1 3.26Å; W86-F160 HydrophobicContact CD2-CZ 4.5Å; W86-F160 HydrophobicContact CE3-CZ 4.19Å; W86-F160 HydrophobicContact CH2-CE2 4.38Å; W86-F160 AromaticContact CH2-CZ 3.74Å; W86-F160 HydrophobicContact CH2-CZ 3.74Å; W86-F160 HydrophobicContact CZ2-CZ 4.01Å; W86-F160 AromaticContact CZ3-CZ 3.82Å; W86-F160 HydrophobicContact CZ3-CZ 3.82Å; W86-C164 WeakPolarHBondContact CZ2-SG 3.19Å; W86-H168 AromaticContact CE2-NE2 3.54Å; W86-H168 AromaticContact CZ2-NE2 3.57Å; W86-H168 AromaticContact NE1-CD2 3.87Å; W86-H168 AromaticContact NE1-NE2 3.08Å; W86-H168 PolarHBondContact NE1-NE2 3.15Å
87	F	97	Very high	95.4	Very high	17 Å²	17	49.9 Å²	49.9	8%	0.075	25%	0.251	C	S	.	.	H	α-helix	trans	-61.9	-57.2	-176.5	178.5	-108.7	0	0	0	111.6	W48 M51 F52 L55 E83 Y84 I91	W48-F87 HydrophobicContact CB-CE2 4.12Å; W48-F87 WeakPolarHBondContact O-CE2 3.49Å; M51-F87 HydrophobicContact CB-CD2 4.06Å; M51-F87 HydrophobicContact CG-CB 3.99Å; M51-F87 HydrophobicContact CG-CD2 4.01Å; M51-F87 HydrophobicContact CG-CG 4.3Å; F52-F87 HydrophobicContact CB-CE2 3.75Å; F52-F87 HydrophobicContact CB-CZ 3.83Å; F52-F87 HydrophobicContact CD2-CE1 4.23Å; F52-F87 HydrophobicContact CD2-CE2 4.46Å; F52-F87 AromaticContact CD2-CZ 3.69Å; F52-F87 HydrophobicContact CD2-CZ 3.69Å; F52-F87 HydrophobicContact CG-CZ 4.19Å; L55-F87 HydrophobicContact CD1-CB 4.25Å; L55-F87 HydrophobicContact CD1-CG 4.46Å; E83-F87 WeakPolarHBondContact O-CB 3.12Å; E83-F87 PolarHBondContact O-N 3.13Å; Y84-F87 PolarHBondContact O-N 3.29Å; F87-I91 WeakPolarHBondContact O-CD1 3.21Å; F87-I91 VanDerWaalsContact O-CG1 3.31Å; F87-I91 WeakPolarHBondContact O-CG1 3.46Å
88	F	96.5	Very high	95.9	Very high	97 Å²	97	53 Å²	53	43%	0.425	26%	0.257	S	S	.	.	H	α-helix	trans	-75.7	-39.8	-178.5	-68.8	-67.8	0	0	0	112.5	L59 Y84 I91 F92	L59-F88 HydrophobicContact CD2-CZ 4.4Å; Y84-F88 HydrophobicContact CD1-CE2 4.14Å; Y84-F88 WeakPolarHBondContact O-CD2 3.18Å; Y84-F88 PolarHBondContact O-N 3.03Å; F88-I91 PolarHBondContact O-N 2.96Å; F88-F92 WeakPolarHBondContact O-CD2 3.07Å
89	G	96.9	Very high	96.3	Very high	9 Å²	9	47.7 Å²	47.7	9%	0.093	23%	0.233	C	C	.	.	H	α-helix	trans	-69.9	-35.4	-176.6	0	0	0	0	0	113.3	V85 I91 P93	V85-G89 WeakPolarHBondContact O-CA 3.43Å; V85-G89 PolarHBondContact O-N 3.48Å; G89-I91 VanDerWaalsContact C-N 3.3Å; G89-I91 PolarHBondContact O-N 3.23Å; G89-P93 WeakPolarHBondContact O-CD 3.42Å
90	S	96.9	Very high	96.7	Very high	1 Å²	1	47 Å²	47	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-76.5	-14	-179.4	70.5	0	0	0	0	114.2	W48 W86 P93 T94	W48-S90 WeakPolarHBondContact CZ2-O 3.31Å; W48-S90 PolarHBondContact NE1-OG 3.29Å; W86-S90 WeakPolarHBondContact O-CB 3.23Å; W86-S90 PolarHBondContact O-N 3.46Å; W86-S90 PolarHBondContact O-OG 2.87Å; S90-P93 WeakPolarHBondContact O-CD 3.44Å; S90-T94 PolarHBondContact O-N 3.29Å; S90-T94 PolarHBondContact O-OG1 3.49Å
91	I	97.6	Very high	96.8	Very high	54 Å²	54	43.7 Å²	43.7	28%	0.277	21%	0.211	S	C	.	.	H	α-helix	trans	-62.6	-47.8	175.3	-69.1	166.3	0	0	0	111.6	W48 F87 F88 G89 T94 L95	W48-I91 HydrophobicContact CD2-CG1 4.07Å; W48-I91 HydrophobicContact CE3-CG1 4.26Å; W48-I91 HydrophobicContact CH2-CB 4.21Å; W48-I91 HydrophobicContact CH2-CG1 3.99Å; W48-I91 HydrophobicContact CH2-CG2 4.38Å; W48-I91 VanDerWaalsContact CZ2-CA 3.4Å; W48-I91 HydrophobicContact CZ2-CB 4.2Å; W48-I91 HydrophobicContact CZ2-CG1 3.83Å; W48-I91 HydrophobicContact CZ3-CG1 4.21Å; F87-I91 WeakPolarHBondContact O-CD1 3.21Å; F87-I91 VanDerWaalsContact O-CG1 3.31Å; F87-I91 WeakPolarHBondContact O-CG1 3.46Å; F88-I91 PolarHBondContact O-N 2.96Å; G89-I91 VanDerWaalsContact C-N 3.3Å; G89-I91 PolarHBondContact O-N 3.23Å; I91-T94 PolarHBondContact O-N 3.02Å; I91-L95 WeakPolarHBondContact O-CB 3.48Å; I91-L95 PolarHBondContact O-N 3.41Å
92	F	96.2	Very high	96.6	Very high	126 Å²	126	43.4 Å²	43.4	55%	0.553	21%	0.205	S	C	*	.	H	α-helix	trans	-63	-48.3	-175.3	-57.3	-81.9	0	0	0	113.6	F88 T94 L95 F96	F88-F92 WeakPolarHBondContact O-CD2 3.07Å; F92-T94 VanDerWaalsContact C-N 3.33Å; F92-T94 PolarHBondContact O-N 3.18Å; F92-L95 PolarHBondContact O-N 2.94Å; F92-F96 HydrophobicContact CB-CE2 4.46Å; F92-F96 WeakPolarHBondContact O-CD2 3.48Å; F92-F96 WeakPolarHBondContact O-CG 3.39Å; F92-F96 PolarHBondContact O-N 2.61Å
93	P	97.7	Very high	96.3	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-58.3	-42.6	176.5	-23.4	32.5	0	0	0	112.9	G89 S90 G97 S112 G115 F119	G89-P93 WeakPolarHBondContact O-CD 3.42Å; S90-P93 WeakPolarHBondContact O-CD 3.44Å; P93-G97 PolarHBondContact O-N 3.41Å; P93-S112 VanDerWaalsContact O-CB 3.25Å; P93-S112 WeakPolarHBondContact O-CB 3.46Å; P93-S112 PolarHBondContact O-OG 3.14Å; P93-G115 WeakPolarHBondContact CG-O 3.05Å; P93-F119 HydrophobicContact CG-CD2 4.35Å
94	T	97.3	Very high	96	Very high	7 Å²	7	53.1 Å²	53.1	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-66.4	-40.9	178.6	-64.1	0	0	0	0	111.5	Y41 H44 W48 S90 I91 F92 G97 Y98	Y41-T94 HydrophobicContact CD1-CG2 3.74Å; Y41-T94 HydrophobicContact CE1-CG2 4.34Å; Y41-T94 HydrophobicContact CG-CG2 4.08Å; H44-T94 HydrophobicContact CB-CG2 4.18Å; W48-T94 VanDerWaalsContact CH2-CB 3.49Å; W48-T94 HydrophobicContact CH2-CG2 3.46Å; W48-T94 VanDerWaalsContact CH2-CG2 3.46Å; W48-T94 HydrophobicContact CZ2-CG2 3.94Å; W48-T94 HydrophobicContact CZ3-CG2 4.34Å; S90-T94 PolarHBondContact O-N 3.29Å; S90-T94 PolarHBondContact O-OG1 3.49Å; I91-T94 PolarHBondContact O-N 3.02Å; F92-T94 VanDerWaalsContact C-N 3.33Å; F92-T94 PolarHBondContact O-N 3.18Å; T94-G97 PolarHBondContact O-N 3.01Å; T94-Y98 WeakPolarHBondContact O-CB 3.43Å; T94-Y98 PolarHBondContact O-N 3.26Å
95	L	97	Very high	95.9	Very high	87 Å²	87	57.2 Å²	57.2	46%	0.455	26%	0.263	S	S	.	.	H	α-helix	trans	-65.2	-48.3	176.9	-177.6	60.7	0	0	0	111.8	I91 F92 G97 Y98 I99	I91-L95 WeakPolarHBondContact O-CB 3.48Å; I91-L95 PolarHBondContact O-N 3.41Å; F92-L95 PolarHBondContact O-N 2.94Å; L95-G97 PolarHBondContact O-N 3.37Å; L95-Y98 PolarHBondContact O-N 2.88Å; L95-I99 HydrophobicContact CD1-CD1 4.08Å; L95-I99 HydrophobicContact CD1-CG1 4.4Å; L95-I99 HydrophobicContact CG-CD1 3.95Å; L95-I99 WeakPolarHBondContact O-CG1 3.47Å; L95-I99 PolarHBondContact O-N 3.08Å
96	F	97.7	Very high	95.7	Very high	78 Å²	78	54.5 Å²	54.5	34%	0.342	25%	0.248	S	C	.	.	H	α-helix	trans	-61.3	-37.5	174.9	-68.5	-30.1	0	0	0	112	F92 S100 V111	F92-F96 HydrophobicContact CB-CE2 4.46Å; F92-F96 WeakPolarHBondContact O-CD2 3.48Å; F92-F96 WeakPolarHBondContact O-CG 3.39Å; F92-F96 PolarHBondContact O-N 2.61Å; F96-S100 WeakPolarHBondContact O-CB 3.42Å; F96-S100 PolarHBondContact O-N 2.95Å; F96-V111 HydrophobicContact CD2-CG1 3.75Å; F96-V111 HydrophobicContact CE2-CG1 4.17Å
97	G	97.7	Very high	95.5	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.2	-50.7	172.4	0	0	0	0	0	112	Y41 P93 T94 L95 S100 L101 S112	Y41-G97 WeakPolarHBondContact OH-CA 3.49Å; P93-G97 PolarHBondContact O-N 3.41Å; T94-G97 PolarHBondContact O-N 3.01Å; L95-G97 PolarHBondContact O-N 3.37Å; G97-S100 WeakPolarHBondContact O-CB 3.39Å; G97-S100 PolarHBondContact O-N 2.9Å; G97-S100 PolarHBondContact O-OG 3.22Å; G97-L101 WeakPolarHBondContact O-CG 3.49Å; G97-L101 PolarHBondContact O-N 2.87Å; G97-S112 WeakPolarHBondContact CA-OG 3.45Å; G97-S112 PolarHBondContact N-OG 3.23Å
98	Y	97.2	Very high	95.5	Very high	112 Å²	112	58.4 Å²	58.4	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-47.4	178.3	-172	-88	0	0	0	112.5	Y41 T94 L95 S100 L101	Y41-Y98 HydrophobicContact CD2-CD2 4.06Å; T94-Y98 WeakPolarHBondContact O-CB 3.43Å; T94-Y98 PolarHBondContact O-N 3.26Å; L95-Y98 PolarHBondContact O-N 2.88Å; Y98-S100 VanDerWaalsContact C-N 3.26Å; Y98-S100 PolarHBondContact O-N 3.41Å; Y98-L101 WeakPolarHBondContact O-CB 3.41Å; Y98-L101 WeakPolarHBondContact O-CG 2.95Å; Y98-L101 PolarHBondContact O-N 3.46Å; Y98-L101 VanDerWaalsContact O-N 3.1Å
99	I	97.4	Very high	95.6	Very high	57 Å²	57	53.8 Å²	53.8	29%	0.292	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-36.9	178.1	-65.8	167.3	0	0	0	110.7	L95 L101 Q102 L108	L95-I99 HydrophobicContact CD1-CD1 4.08Å; L95-I99 HydrophobicContact CD1-CG1 4.4Å; L95-I99 HydrophobicContact CG-CD1 3.95Å; L95-I99 WeakPolarHBondContact O-CG1 3.47Å; L95-I99 PolarHBondContact O-N 3.08Å; I99-L101 PolarHBondContact O-N 3.29Å; I99-Q102 PolarHBondContact O-N 3.46Å; I99-L108 HydrophobicContact CG2-CD1 3.91Å
100	S	96	Very high	95.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-28.4	177.8	84	0	0	0	0	112.8	F96 G97 Y98 Q102 S104 R105 M109	F96-S100 WeakPolarHBondContact O-CB 3.42Å; F96-S100 PolarHBondContact O-N 2.95Å; G97-S100 WeakPolarHBondContact O-CB 3.39Å; G97-S100 PolarHBondContact O-N 2.9Å; G97-S100 PolarHBondContact O-OG 3.22Å; Y98-S100 VanDerWaalsContact C-N 3.26Å; Y98-S100 PolarHBondContact O-N 3.41Å; S100-Q102 PolarHBondContact O-N 2.66Å; S100-S104 CarbonylContact O-C 3.52Å; S100-S104 WeakPolarHBondContact O-CA 3.32Å; S100-S104 PolarHBondContact O-N 3.42Å; S100-R105 PolarHBondContact O-N 3.47Å; S100-M109 VanDerWaalsContact OG-CE 3.24Å; S100-M109 WeakPolarHBondContact OG-CE 3.47Å
101	L	95.2	Very high	95.6	Very high	6 Å²	6	64.1 Å²	64.1	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-68.7	-31.7	-177.3	-52.3	-174	0	0	0	113.1	K34 I37 K38 Y41 G97 Y98 I99 M109 L178 W182	K34-L101 WeakPolarHBondContact CE-O 3.09Å; K34-L101 PolarHBondContact NZ-O 3.01Å; I37-L101 HydrophobicContact CG2-CD1 3.74Å; I37-L101 HydrophobicContact CG2-CD2 3.7Å; I37-L101 HydrophobicContact CG2-CG 4.39Å; K38-L101 HydrophobicContact CD-CD1 4.43Å; K38-L101 HydrophobicContact CG-CD1 3.56Å; Y41-L101 HydrophobicContact CD2-CD1 4.3Å; Y41-L101 HydrophobicContact CE2-CD1 4.01Å; Y41-L101 HydrophobicContact CE2-CG 4.41Å; G97-L101 WeakPolarHBondContact O-CG 3.49Å; G97-L101 PolarHBondContact O-N 2.87Å; Y98-L101 WeakPolarHBondContact O-CB 3.41Å; Y98-L101 WeakPolarHBondContact O-CG 2.95Å; Y98-L101 PolarHBondContact O-N 3.46Å; Y98-L101 VanDerWaalsContact O-N 3.1Å; I99-L101 PolarHBondContact O-N 3.29Å; L101-M109 HydrophobicContact CD2-CE 3.65Å; L101-L178 HydrophobicContact CD2-CD1 3.99Å; L101-W182 HydrophobicContact CD2-CH2 3.77Å
102	Q	91	Very high	95.6	Very high	142 Å²	142	61.6 Å²	61.6	66%	0.664	29%	0.292	S	S	*	.	H	α-helix	trans	-63.9	-51.5	-174.9	-67.9	-177.2	-12.9	0	0	111.2	I99 S100	I99-Q102 PolarHBondContact O-N 3.46Å; S100-Q102 PolarHBondContact O-N 2.66Å
103	R	88.4	Confident	95.7	Very high	188 Å²	188	56.4 Å²	56.4	71%	0.709	27%	0.27	S	S	*	.	H	α-helix	trans	-107.5	12.2	-178.7	-62.2	-165.9	-171.4	-176	4.7	113.9	R105	R103-R105 VanDerWaalsContact C-N 3.27Å; R103-R105 HydrophobicContact CB-CG 3.95Å; R103-R105 PolarHBondContact O-N 3.35Å
104	S	91.5	Very high	95.8	Very high	39 Å²	39	60.2 Å²	60.2	27%	0.273	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	42.2	-179.1	-44.2	0	0	0	0	112.4	K34 S100 A106 W182	K34-S104 PolarHBondContact NZ-OG 3.38Å; S100-S104 CarbonylContact O-C 3.52Å; S100-S104 WeakPolarHBondContact O-CA 3.32Å; S100-S104 PolarHBondContact O-N 3.42Å; S104-A106 PolarHBondContact O-N 3.2Å; S104-A106 VanDerWaalsContact O-N 3.15Å; S104-W182 VanDerWaalsContact C-CE3 3.44Å
105	R	92.8	Very high	95.8	Very high	110 Å²	110	60.4 Å²	60.4	42%	0.415	30%	0.296	S	S	.	.			trans	-78.6	99	-173.1	-70.4	175.8	174.8	178.1	-0.7	110.4	S100 R103 G107 L108 M109	S100-R105 PolarHBondContact O-N 3.47Å; R103-R105 VanDerWaalsContact C-N 3.27Å; R103-R105 HydrophobicContact CB-CG 3.95Å; R103-R105 PolarHBondContact O-N 3.35Å; R105-G107 VanDerWaalsContact C-N 3.28Å; R105-G107 PolarHBondContact O-N 3.12Å; R105-L108 HydrophobicContact CB-CB 4.25Å; R105-L108 HydrophobicContact CB-CD1 4.25Å; R105-L108 HydrophobicContact CB-CG 4.31Å; R105-L108 PolarHBondContact O-N 3.32Å; R105-M109 PolarHBondContact O-N 2.9Å; R105-M109 VanDerWaalsContact O-N 3.11Å
106	A	93.8	Very high	95.9	Very high	10 Å²	10	56.3 Å²	56.3	8%	0.083	28%	0.275	C	S	.	.	H	α-helix	trans	-55.9	-39	-179.4	0	0	0	0	0	113.2	S104 M109 R110 Y179 W182	S104-A106 PolarHBondContact O-N 3.2Å; S104-A106 VanDerWaalsContact O-N 3.15Å; A106-M109 PolarHBondContact O-N 3.16Å; A106-R110 PolarHBondContact O-N 3.46Å; A106-Y179 HydrophobicContact CB-CD2 4.15Å; A106-Y179 HydrophobicContact CB-CE2 4.26Å; A106-Y179 WeakPolarHBondContact O-CD2 3.12Å; A106-W182 HydrophobicContact CB-CB 3.98Å
107	G	94.3	Very high	95.9	Very high	52 Å²	52	56 Å²	56	54%	0.536	28%	0.279	S	S	.	.	H	α-helix	trans	-60.7	-47.3	178.3	0	0	0	0	0	113.4	R105 M109 R110 V111	R105-G107 VanDerWaalsContact C-N 3.28Å; R105-G107 PolarHBondContact O-N 3.12Å; G107-M109 VanDerWaalsContact C-N 3.34Å; G107-M109 PolarHBondContact O-N 3.19Å; G107-R110 WeakPolarHBondContact O-CB 3.48Å; G107-R110 PolarHBondContact O-N 2.81Å; G107-V111 PolarHBondContact O-N 3.37Å; G107-V111 VanDerWaalsContact O-N 3.1Å
108	L	96.5	Very high	96	Very high	47 Å²	47	59.7 Å²	59.7	25%	0.246	30%	0.302	C	S	.	.	H	α-helix	trans	-66.9	-36.1	176.8	-69.4	-178.7	0	0	0	112.1	I99 R105 R110 V111 S112	I99-L108 HydrophobicContact CG2-CD1 3.91Å; R105-L108 HydrophobicContact CB-CB 4.25Å; R105-L108 HydrophobicContact CB-CD1 4.25Å; R105-L108 HydrophobicContact CB-CG 4.31Å; R105-L108 PolarHBondContact O-N 3.32Å; L108-R110 VanDerWaalsContact C-N 3.31Å; L108-R110 PolarHBondContact O-N 3.41Å; L108-V111 PolarHBondContact O-N 3.27Å; L108-S112 WeakPolarHBondContact O-CB 3.47Å; L108-S112 PolarHBondContact O-N 2.83Å
109	M	97.5	Very high	96	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-39.6	173.3	-176.1	57.8	78.9	0	0	111.1	I37 S100 L101 R105 A106 G107 S112 L113 G175 L178 W182	I37-M109 HydrophobicContact CD1-CE 3.96Å; I37-M109 HydrophobicContact CD1-SD 4.42Å; S100-M109 VanDerWaalsContact OG-CE 3.24Å; S100-M109 WeakPolarHBondContact OG-CE 3.47Å; L101-M109 HydrophobicContact CD2-CE 3.65Å; R105-M109 PolarHBondContact O-N 2.9Å; R105-M109 VanDerWaalsContact O-N 3.11Å; A106-M109 PolarHBondContact O-N 3.16Å; G107-M109 VanDerWaalsContact C-N 3.34Å; G107-M109 PolarHBondContact O-N 3.19Å; M109-S112 WeakPolarHBondContact O-CB 3.43Å; M109-S112 PolarHBondContact O-N 2.97Å; M109-L113 HydrophobicContact CG-CD1 4.28Å; M109-L113 HydrophobicContact CG-CG 4.46Å; M109-L113 VanDerWaalsContact O-CG 3.25Å; M109-L113 WeakPolarHBondContact O-CG 3.47Å; M109-L113 PolarHBondContact O-N 3.16Å; M109-L113 HydrophobicContact SD-CG 4.41Å; M109-G175 WeakPolarHBondContact CG-O 3.37Å; M109-L178 HydrophobicContact CE-CB 4.22Å; M109-L178 HydrophobicContact CE-CD1 4.01Å; M109-W182 HydrophobicContact CB-CE3 4.34Å; M109-W182 HydrophobicContact CB-CZ3 4.08Å; M109-W182 HydrophobicContact CE-CH2 3.9Å; M109-W182 HydrophobicContact CE-CZ3 3.74Å; M109-W182 HydrophobicContact CG-CZ3 4.38Å
110	R	97.3	Very high	96	Very high	155 Å²	155	55.8 Å²	55.8	59%	0.585	29%	0.285	S	S	*	.	H	α-helix	trans	-61.5	-46.6	174.9	-175	-179.6	175.7	-175.4	-1.4	111.9	A106 G107 L108 S112 L113 T114 Y179	A106-R110 PolarHBondContact O-N 3.46Å; G107-R110 WeakPolarHBondContact O-CB 3.48Å; G107-R110 PolarHBondContact O-N 2.81Å; L108-R110 VanDerWaalsContact C-N 3.31Å; L108-R110 PolarHBondContact O-N 3.41Å; R110-S112 VanDerWaalsContact C-N 3.31Å; R110-S112 PolarHBondContact O-N 2.91Å; R110-L113 PolarHBondContact O-N 3.2Å; R110-T114 PolarHBondContact O-N 3.32Å; R110-T114 PolarHBondContact O-OG1 3.43Å; R110-Y179 HydrophobicContact CB-CD2 4.12Å; R110-Y179 HydrophobicContact CB-CE2 3.77Å; R110-Y179 HydrophobicContact CG-CE2 4.36Å
111	V	97.9	Very high	96.1	Very high	73 Å²	73	58.2 Å²	58.2	44%	0.442	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-43.9	176.4	176	0	0	0	0	110.7	F96 G107 L108 T114 G115	F96-V111 HydrophobicContact CD2-CG1 3.75Å; F96-V111 HydrophobicContact CE2-CG1 4.17Å; G107-V111 PolarHBondContact O-N 3.37Å; G107-V111 VanDerWaalsContact O-N 3.1Å; L108-V111 PolarHBondContact O-N 3.27Å; V111-T114 PolarHBondContact O-N 2.94Å; V111-G115 PolarHBondContact O-N 3.2Å
112	S	98	Very high	96.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-56.8	-50.1	174.2	179.5	0	0	0	0	111.6	P93 G97 L108 M109 R110 T114 G115 T116	P93-S112 VanDerWaalsContact O-CB 3.25Å; P93-S112 WeakPolarHBondContact O-CB 3.46Å; P93-S112 PolarHBondContact O-OG 3.14Å; G97-S112 WeakPolarHBondContact CA-OG 3.45Å; G97-S112 PolarHBondContact N-OG 3.23Å; L108-S112 WeakPolarHBondContact O-CB 3.47Å; L108-S112 PolarHBondContact O-N 2.83Å; M109-S112 WeakPolarHBondContact O-CB 3.43Å; M109-S112 PolarHBondContact O-N 2.97Å; R110-S112 VanDerWaalsContact C-N 3.31Å; R110-S112 PolarHBondContact O-N 2.91Å; S112-T114 PolarHBondContact O-N 3.07Å; S112-G115 PolarHBondContact O-N 3Å; S112-T116 WeakPolarHBondContact O-CB 3.34Å; S112-T116 PolarHBondContact O-N 3.33Å; S112-T116 PolarHBondContact O-OG1 3.21Å
113	L	98.4	Very high	96.5	Very high	18 Å²	18	53.3 Å²	53.3	9%	0.094	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-49.9	179.5	-71.3	171.8	0	0	0	112.6	M109 R110 G115 T116 V117 V172 Y179	M109-L113 HydrophobicContact CG-CD1 4.28Å; M109-L113 HydrophobicContact CG-CG 4.46Å; M109-L113 VanDerWaalsContact O-CG 3.25Å; M109-L113 WeakPolarHBondContact O-CG 3.47Å; M109-L113 PolarHBondContact O-N 3.16Å; M109-L113 HydrophobicContact SD-CG 4.41Å; R110-L113 PolarHBondContact O-N 3.2Å; L113-G115 VanDerWaalsContact C-N 3.31Å; L113-G115 PolarHBondContact O-N 3.37Å; L113-T116 PolarHBondContact O-N 3.27Å; L113-V117 WeakPolarHBondContact O-CG2 3.44Å; L113-V117 PolarHBondContact O-N 3.31Å; L113-V172 HydrophobicContact CD2-CB 4.37Å; L113-V172 HydrophobicContact CD2-CG1 4.35Å; L113-V172 WeakPolarHBondContact CD2-O 3.46Å; L113-Y179 HydrophobicContact CD1-CG 4.43Å
114	T	98.4	Very high	97	Very high	84 Å²	84	44.4 Å²	44.4	52%	0.515	25%	0.251	S	S	.	.	H	α-helix	trans	-60.8	-44.2	177.7	-58.4	0	0	0	0	110.8	R110 V111 S112 T116 V117 V118	R110-T114 PolarHBondContact O-N 3.32Å; R110-T114 PolarHBondContact O-OG1 3.43Å; V111-T114 PolarHBondContact O-N 2.94Å; S112-T114 PolarHBondContact O-N 3.07Å; T114-T116 PolarHBondContact O-N 2.86Å; T114-V117 PolarHBondContact O-N 3.23Å; T114-V118 WeakPolarHBondContact O-CG2 3.35Å; T114-V118 PolarHBondContact O-N 3.3Å
115	G	98.3	Very high	97.3	Very high	10 Å²	10	44.4 Å²	44.4	10%	0.103	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-39.9	177.8	0	0	0	0	0	113.5	P93 V111 S112 L113 V117 V118 F119	P93-G115 WeakPolarHBondContact CG-O 3.05Å; V111-G115 PolarHBondContact O-N 3.2Å; S112-G115 PolarHBondContact O-N 3Å; L113-G115 VanDerWaalsContact C-N 3.31Å; L113-G115 PolarHBondContact O-N 3.37Å; G115-V117 VanDerWaalsContact C-N 3.33Å; G115-V117 PolarHBondContact O-N 2.87Å; G115-V118 PolarHBondContact O-N 2.96Å; G115-F119 WeakPolarHBondContact O-CB 3.48Å; G115-F119 PolarHBondContact O-N 3.1Å
116	T	98.4	Very high	97.5	Very high	1 Å²	1	43 Å²	43	1%	0.006	26%	0.257	C	S	.	.	I	π-helix	trans	-65.4	-36.7	176.6	-63.1	0	0	0	0	111.3	S112 L113 T114 G120 L121 H168 V172	S112-T116 WeakPolarHBondContact O-CB 3.34Å; S112-T116 PolarHBondContact O-N 3.33Å; S112-T116 PolarHBondContact O-OG1 3.21Å; L113-T116 PolarHBondContact O-N 3.27Å; T114-T116 PolarHBondContact O-N 2.86Å; T116-G120 CarbonylContact O-C 3.53Å; T116-G120 WeakPolarHBondContact O-CA 3.36Å; T116-G120 PolarHBondContact O-N 3.31Å; T116-L121 PolarHBondContact O-N 3.34Å; T116-H168 HydrophobicContact CG2-CB 4.05Å; T116-H168 WeakPolarHBondContact CG2-ND1 3.43Å; T116-V172 HydrophobicContact CG2-CG2 3.78Å
117	V	98.6	Very high	97.7	Very high	71 Å²	71	42.5 Å²	42.5	43%	0.43	25%	0.253	S	S	.	.	I	π-helix	trans	-66.4	-47.4	174.1	173.3	0	0	0	0	110.9	L113 T114 G115 L121 G122 V172	L113-V117 WeakPolarHBondContact O-CG2 3.44Å; L113-V117 PolarHBondContact O-N 3.31Å; T114-V117 PolarHBondContact O-N 3.23Å; G115-V117 VanDerWaalsContact C-N 3.33Å; G115-V117 PolarHBondContact O-N 2.87Å; V117-L121 PolarHBondContact O-N 3.17Å; V117-G122 PolarHBondContact O-N 2.93Å; V117-V172 HydrophobicContact CG2-CG2 3.99Å
118	V	98.3	Very high	97.9	Very high	79 Å²	79	41.5 Å²	41.5	48%	0.479	24%	0.237	S	C	.	.	I	π-helix	trans	-72.9	-58	-176.1	176.2	0	0	0	0	112.1	T114 G115 G122 T123	T114-V118 WeakPolarHBondContact O-CG2 3.35Å; T114-V118 PolarHBondContact O-N 3.3Å; G115-V118 PolarHBondContact O-N 2.96Å; V118-G122 WeakPolarHBondContact O-CA 3.39Å; V118-T123 PolarHBondContact O-N 2.83Å
119	F	97.7	Very high	97.9	Very high	86 Å²	86	47.1 Å²	47.1	38%	0.377	26%	0.26	S	S	.	.	I	π-helix	trans	-89.5	-10.9	-173.5	-62.8	-68.3	0	0	0	114.3	V85 P93 G115 T123	V85-F119 HydrophobicContact CG1-CD1 4.15Å; P93-F119 HydrophobicContact CG-CD2 4.35Å; G115-F119 WeakPolarHBondContact O-CB 3.48Å; G115-F119 PolarHBondContact O-N 3.1Å; F119-T123 PolarHBondContact O-OG1 3.33Å
120	G	97	Very high	97.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-101.9	-68.9	176.4	0	0	0	0	0	112.3	T116 T123 V124 H168	T116-G120 CarbonylContact O-C 3.53Å; T116-G120 WeakPolarHBondContact O-CA 3.36Å; T116-G120 PolarHBondContact O-N 3.31Å; G120-T123 PolarHBondContact O-OG1 2.99Å; G120-T123 VanDerWaalsContact O-OG1 3.12Å; G120-V124 WeakPolarHBondContact O-CB 3.35Å; G120-V124 WeakPolarHBondContact O-CG2 3.45Å; G120-V124 PolarHBondContact O-N 2.99Å; G120-H168 WeakPolarHBondContact CA-CE1 3.33Å
121	L	98.2	Very high	97.7	Very high	52 Å²	52	44.6 Å²	44.6	27%	0.272	26%	0.261	S	S	.	.	I	π-helix	trans	-74.3	-42.7	-178.1	-67.4	173.5	0	0	0	112.7	T116 V117 V124 A125 H168	T116-L121 PolarHBondContact O-N 3.34Å; V117-L121 PolarHBondContact O-N 3.17Å; L121-V124 PolarHBondContact O-N 3.41Å; L121-A125 WeakPolarHBondContact O-CB 3.5Å; L121-A125 PolarHBondContact O-N 3.44Å; L121-H168 HydrophobicContact CD2-CB 3.62Å; L121-H168 HydrophobicContact CG-CB 3.85Å
122	G	98	Very high	97.7	Very high	32 Å²	32	43.1 Å²	43.1	33%	0.33	26%	0.256	S	S	.	.	I	π-helix	trans	-63.1	-45.2	-178	0	0	0	0	0	112.6	V117 V118 A125 V126	V117-G122 PolarHBondContact O-N 2.93Å; V118-G122 WeakPolarHBondContact O-CA 3.39Å; G122-A125 WeakPolarHBondContact O-CB 3.36Å; G122-A125 PolarHBondContact O-N 3.39Å; G122-V126 WeakPolarHBondContact O-CG2 3.33Å; G122-V126 PolarHBondContact O-N 3.03Å
123	T	97.8	Very high	97.6	Very high	13 Å²	13	50.6 Å²	50.6	8%	0.08	29%	0.289	C	S	.	.	H	α-helix	trans	-65.8	-39.8	176.4	49.7	0	0	0	0	112.5	V85 W86 V118 F119 G120 A125 V126 G127	V85-T123 HydrophobicContact CB-CG2 4.19Å; V85-T123 HydrophobicContact CG1-CG2 3.53Å; W86-T123 VanDerWaalsContact CD1-OG1 3.26Å; V118-T123 PolarHBondContact O-N 2.83Å; F119-T123 PolarHBondContact O-OG1 3.33Å; G120-T123 PolarHBondContact O-OG1 2.99Å; G120-T123 VanDerWaalsContact O-OG1 3.12Å; T123-A125 VanDerWaalsContact C-N 3.33Å; T123-V126 PolarHBondContact O-N 2.65Å; T123-G127 PolarHBondContact O-N 2.87Å
124	V	97.9	Very high	97.4	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-42.1	172.5	168.7	0	0	0	0	110.9	G120 L121 V126 G127 C128 F161 C164 V165	G120-V124 WeakPolarHBondContact O-CB 3.35Å; G120-V124 WeakPolarHBondContact O-CG2 3.45Å; G120-V124 PolarHBondContact O-N 2.99Å; L121-V124 PolarHBondContact O-N 3.41Å; V124-V126 VanDerWaalsContact C-N 3.34Å; V124-V126 PolarHBondContact O-N 2.89Å; V124-G127 PolarHBondContact O-N 3.45Å; V124-C128 PolarHBondContact O-N 3.46Å; V124-C128 PolarHBondContact O-SG 3.14Å; V124-C128 VanDerWaalsContact O-SG 3.32Å; V124-F161 HydrophobicContact CG1-CB 4.13Å; V124-F161 HydrophobicContact CG1-CD1 3.9Å; V124-F161 HydrophobicContact CG1-CG 4.34Å; V124-C164 HydrophobicContact CG1-CB 4.43Å; V124-C164 HydrophobicContact CG2-CB 3.63Å; V124-V165 HydrophobicContact CG1-CG2 3.99Å
125	A	98.2	Very high	97.4	Very high	39 Å²	39	49.7 Å²	49.7	32%	0.322	28%	0.28	S	S	.	.	H	α-helix	trans	-60.9	-44.2	176.8	0	0	0	0	0	111.4	L121 G122 T123 G127 C128 F129	L121-A125 WeakPolarHBondContact O-CB 3.5Å; L121-A125 PolarHBondContact O-N 3.44Å; G122-A125 WeakPolarHBondContact O-CB 3.36Å; G122-A125 PolarHBondContact O-N 3.39Å; T123-A125 VanDerWaalsContact C-N 3.33Å; A125-G127 VanDerWaalsContact C-N 3.34Å; A125-G127 PolarHBondContact O-N 3.31Å; A125-C128 WeakPolarHBondContact O-CB 3.49Å; A125-C128 PolarHBondContact O-N 3.15Å; A125-F129 HydrophobicContact CB-CE2 4.47Å; A125-F129 WeakPolarHBondContact O-CD2 3.45Å; A125-F129 PolarHBondContact O-N 3.35Å
126	V	98	Very high	97.3	Very high	80 Å²	80	54 Å²	54	49%	0.485	30%	0.299	S	S	.	.	H	α-helix	trans	-59	-44.7	173.9	173.5	0	0	0	0	111.2	W82 G122 T123 V124 C128 F129 T130	W82-V126 HydrophobicContact CB-CG1 4.3Å; G122-V126 WeakPolarHBondContact O-CG2 3.33Å; G122-V126 PolarHBondContact O-N 3.03Å; T123-V126 PolarHBondContact O-N 2.65Å; V124-V126 VanDerWaalsContact C-N 3.34Å; V124-V126 PolarHBondContact O-N 2.89Å; V126-C128 PolarHBondContact O-N 3.32Å; V126-F129 PolarHBondContact O-N 3.49Å; V126-T130 HydrophobicContact CG1-CG2 4.29Å; V126-T130 WeakPolarHBondContact O-CB 3.25Å; V126-T130 WeakPolarHBondContact O-CG2 3.49Å; V126-T130 PolarHBondContact O-N 3.42Å; V126-T130 PolarHBondContact O-OG1 2.86Å
127	G	97.5	Very high	97.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.7	-45.4	174.5	0	0	0	0	0	112.8	T123 V124 A125 F129 T130 N131 F161	T123-G127 PolarHBondContact O-N 2.87Å; V124-G127 PolarHBondContact O-N 3.45Å; A125-G127 VanDerWaalsContact C-N 3.34Å; A125-G127 PolarHBondContact O-N 3.31Å; G127-F129 PolarHBondContact O-N 3.07Å; G127-T130 WeakPolarHBondContact CA-OG1 3.42Å; G127-T130 PolarHBondContact O-OG1 3.5Å; G127-N131 WeakPolarHBondContact O-CB 3.4Å; G127-N131 PolarHBondContact O-N 3.33Å; G127-N131 VanDerWaalsContact O-N 3.13Å; G127-N131 PolarHBondContact O-ND2 3.35Å; G127-F161 VanDerWaalsContact C-CZ 3.44Å
128	C	97.6	Very high	97.1	Very high	31 Å²	31	55.3 Å²	55.3	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-60.3	-43.8	175.5	-71	0	0	0	0	112.5	V124 A125 V126 A132 Y158 F161	V124-C128 PolarHBondContact O-N 3.46Å; V124-C128 PolarHBondContact O-SG 3.14Å; V124-C128 VanDerWaalsContact O-SG 3.32Å; A125-C128 WeakPolarHBondContact O-CB 3.49Å; A125-C128 PolarHBondContact O-N 3.15Å; V126-C128 PolarHBondContact O-N 3.32Å; C128-A132 WeakPolarHBondContact O-CB 3.4Å; C128-A132 PolarHBondContact O-N 3.26Å; C128-A132 VanDerWaalsContact O-N 3.09Å; C128-Y158 PolarHBondContact O-OH 3.11Å; C128-F161 HydrophobicContact CB-CD2 4.48Å; C128-F161 WeakPolarHBondContact SG-CD2 3.43Å; C128-F161 WeakPolarHBondContact SG-CG 3.41Å
129	F	97.4	Very high	97	Very high	165 Å²	165	58.3 Å²	58.3	72%	0.724	31%	0.306	S	S	*	.	H	α-helix	trans	-72.1	-41.1	-177.5	-76.9	-64.2	0	0	0	112.6	A125 V126 G127 N131 A132	A125-F129 HydrophobicContact CB-CE2 4.47Å; A125-F129 WeakPolarHBondContact O-CD2 3.45Å; A125-F129 PolarHBondContact O-N 3.35Å; V126-F129 PolarHBondContact O-N 3.49Å; G127-F129 PolarHBondContact O-N 3.07Å; F129-N131 VanDerWaalsContact C-N 3.27Å; F129-N131 PolarHBondContact O-N 3.19Å; F129-A132 WeakPolarHBondContact O-CB 3.24Å; F129-A132 PolarHBondContact O-N 2.93Å
130	T	95.3	Very high	97	Very high	83 Å²	83	60.9 Å²	60.9	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-35.7	177.4	47.6	0	0	0	0	112	V126 G127	V126-T130 HydrophobicContact CG1-CG2 4.29Å; V126-T130 WeakPolarHBondContact O-CB 3.25Å; V126-T130 WeakPolarHBondContact O-CG2 3.49Å; V126-T130 PolarHBondContact O-N 3.42Å; V126-T130 PolarHBondContact O-OG1 2.86Å; G127-T130 WeakPolarHBondContact CA-OG1 3.42Å; G127-T130 PolarHBondContact O-OG1 3.5Å
131	N	95.8	Very high	97	Very high	18 Å²	18	63.7 Å²	63.7	10%	0.096	34%	0.339	C	S	.	.	H	α-helix	trans	-91.9	-2	-179.1	-74.1	-90.7	0	0	0	114.2	E80 G127 F129 F133 E134 L135 I154 Y158	E80-N131 PolarHBondContact OE2-ND2 3.19Å; G127-N131 WeakPolarHBondContact O-CB 3.4Å; G127-N131 PolarHBondContact O-N 3.33Å; G127-N131 VanDerWaalsContact O-N 3.13Å; G127-N131 PolarHBondContact O-ND2 3.35Å; F129-N131 VanDerWaalsContact C-N 3.27Å; F129-N131 PolarHBondContact O-N 3.19Å; N131-F133 PolarHBondContact O-N 3.45Å; N131-E134 PolarHBondContact O-N 3.04Å; N131-L135 PolarHBondContact O-N 3.3Å; N131-L135 VanDerWaalsContact O-N 3.08Å; N131-I154 HydrophobicContact CB-CD1 3.85Å; N131-Y158 HydrophobicContact CB-CE2 4.22Å
132	A	96.6	Very high	96.8	Very high	42 Å²	42	68.1 Å²	68.1	35%	0.347	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-41	-174.7	0	0	0	0	0	113.6	C128 F129 L135 M136 Y158	C128-A132 WeakPolarHBondContact O-CB 3.4Å; C128-A132 PolarHBondContact O-N 3.26Å; C128-A132 VanDerWaalsContact O-N 3.09Å; F129-A132 WeakPolarHBondContact O-CB 3.24Å; F129-A132 PolarHBondContact O-N 2.93Å; A132-L135 PolarHBondContact O-N 2.62Å; A132-M136 PolarHBondContact O-N 3.23Å; A132-Y158 WeakPolarHBondContact CA-OH 3.39Å; A132-Y158 PolarHBondContact N-OH 3.31Å
133	F	96	Very high	96.6	Very high	158 Å²	158	71.1 Å²	71.1	69%	0.693	36%	0.364	S	S	*	.	H	α-helix	trans	-67	-38.3	179.9	-175.8	-99.7	0	0	0	112.1	N131 M136 T137	N131-F133 PolarHBondContact O-N 3.45Å; F133-M136 PolarHBondContact O-N 2.96Å; F133-T137 PolarHBondContact O-N 3.4Å; F133-T137 PolarHBondContact O-OG1 2.87Å
134	E	95.6	Very high	96.4	Very high	33 Å²	33	70.9 Å²	70.9	15%	0.154	36%	0.363	C	S	.	.	H	α-helix	trans	-65.6	-42.1	176	-177.1	161.7	157.4	0	0	111.5	N131 M136 T137 Y138 K145 I154	N131-E134 PolarHBondContact O-N 3.04Å; E134-M136 VanDerWaalsContact C-N 3.31Å; E134-M136 PolarHBondContact O-N 2.94Å; E134-T137 PolarHBondContact O-N 3.1Å; E134-Y138 WeakPolarHBondContact O-CB 3.06Å; E134-Y138 PolarHBondContact O-N 3.46Å; E134-K145 HydrophobicContact CG-CD 4.42Å; E134-K145 WeakPolarHBondContact OE2-CD 3.42Å; E134-K145 WeakPolarHBondContact OE2-CE 3.47Å; E134-K145 IonicContact OE2-NZ 3.29Å; E134-K145 PolarHBondContact OE2-NZ 2.87Å; E134-I154 HydrophobicContact CB-CD1 4.13Å; E134-I154 HydrophobicContact CB-CG1 4.42Å; E134-I154 HydrophobicContact CG-CB 4.37Å; E134-I154 HydrophobicContact CG-CD1 4.09Å; E134-I154 HydrophobicContact CG-CG1 4.07Å
135	L	96.7	Very high	96.1	Very high	50 Å²	50	77.4 Å²	77.4	26%	0.262	39%	0.391	S	S	.	.	H	α-helix	trans	-61	-42.4	173.9	-178.1	67.6	0	0	0	111.5	N131 A132 Y138 Y139 I154 Y158	N131-L135 PolarHBondContact O-N 3.3Å; N131-L135 VanDerWaalsContact O-N 3.08Å; A132-L135 PolarHBondContact O-N 2.62Å; L135-Y138 PolarHBondContact O-N 2.86Å; L135-Y139 WeakPolarHBondContact O-CB 3.49Å; L135-Y139 PolarHBondContact O-N 3.38Å; L135-I154 HydrophobicContact CB-CD1 4.43Å; L135-I154 HydrophobicContact CB-CG1 3.96Å; L135-I154 HydrophobicContact CD1-CG1 4.14Å; L135-Y158 HydrophobicContact CB-CD2 4.35Å; L135-Y158 HydrophobicContact CB-CE2 3.73Å; L135-Y158 HydrophobicContact CD1-CD2 4.2Å; L135-Y158 HydrophobicContact CD1-CE2 4.42Å; L135-Y158 HydrophobicContact CD2-CD1 3.83Å; L135-Y158 HydrophobicContact CD2-CD2 3.85Å; L135-Y158 HydrophobicContact CD2-CE1 3.62Å; L135-Y158 HydrophobicContact CD2-CE2 3.63Å; L135-Y158 HydrophobicContact CD2-CG 3.93Å; L135-Y158 VanDerWaalsContact CD2-CZ 3.5Å; L135-Y158 HydrophobicContact CG-CD2 4.35Å; L135-Y158 HydrophobicContact CG-CE2 4.12Å
136	M	96.7	Very high	95.8	Very high	99 Å²	99	78.8 Å²	78.8	49%	0.488	39%	0.391	S	S	.	.	H	α-helix	trans	-65.2	-42.2	178.9	-171.2	60.6	165.5	0	0	111.9	A132 F133 E134 Y139 Q140	A132-M136 PolarHBondContact O-N 3.23Å; F133-M136 PolarHBondContact O-N 2.96Å; E134-M136 VanDerWaalsContact C-N 3.31Å; E134-M136 PolarHBondContact O-N 2.94Å; M136-Y139 WeakPolarHBondContact O-CB 3.46Å; M136-Y139 PolarHBondContact O-N 3.34Å; M136-Y139 HydrophobicContact SD-CD1 4.41Å; M136-Q140 WeakPolarHBondContact O-CG 3.47Å; M136-Q140 PolarHBondContact O-N 3.38Å
137	T	96.9	Very high	95.6	Very high	53 Å²	53	79.5 Å²	79.5	33%	0.325	39%	0.385	S	S	.	.	H	α-helix	trans	-61.3	-47.6	175.2	-60.4	0	0	0	0	110.3	F133 E134 Y139 Q140 S141	F133-T137 PolarHBondContact O-N 3.4Å; F133-T137 PolarHBondContact O-OG1 2.87Å; E134-T137 PolarHBondContact O-N 3.1Å; T137-Y139 VanDerWaalsContact C-N 3.32Å; T137-Y139 PolarHBondContact O-N 3.48Å; T137-Q140 PolarHBondContact O-N 3.44Å; T137-S141 WeakPolarHBondContact O-CB 3.33Å; T137-S141 PolarHBondContact O-N 3.48Å; T137-S141 PolarHBondContact O-OG 3.26Å
138	Y	96.4	Very high	95.3	Very high	48 Å²	48	82.7 Å²	82.7	19%	0.188	40%	0.399	C	S	.	.	H	α-helix	trans	-60	-40.4	175.4	169.4	-106	0	0	0	112.3	E134 L135 Q140 R142 A144 P152 I154 V155	E134-Y138 WeakPolarHBondContact O-CB 3.06Å; E134-Y138 PolarHBondContact O-N 3.46Å; L135-Y138 PolarHBondContact O-N 2.86Å; Y138-Q140 VanDerWaalsContact C-N 3.3Å; Y138-Q140 PolarHBondContact O-N 3.49Å; Y138-R142 WeakPolarHBondContact O-CA 3.4Å; Y138-R142 PolarHBondContact O-N 2.81Å; Y138-A144 HydrophobicContact CD2-CB 3.81Å; Y138-A144 HydrophobicContact CE2-CB 4.25Å; Y138-P152 HydrophobicContact CD2-CB 4.42Å; Y138-P152 HydrophobicContact CD2-CG 4.42Å; Y138-P152 HydrophobicContact CE1-CB 4.44Å; Y138-P152 HydrophobicContact CE1-CG 4.31Å; Y138-P152 HydrophobicContact CE2-CB 3.97Å; Y138-P152 HydrophobicContact CE2-CG 3.54Å; Y138-P152 VanDerWaalsContact CZ-CG 3.48Å; Y138-P152 WeakPolarHBondContact OH-CG 3.4Å; Y138-I154 HydrophobicContact CD1-CG2 4.12Å; Y138-I154 HydrophobicContact CG-CG2 4Å; Y138-V155 HydrophobicContact CD1-CG2 3.93Å; Y138-V155 HydrophobicContact CE1-CG2 3.42Å; Y138-V155 VanDerWaalsContact CE1-CG2 3.42Å
139	Y	96.3	Very high	95	Very high	142 Å²	142	90.8 Å²	90.8	56%	0.557	43%	0.427	S	S	*	.	H	α-helix	trans	-61.2	-39.3	177.6	176.3	-99.3	0	0	0	112.3	L135 M136 T137 R142	L135-Y139 WeakPolarHBondContact O-CB 3.49Å; L135-Y139 PolarHBondContact O-N 3.38Å; M136-Y139 WeakPolarHBondContact O-CB 3.46Å; M136-Y139 PolarHBondContact O-N 3.34Å; M136-Y139 HydrophobicContact SD-CD1 4.41Å; T137-Y139 VanDerWaalsContact C-N 3.32Å; T137-Y139 PolarHBondContact O-N 3.48Å; Y139-R142 PolarHBondContact O-NE 2.88Å; Y139-R142 VanDerWaalsContact O-NE 3.16Å; Y139-R142 PolarHBondContact O-NH2 2.89Å
140	Q	97.4	Very high	94.7	Very high	139 Å²	139	91 Å²	91	65%	0.65	43%	0.43	S	S	*	.	H	α-helix	trans	-80	-48.8	-179.1	-69.2	175.9	-30.8	0	0	112.8	M136 T137 Y138	M136-Q140 WeakPolarHBondContact O-CG 3.47Å; M136-Q140 PolarHBondContact O-N 3.38Å; T137-Q140 PolarHBondContact O-N 3.44Å; Y138-Q140 VanDerWaalsContact C-N 3.3Å; Y138-Q140 PolarHBondContact O-N 3.49Å
141	S	96.3	Very high	94.6	Very high	60 Å²	60	91.2 Å²	91.2	42%	0.42	42%	0.424	S	S	.	.	H	α-helix	trans	-87.1	-22.3	-173.6	70.3	0	0	0	0	113.6	T137 V143	T137-S141 WeakPolarHBondContact O-CB 3.33Å; T137-S141 PolarHBondContact O-N 3.48Å; T137-S141 PolarHBondContact O-OG 3.26Å; S141-V143 PolarHBondContact O-N 3.33Å; S141-V143 PolarHBondContact OG-N 3.37Å; S141-V143 PolarHBondContact OG-O 2.91Å
142	R	94.3	Very high	94.6	Very high	145 Å²	145	90.9 Å²	90.9	55%	0.547	42%	0.423	S	S	.	.			trans	59	17.8	-166.9	-51.7	-58.5	179.7	-178.8	-5.8	114	Y138 Y139	Y138-R142 WeakPolarHBondContact O-CA 3.4Å; Y138-R142 PolarHBondContact O-N 2.81Å; Y139-R142 PolarHBondContact O-NE 2.88Å; Y139-R142 VanDerWaalsContact O-NE 3.16Å; Y139-R142 PolarHBondContact O-NH2 2.89Å
143	V	94	Very high	94.5	Very high	95 Å²	95	89.4 Å²	89.4	58%	0.576	41%	0.41	S	S	*	.			trans	-114.7	114.1	176.9	-178.1	0	0	0	0	108.8	S141	S141-V143 PolarHBondContact O-N 3.33Å; S141-V143 PolarHBondContact OG-N 3.37Å; S141-V143 PolarHBondContact OG-O 2.91Å
144	A	93	Very high	94.5	Very high	8 Å²	8	82 Å²	82	7%	0.066	38%	0.378	C	S	.	.			trans	-87	151.8	175.1	0	0	0	0	0	111.2	Y138 Y147 P152	Y138-A144 HydrophobicContact CD2-CB 3.81Å; Y138-A144 HydrophobicContact CE2-CB 4.25Å; A144-Y147 HydrophobicContact CB-CD1 4.46Å; A144-Y147 HydrophobicContact CB-CE1 3.9Å; A144-Y147 HydrophobicContact CB-CE2 4.05Å; A144-Y147 PolarHBondContact N-OH 3.1Å; A144-Y147 WeakPolarHBondContact O-CE2 3.16Å; A144-P152 HydrophobicContact CB-CB 3.79Å; A144-P152 HydrophobicContact CB-CG 4.36Å
145	K	91.5	Very high	94.5	Very high	137 Å²	137	82.2 Å²	82.2	60%	0.596	38%	0.381	S	S	*	.	S	Bend	trans	-71.2	-35.1	174.6	-63.5	-174.6	-165.8	154.6	0	112.5	E134	E134-K145 HydrophobicContact CG-CD 4.42Å; E134-K145 WeakPolarHBondContact OE2-CD 3.42Å; E134-K145 WeakPolarHBondContact OE2-CE 3.47Å; E134-K145 IonicContact OE2-NZ 3.29Å; E134-K145 PolarHBondContact OE2-NZ 2.87Å
146	H	92.4	Very high	94.4	Very high	69 Å²	69	82.5 Å²	82.5	32%	0.319	38%	0.382	S	S	.	.			trans	-134.1	138.5	-176.7	-55.2	90.7	0	0	0	110.2	V153	H146-V153 HydrophobicContact CB-CB 4.01Å; H146-V153 HydrophobicContact CB-CG2 3.89Å; H146-V153 PolarHBondContact O-N 3.21Å
147	Y	93.1	Very high	94.3	Very high	94 Å²	94	78.9 Å²	78.9	37%	0.369	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.5	178.6	-66.2	-90.7	0	0	0	110.6	A144 F151 P152	A144-Y147 HydrophobicContact CB-CD1 4.46Å; A144-Y147 HydrophobicContact CB-CE1 3.9Å; A144-Y147 HydrophobicContact CB-CE2 4.05Å; A144-Y147 PolarHBondContact N-OH 3.1Å; A144-Y147 WeakPolarHBondContact O-CE2 3.16Å; Y147-F151 CarbonylContact C-O 3.58Å; Y147-F151 WeakPolarHBondContact CA-O 3.25Å; Y147-P152 HydrophobicContact CE1-CG 4.25Å
148	F	91.3	Very high	94.4	Very high	67 Å²	67	79 Å²	79	29%	0.294	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	104.7	172.3	179.9	-107.9	0	0	0	108	P75 F76 E150 F151 V153 L156	P75-F148 HydrophobicContact CB-CD2 4.25Å; P75-F148 HydrophobicContact CG-CD2 3.5Å; P75-F148 HydrophobicContact CG-CE2 3.9Å; F76-F148 AromaticContact CE2-CD2 3.6Å; F76-F148 HydrophobicContact CE2-CD2 3.6Å; F76-F148 AromaticContact CE2-CE2 3.8Å; F76-F148 HydrophobicContact CE2-CE2 3.8Å; F76-F148 HydrophobicContact CE2-CG 4.22Å; F76-F148 HydrophobicContact CZ-CB 4.26Å; F76-F148 HydrophobicContact CZ-CD1 4.46Å; F76-F148 AromaticContact CZ-CD2 3.79Å; F76-F148 HydrophobicContact CZ-CD2 3.79Å; F76-F148 HydrophobicContact CZ-CE2 4.21Å; F76-F148 AromaticContact CZ-CG 3.92Å; F76-F148 HydrophobicContact CZ-CG 3.92Å; F148-E150 PolarHBondContact O-N 3.2Å; F148-F151 PolarHBondContact N-O 3.26Å; F148-F151 VanDerWaalsContact O-CB 3.28Å; F148-F151 WeakPolarHBondContact O-CB 3.15Å; F148-F151 PolarHBondContact O-N 3.49Å; F148-V153 HydrophobicContact CB-CG2 3.97Å; F148-L156 HydrophobicContact CB-CD1 4.05Å; F148-L156 HydrophobicContact CD1-CD1 3.94Å; F148-L156 HydrophobicContact CG-CD1 4.32Å
149	Y	91	Very high	94.4	Very high	202 Å²	202	80.9 Å²	80.9	79%	0.792	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	56.3	-171.8	-63.5	-83.8	0	0	0	112.3	F151	Y149-F151 PolarHBondContact O-N 2.99Å
150	E	91	Very high	94.5	Very high	168 Å²	168	75 Å²	75	79%	0.785	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	-0.4	-175.6	-53.5	-55.9	117.4	0	0	115.5	F148	F148-E150 PolarHBondContact O-N 3.2Å
151	F	93.8	Very high	94.5	Very high	88 Å²	88	68.5 Å²	68.5	39%	0.386	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.5	177.2	-163.4	-88.7	0	0	0	111.3	Y147 F148 Y149 V153 V155 L156 I159	Y147-F151 CarbonylContact C-O 3.58Å; Y147-F151 WeakPolarHBondContact CA-O 3.25Å; F148-F151 PolarHBondContact N-O 3.26Å; F148-F151 VanDerWaalsContact O-CB 3.28Å; F148-F151 WeakPolarHBondContact O-CB 3.15Å; F148-F151 PolarHBondContact O-N 3.49Å; Y149-F151 PolarHBondContact O-N 2.99Å; F151-V153 PolarHBondContact O-N 3.43Å; F151-V155 HydrophobicContact CE1-CB 3.76Å; F151-V155 HydrophobicContact CE1-CG1 3.7Å; F151-V155 HydrophobicContact CZ-CB 4.15Å; F151-V155 HydrophobicContact CZ-CG1 3.63Å; F151-L156 HydrophobicContact CD1-CD1 3.97Å; F151-L156 HydrophobicContact CD1-CD2 3.57Å; F151-L156 HydrophobicContact CD1-CG 3.47Å; F151-L156 VanDerWaalsContact CD1-CG 3.47Å; F151-L156 HydrophobicContact CE1-CD2 3.46Å; F151-L156 VanDerWaalsContact CE1-CD2 3.46Å; F151-L156 HydrophobicContact CE1-CG 3.6Å; F151-L156 HydrophobicContact CZ-CD2 4.44Å; F151-I159 HydrophobicContact CZ-CD1 4.49Å
152	P	95.6	Very high	94.6	Very high	11 Å²	11	68.6 Å²	68.6	7%	0.071	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	121.9	180	-24.7	33	0	0	0	112.9	Y138 A144 Y147 I154 V155 L156	Y138-P152 HydrophobicContact CD2-CB 4.42Å; Y138-P152 HydrophobicContact CD2-CG 4.42Å; Y138-P152 HydrophobicContact CE1-CB 4.44Å; Y138-P152 HydrophobicContact CE1-CG 4.31Å; Y138-P152 HydrophobicContact CE2-CB 3.97Å; Y138-P152 HydrophobicContact CE2-CG 3.54Å; Y138-P152 VanDerWaalsContact CZ-CG 3.48Å; Y138-P152 WeakPolarHBondContact OH-CG 3.4Å; A144-P152 HydrophobicContact CB-CB 3.79Å; A144-P152 HydrophobicContact CB-CG 4.36Å; Y147-P152 HydrophobicContact CE1-CG 4.25Å; P152-I154 VanDerWaalsContact C-N 3.26Å; P152-I154 HydrophobicContact CB-CG2 4.18Å; P152-I154 PolarHBondContact O-N 3.47Å; P152-V155 HydrophobicContact CB-CB 4.24Å; P152-V155 HydrophobicContact CB-CG2 3.85Å; P152-V155 HydrophobicContact CG-CG2 4.33Å; P152-V155 PolarHBondContact O-N 3.23Å; P152-V155 VanDerWaalsContact O-N 3.08Å; P152-L156 PolarHBondContact O-N 2.81Å
153	V	94.7	Very high	94.8	Very high	12 Å²	12	65.3 Å²	65.3	7%	0.073	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-36.9	180	170	0	0	0	0	111.7	F76 H146 F148 F151 V155 L156 A157	F76-V153 HydrophobicContact CD1-CG1 3.57Å; F76-V153 HydrophobicContact CD1-CG2 4.09Å; F76-V153 HydrophobicContact CE1-CG1 3.82Å; F76-V153 HydrophobicContact CE1-CG2 4.06Å; H146-V153 HydrophobicContact CB-CB 4.01Å; H146-V153 HydrophobicContact CB-CG2 3.89Å; H146-V153 PolarHBondContact O-N 3.21Å; F148-V153 HydrophobicContact CB-CG2 3.97Å; F151-V153 PolarHBondContact O-N 3.43Å; V153-V155 PolarHBondContact O-N 2.91Å; V153-L156 WeakPolarHBondContact O-CB 3.45Å; V153-L156 PolarHBondContact O-N 2.94Å; V153-L156 VanDerWaalsContact O-N 3.11Å; V153-A157 PolarHBondContact O-N 3.39Å
154	I	95.5	Very high	95	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-35.5	177.3	-171.6	61.5	0	0	0	112.2	N131 E134 L135 Y138 P152 A157 Y158	N131-I154 HydrophobicContact CB-CD1 3.85Å; E134-I154 HydrophobicContact CB-CD1 4.13Å; E134-I154 HydrophobicContact CB-CG1 4.42Å; E134-I154 HydrophobicContact CG-CB 4.37Å; E134-I154 HydrophobicContact CG-CD1 4.09Å; E134-I154 HydrophobicContact CG-CG1 4.07Å; L135-I154 HydrophobicContact CB-CD1 4.43Å; L135-I154 HydrophobicContact CB-CG1 3.96Å; L135-I154 HydrophobicContact CD1-CG1 4.14Å; Y138-I154 HydrophobicContact CD1-CG2 4.12Å; Y138-I154 HydrophobicContact CG-CG2 4Å; P152-I154 VanDerWaalsContact C-N 3.26Å; P152-I154 HydrophobicContact CB-CG2 4.18Å; P152-I154 PolarHBondContact O-N 3.47Å; I154-A157 WeakPolarHBondContact O-CB 3.25Å; I154-A157 PolarHBondContact O-N 3.02Å; I154-Y158 HydrophobicContact CD1-CD2 4.2Å; I154-Y158 HydrophobicContact CD1-CE2 3.98Å; I154-Y158 HydrophobicContact CG1-CD2 4.42Å; I154-Y158 HydrophobicContact CG1-CE2 4.44Å; I154-Y158 WeakPolarHBondContact O-CD2 3.39Å; I154-Y158 PolarHBondContact O-N 3.26Å; I154-Y158 VanDerWaalsContact O-N 3.17Å
155	V	96.2	Very high	95.3	Very high	36 Å²	36	63.9 Å²	63.9	22%	0.218	31%	0.307	C	S	.	.	H	α-helix	trans	-70.8	-40.1	176.7	177.5	0	0	0	0	110.4	Y138 F151 P152 V153 A157 Y158 I159	Y138-V155 HydrophobicContact CD1-CG2 3.93Å; Y138-V155 HydrophobicContact CE1-CG2 3.42Å; Y138-V155 VanDerWaalsContact CE1-CG2 3.42Å; F151-V155 HydrophobicContact CE1-CB 3.76Å; F151-V155 HydrophobicContact CE1-CG1 3.7Å; F151-V155 HydrophobicContact CZ-CB 4.15Å; F151-V155 HydrophobicContact CZ-CG1 3.63Å; P152-V155 HydrophobicContact CB-CB 4.24Å; P152-V155 HydrophobicContact CB-CG2 3.85Å; P152-V155 HydrophobicContact CG-CG2 4.33Å; P152-V155 PolarHBondContact O-N 3.23Å; P152-V155 VanDerWaalsContact O-N 3.08Å; V153-V155 PolarHBondContact O-N 2.91Å; V155-A157 VanDerWaalsContact C-N 3.3Å; V155-A157 PolarHBondContact O-N 3.24Å; V155-Y158 PolarHBondContact O-N 3.07Å; V155-I159 HydrophobicContact CG1-CD1 4.19Å; V155-I159 WeakPolarHBondContact O-CG1 3.25Å; V155-I159 PolarHBondContact O-N 3.45Å
156	L	95.1	Very high	95.6	Very high	56 Å²	56	61.9 Å²	61.9	29%	0.293	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-40.2	173.2	-64.4	173	0	0	0	111.7	F148 F151 P152 V153 Y158 I159 F160	F148-L156 HydrophobicContact CB-CD1 4.05Å; F148-L156 HydrophobicContact CD1-CD1 3.94Å; F148-L156 HydrophobicContact CG-CD1 4.32Å; F151-L156 HydrophobicContact CD1-CD1 3.97Å; F151-L156 HydrophobicContact CD1-CD2 3.57Å; F151-L156 HydrophobicContact CD1-CG 3.47Å; F151-L156 VanDerWaalsContact CD1-CG 3.47Å; F151-L156 HydrophobicContact CE1-CD2 3.46Å; F151-L156 VanDerWaalsContact CE1-CD2 3.46Å; F151-L156 HydrophobicContact CE1-CG 3.6Å; F151-L156 HydrophobicContact CZ-CD2 4.44Å; P152-L156 PolarHBondContact O-N 2.81Å; V153-L156 WeakPolarHBondContact O-CB 3.45Å; V153-L156 PolarHBondContact O-N 2.94Å; V153-L156 VanDerWaalsContact O-N 3.11Å; L156-Y158 VanDerWaalsContact C-N 3.33Å; L156-Y158 PolarHBondContact O-N 2.98Å; L156-I159 PolarHBondContact O-N 3.4Å; L156-F160 WeakPolarHBondContact O-CB 3.14Å; L156-F160 PolarHBondContact O-N 3.26Å
157	A	95	Very high	95.9	Very high	23 Å²	23	59.2 Å²	59.2	19%	0.19	29%	0.288	C	S	.	.	H	α-helix	trans	-59.6	-43.7	176.3	0	0	0	0	0	111.3	V153 I154 V155 F160 F161	V153-A157 PolarHBondContact O-N 3.39Å; I154-A157 WeakPolarHBondContact O-CB 3.25Å; I154-A157 PolarHBondContact O-N 3.02Å; V155-A157 VanDerWaalsContact C-N 3.3Å; V155-A157 PolarHBondContact O-N 3.24Å; A157-F160 CarbonylContact O-C 3.6Å; A157-F160 WeakPolarHBondContact O-CB 3.4Å; A157-F160 PolarHBondContact O-N 2.81Å; A157-F161 HydrophobicContact CB-CE2 4.24Å; A157-F161 VanDerWaalsContact O-CD2 3.23Å; A157-F161 WeakPolarHBondContact O-CD2 3.46Å; A157-F161 WeakPolarHBondContact O-CG 3.37Å; A157-F161 PolarHBondContact O-N 3.02Å
158	Y	97.4	Very high	96.2	Very high	57 Å²	57	54.8 Å²	54.8	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-71.9	-31.4	177.2	-86.7	-96.5	0	0	0	114.4	C128 N131 A132 L135 I154 V155 L156 F160 F161 S162	C128-Y158 PolarHBondContact O-OH 3.11Å; N131-Y158 HydrophobicContact CB-CE2 4.22Å; A132-Y158 WeakPolarHBondContact CA-OH 3.39Å; A132-Y158 PolarHBondContact N-OH 3.31Å; L135-Y158 HydrophobicContact CB-CD2 4.35Å; L135-Y158 HydrophobicContact CB-CE2 3.73Å; L135-Y158 HydrophobicContact CD1-CD2 4.2Å; L135-Y158 HydrophobicContact CD1-CE2 4.42Å; L135-Y158 HydrophobicContact CD2-CD1 3.83Å; L135-Y158 HydrophobicContact CD2-CD2 3.85Å; L135-Y158 HydrophobicContact CD2-CE1 3.62Å; L135-Y158 HydrophobicContact CD2-CE2 3.63Å; L135-Y158 HydrophobicContact CD2-CG 3.93Å; L135-Y158 VanDerWaalsContact CD2-CZ 3.5Å; L135-Y158 HydrophobicContact CG-CD2 4.35Å; L135-Y158 HydrophobicContact CG-CE2 4.12Å; I154-Y158 HydrophobicContact CD1-CD2 4.2Å; I154-Y158 HydrophobicContact CD1-CE2 3.98Å; I154-Y158 HydrophobicContact CG1-CD2 4.42Å; I154-Y158 HydrophobicContact CG1-CE2 4.44Å; I154-Y158 WeakPolarHBondContact O-CD2 3.39Å; I154-Y158 PolarHBondContact O-N 3.26Å; I154-Y158 VanDerWaalsContact O-N 3.17Å; V155-Y158 PolarHBondContact O-N 3.07Å; L156-Y158 VanDerWaalsContact C-N 3.33Å; L156-Y158 PolarHBondContact O-N 2.98Å; Y158-F160 VanDerWaalsContact C-N 3.33Å; Y158-F161 HydrophobicContact CD1-CD2 4.1Å; Y158-F161 HydrophobicContact CD2-CD2 4.09Å; Y158-F161 HydrophobicContact CD2-CE2 4.2Å; Y158-F161 HydrophobicContact CE1-CD2 4.35Å; Y158-F161 HydrophobicContact CE2-CD2 4.36Å; Y158-F161 HydrophobicContact CE2-CE2 4.2Å; Y158-F161 AromaticContact CG-CD2 3.97Å; Y158-F161 HydrophobicContact CG-CD2 3.97Å; Y158-F161 PolarHBondContact O-N 3.3Å; Y158-S162 WeakPolarHBondContact O-CB 3.44Å; Y158-S162 PolarHBondContact O-N 3.24Å
159	I	97.7	Very high	96.5	Very high	87 Å²	87	53 Å²	53	45%	0.446	27%	0.271	S	S	.	.	H	α-helix	trans	-62.3	-45.5	168.4	-67.6	167.1	0	0	0	109.5	F151 V155 L156 F161 S162 L163	F151-I159 HydrophobicContact CZ-CD1 4.49Å; V155-I159 HydrophobicContact CG1-CD1 4.19Å; V155-I159 WeakPolarHBondContact O-CG1 3.25Å; V155-I159 PolarHBondContact O-N 3.45Å; L156-I159 PolarHBondContact O-N 3.4Å; I159-F161 PolarHBondContact O-N 3.49Å; I159-S162 WeakPolarHBondContact O-CB 3.34Å; I159-S162 PolarHBondContact O-N 3.15Å; I159-L163 HydrophobicContact CG2-CD1 4.36Å; I159-L163 WeakPolarHBondContact O-CG 3.48Å; I159-L163 PolarHBondContact O-N 3.25Å
160	F	97.2	Very high	96.9	Very high	18 Å²	18	48.2 Å²	48.2	8%	0.079	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-43.9	175.7	176.2	-97.1	0	0	0	112.1	L47 L50 M51 W82 W86 L156 A157 Y158 S162 L163 C164	L47-F160 HydrophobicContact CB-CE2 4.4Å; L47-F160 HydrophobicContact CD2-CD2 4.31Å; L47-F160 HydrophobicContact CD2-CE2 4.06Å; L50-F160 HydrophobicContact CD2-CD2 3.93Å; L50-F160 HydrophobicContact CD2-CE2 4.32Å; M51-F160 HydrophobicContact CE-CD1 4.05Å; M51-F160 HydrophobicContact CE-CE1 3.26Å; M51-F160 HydrophobicContact CE-CE2 4.09Å; M51-F160 HydrophobicContact CE-CZ 3.29Å; W82-F160 HydrophobicContact CZ3-CE1 4.4Å; W86-F160 HydrophobicContact CD2-CZ 4.5Å; W86-F160 HydrophobicContact CE3-CZ 4.19Å; W86-F160 HydrophobicContact CH2-CE2 4.38Å; W86-F160 AromaticContact CH2-CZ 3.74Å; W86-F160 HydrophobicContact CH2-CZ 3.74Å; W86-F160 HydrophobicContact CZ2-CZ 4.01Å; W86-F160 AromaticContact CZ3-CZ 3.82Å; W86-F160 HydrophobicContact CZ3-CZ 3.82Å; L156-F160 WeakPolarHBondContact O-CB 3.14Å; L156-F160 PolarHBondContact O-N 3.26Å; A157-F160 CarbonylContact O-C 3.6Å; A157-F160 WeakPolarHBondContact O-CB 3.4Å; A157-F160 PolarHBondContact O-N 2.81Å; Y158-F160 VanDerWaalsContact C-N 3.33Å; F160-S162 VanDerWaalsContact C-N 3.35Å; F160-S162 PolarHBondContact O-N 2.93Å; F160-L163 PolarHBondContact O-N 3.34Å; F160-C164 WeakPolarHBondContact CE1-SG 3.4Å; F160-C164 WeakPolarHBondContact CZ-SG 3.45Å; F160-C164 WeakPolarHBondContact O-CB 3.33Å; F160-C164 PolarHBondContact O-N 2.98Å; F160-C164 PolarHBondContact O-SG 3.1Å
161	F	98.1	Very high	97.2	Very high	3 Å²	3	40.2 Å²	40.2	1%	0.013	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-45	174.6	-64.6	-38.5	0	0	0	111.9	W82 V124 G127 C128 A157 Y158 I159 L163 C164 V165	W82-F161 HydrophobicContact CE3-CE1 4.27Å; W82-F161 HydrophobicContact CH2-CD1 4.31Å; W82-F161 AromaticContact CH2-CE1 3.23Å; W82-F161 HydrophobicContact CH2-CE1 3.23Å; W82-F161 AromaticContact CH2-CZ 3.66Å; W82-F161 HydrophobicContact CH2-CZ 3.66Å; W82-F161 AromaticContact CZ2-CE1 3.64Å; W82-F161 HydrophobicContact CZ2-CE1 3.64Å; W82-F161 AromaticContact CZ2-CZ 3.57Å; W82-F161 HydrophobicContact CZ2-CZ 3.57Å; W82-F161 HydrophobicContact CZ3-CD1 4.49Å; W82-F161 AromaticContact CZ3-CE1 3.58Å; W82-F161 HydrophobicContact CZ3-CE1 3.58Å; W82-F161 HydrophobicContact CZ3-CZ 4.36Å; V124-F161 HydrophobicContact CG1-CB 4.13Å; V124-F161 HydrophobicContact CG1-CD1 3.9Å; V124-F161 HydrophobicContact CG1-CG 4.34Å; G127-F161 VanDerWaalsContact C-CZ 3.44Å; C128-F161 HydrophobicContact CB-CD2 4.48Å; C128-F161 WeakPolarHBondContact SG-CD2 3.43Å; C128-F161 WeakPolarHBondContact SG-CG 3.41Å; A157-F161 HydrophobicContact CB-CE2 4.24Å; A157-F161 VanDerWaalsContact O-CD2 3.23Å; A157-F161 WeakPolarHBondContact O-CD2 3.46Å; A157-F161 WeakPolarHBondContact O-CG 3.37Å; A157-F161 PolarHBondContact O-N 3.02Å; Y158-F161 HydrophobicContact CD1-CD2 4.1Å; Y158-F161 HydrophobicContact CD2-CD2 4.09Å; Y158-F161 HydrophobicContact CD2-CE2 4.2Å; Y158-F161 HydrophobicContact CE1-CD2 4.35Å; Y158-F161 HydrophobicContact CE2-CD2 4.36Å; Y158-F161 HydrophobicContact CE2-CE2 4.2Å; Y158-F161 AromaticContact CG-CD2 3.97Å; Y158-F161 HydrophobicContact CG-CD2 3.97Å; Y158-F161 PolarHBondContact O-N 3.3Å; I159-F161 PolarHBondContact O-N 3.49Å; F161-L163 PolarHBondContact O-N 2.91Å; F161-C164 WeakPolarHBondContact O-CB 3.21Å; F161-C164 PolarHBondContact O-N 3.44Å; F161-V165 WeakPolarHBondContact O-CG2 3.42Å; F161-V165 PolarHBondContact O-N 2.84Å
162	S	98.2	Very high	97.4	Very high	62 Å²	62	37.9 Å²	37.9	43%	0.434	21%	0.21	S	C	.	.	H	α-helix	trans	-59.2	-45.6	176.5	178.9	0	0	0	0	112.2	Y158 I159 F160 V165 Q166	Y158-S162 WeakPolarHBondContact O-CB 3.44Å; Y158-S162 PolarHBondContact O-N 3.24Å; I159-S162 WeakPolarHBondContact O-CB 3.34Å; I159-S162 PolarHBondContact O-N 3.15Å; F160-S162 VanDerWaalsContact C-N 3.35Å; F160-S162 PolarHBondContact O-N 2.93Å; S162-V165 PolarHBondContact O-N 2.9Å; S162-Q166 WeakPolarHBondContact O-CG 3.38Å; S162-Q166 PolarHBondContact O-N 2.94Å; S162-Q166 VanDerWaalsContact O-N 3.17Å; S162-Q166 PolarHBondContact O-NE2 3.49Å; S162-Q166 PolarHBondContact OG-NE2 2.93Å
163	L	98.6	Very high	97.6	Very high	75 Å²	75	43.5 Å²	43.5	39%	0.393	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-42.4	175.7	-68	174.7	0	0	0	111.6	L47 I159 F160 F161 Q166 V167	L47-L163 HydrophobicContact CD2-CB 4.18Å; I159-L163 HydrophobicContact CG2-CD1 4.36Å; I159-L163 WeakPolarHBondContact O-CG 3.48Å; I159-L163 PolarHBondContact O-N 3.25Å; F160-L163 PolarHBondContact O-N 3.34Å; F161-L163 PolarHBondContact O-N 2.91Å; L163-Q166 PolarHBondContact O-N 3.37Å; L163-V167 WeakPolarHBondContact O-CG2 3.36Å; L163-V167 PolarHBondContact O-N 3.21Å
164	C	98.5	Very high	97.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-47.8	177.3	-72.9	0	0	0	0	111.9	W86 V124 F160 F161 Q166 V167 H168	W86-C164 WeakPolarHBondContact CZ2-SG 3.19Å; V124-C164 HydrophobicContact CG1-CB 4.43Å; V124-C164 HydrophobicContact CG2-CB 3.63Å; F160-C164 WeakPolarHBondContact CE1-SG 3.4Å; F160-C164 WeakPolarHBondContact CZ-SG 3.45Å; F160-C164 WeakPolarHBondContact O-CB 3.33Å; F160-C164 PolarHBondContact O-N 2.98Å; F160-C164 PolarHBondContact O-SG 3.1Å; F161-C164 WeakPolarHBondContact O-CB 3.21Å; F161-C164 PolarHBondContact O-N 3.44Å; C164-Q166 VanDerWaalsContact C-N 3.26Å; C164-Q166 PolarHBondContact O-N 3.32Å; C164-V167 PolarHBondContact O-N 3.2Å; C164-H168 WeakPolarHBondContact O-CB 3.24Å; C164-H168 PolarHBondContact O-CD2 3.32Å; C164-H168 PolarHBondContact O-N 3.39Å
165	V	98.4	Very high	97.8	Very high	74 Å²	74	44 Å²	44	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-57.4	-42.1	178.1	169.8	0	0	0	0	110.9	V124 F161 S162 G169	V124-V165 HydrophobicContact CG1-CG2 3.99Å; F161-V165 WeakPolarHBondContact O-CG2 3.42Å; F161-V165 PolarHBondContact O-N 2.84Å; S162-V165 PolarHBondContact O-N 2.9Å; V165-G169 WeakPolarHBondContact O-CA 3.45Å; V165-G169 PolarHBondContact O-N 3.3Å
166	Q	98.6	Very high	97.9	Very high	94 Å²	94	48.6 Å²	48.6	44%	0.439	25%	0.246	S	C	.	.	H	α-helix	trans	-65.3	-50.7	177.7	-69.4	173.3	68.8	0	0	112	S162 L163 C164 G169 F170	S162-Q166 WeakPolarHBondContact O-CG 3.38Å; S162-Q166 PolarHBondContact O-N 2.94Å; S162-Q166 VanDerWaalsContact O-N 3.17Å; S162-Q166 PolarHBondContact O-NE2 3.49Å; S162-Q166 PolarHBondContact OG-NE2 2.93Å; L163-Q166 PolarHBondContact O-N 3.37Å; C164-Q166 VanDerWaalsContact C-N 3.26Å; C164-Q166 PolarHBondContact O-N 3.32Å; Q166-G169 PolarHBondContact O-N 3.44Å; Q166-F170 HydrophobicContact CB-CE2 4.32Å; Q166-F170 WeakPolarHBondContact O-CB 3.42Å; Q166-F170 WeakPolarHBondContact O-CD2 3.33Å; Q166-F170 WeakPolarHBondContact O-CG 3.43Å; Q166-F170 PolarHBondContact O-N 2.83Å
167	V	98.7	Very high	98	Very high	13 Å²	13	50.6 Å²	50.6	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-65.3	-47.5	-177	176.7	0	0	0	0	111	V40 L43 L47 L163 C164 F170 S171	V40-V167 HydrophobicContact CG1-CG1 3.95Å; V40-V167 VanDerWaalsContact CG1-O 3.25Å; V40-V167 WeakPolarHBondContact CG1-O 3.28Å; L43-V167 HydrophobicContact CB-CG1 4.03Å; L43-V167 HydrophobicContact CB-CG2 3.97Å; L43-V167 HydrophobicContact CD1-CG2 4.23Å; L47-V167 HydrophobicContact CD1-CB 3.94Å; L47-V167 HydrophobicContact CD1-CG1 4.2Å; L47-V167 HydrophobicContact CD1-CG2 3.84Å; L163-V167 WeakPolarHBondContact O-CG2 3.36Å; L163-V167 PolarHBondContact O-N 3.21Å; C164-V167 PolarHBondContact O-N 3.2Å; V167-F170 PolarHBondContact O-N 3.12Å; V167-S171 WeakPolarHBondContact O-CB 3.38Å; V167-S171 PolarHBondContact O-N 3.24Å
168	H	98.6	Very high	98	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-41.3	175.6	-72.5	-70.7	0	0	0	111.7	H44 W86 T116 G120 L121 C164 F170 S171 V172	H44-H168 AromaticContact CE1-CE1 3.31Å; H44-H168 PolarHBondContact CE1-CE1 3.24Å; H44-H168 AromaticContact CE1-CG 3.81Å; H44-H168 AromaticContact CE1-ND1 3.23Å; H44-H168 PolarHBondContact CE1-ND1 2.93Å; H44-H168 AromaticContact CE1-NE2 3.92Å; H44-H168 AromaticContact ND1-CE1 3.74Å; W86-H168 AromaticContact CE2-NE2 3.54Å; W86-H168 AromaticContact CZ2-NE2 3.57Å; W86-H168 AromaticContact NE1-CD2 3.87Å; W86-H168 AromaticContact NE1-NE2 3.08Å; W86-H168 PolarHBondContact NE1-NE2 3.15Å; T116-H168 HydrophobicContact CG2-CB 4.05Å; T116-H168 WeakPolarHBondContact CG2-ND1 3.43Å; G120-H168 WeakPolarHBondContact CA-CE1 3.33Å; L121-H168 HydrophobicContact CD2-CB 3.62Å; L121-H168 HydrophobicContact CG-CB 3.85Å; C164-H168 WeakPolarHBondContact O-CB 3.24Å; C164-H168 PolarHBondContact O-CD2 3.32Å; C164-H168 PolarHBondContact O-N 3.39Å; H168-F170 PolarHBondContact O-N 3.06Å; H168-S171 WeakPolarHBondContact O-CB 3.34Å; H168-S171 PolarHBondContact O-N 3.49Å; H168-V172 WeakPolarHBondContact O-CG2 3.49Å; H168-V172 PolarHBondContact O-N 3.45Å
169	G	98.6	Very high	97.9	Very high	29 Å²	29	49.7 Å²	49.7	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-44.3	176.6	0	0	0	0	0	112.7	V165 Q166 V172 Y173	V165-G169 WeakPolarHBondContact O-CA 3.45Å; V165-G169 PolarHBondContact O-N 3.3Å; Q166-G169 PolarHBondContact O-N 3.44Å; G169-V172 PolarHBondContact O-N 3.34Å; G169-Y173 WeakPolarHBondContact O-CB 3.07Å; G169-Y173 PolarHBondContact O-N 3.3Å
170	F	98.6	Very high	97.7	Very high	102 Å²	102	47.7 Å²	47.7	45%	0.447	24%	0.237	S	C	.	.	H	α-helix	trans	-67.6	-36	174.7	-70.9	-47	0	0	0	112.6	V40 Q166 V167 H168 Y173 F174	V40-F170 HydrophobicContact CG1-CB 4.37Å; V40-F170 HydrophobicContact CG2-CB 3.88Å; Q166-F170 HydrophobicContact CB-CE2 4.32Å; Q166-F170 WeakPolarHBondContact O-CB 3.42Å; Q166-F170 WeakPolarHBondContact O-CD2 3.33Å; Q166-F170 WeakPolarHBondContact O-CG 3.43Å; Q166-F170 PolarHBondContact O-N 2.83Å; V167-F170 PolarHBondContact O-N 3.12Å; H168-F170 PolarHBondContact O-N 3.06Å; F170-Y173 PolarHBondContact O-N 3.1Å; F170-F174 HydrophobicContact CB-CD2 4.22Å; F170-F174 HydrophobicContact CB-CE2 3.98Å; F170-F174 HydrophobicContact CD1-CE2 4.3Å; F170-F174 HydrophobicContact CG-CE2 4.36Å; F170-F174 WeakPolarHBondContact O-CD2 3.14Å; F170-F174 PolarHBondContact O-N 2.99Å
171	S	98.3	Very high	97.4	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-47.9	173.4	-178.7	0	0	0	0	110.6	V167 H168 G175	V167-S171 WeakPolarHBondContact O-CB 3.38Å; V167-S171 PolarHBondContact O-N 3.24Å; H168-S171 WeakPolarHBondContact O-CB 3.34Å; H168-S171 PolarHBondContact O-N 3.49Å; S171-G175 WeakPolarHBondContact O-CA 3.28Å; S171-G175 PolarHBondContact O-N 3.2Å
172	V	98.6	Very high	97.2	Very high	38 Å²	38	48 Å²	48	23%	0.23	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-47.2	175.9	174.1	0	0	0	0	111.4	L113 T116 V117 H168 G169 Y176	L113-V172 HydrophobicContact CD2-CB 4.37Å; L113-V172 HydrophobicContact CD2-CG1 4.35Å; L113-V172 WeakPolarHBondContact CD2-O 3.46Å; T116-V172 HydrophobicContact CG2-CG2 3.78Å; V117-V172 HydrophobicContact CG2-CG2 3.99Å; H168-V172 WeakPolarHBondContact O-CG2 3.49Å; H168-V172 PolarHBondContact O-N 3.45Å; G169-V172 PolarHBondContact O-N 3.34Å; V172-Y176 WeakPolarHBondContact O-CB 3.49Å; V172-Y176 PolarHBondContact O-N 2.97Å
173	Y	98.4	Very high	96.7	Very high	130 Å²	130	46.8 Å²	46.8	51%	0.51	23%	0.231	S	C	.	.	H	α-helix	trans	-61	-52.9	-178.5	176.1	-97.9	0	0	0	112.7	G169 F170 K177	G169-Y173 WeakPolarHBondContact O-CB 3.07Å; G169-Y173 PolarHBondContact O-N 3.3Å; F170-Y173 PolarHBondContact O-N 3.1Å; Y173-K177 WeakPolarHBondContact O-CG 3.37Å; Y173-K177 PolarHBondContact O-N 3.48Å
174	F	98.2	Very high	96	Very high	25 Å²	25	46.4 Å²	46.4	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-71.2	-38.1	-179.7	-63	-49.2	0	0	0	111.8	L33 R36 I37 V40 F170 K177 L178	L33-F174 HydrophobicContact CD2-CD1 3.65Å; L33-F174 HydrophobicContact CD2-CE1 4.37Å; R36-F174 HydrophobicContact CB-CD1 4.38Å; R36-F174 HydrophobicContact CB-CD2 4.09Å; R36-F174 HydrophobicContact CB-CE1 4.32Å; R36-F174 HydrophobicContact CB-CE2 4.02Å; R36-F174 HydrophobicContact CB-CG 4.29Å; R36-F174 HydrophobicContact CB-CZ 4.15Å; I37-F174 HydrophobicContact CB-CB 4.09Å; I37-F174 HydrophobicContact CD1-CB 4.44Å; I37-F174 HydrophobicContact CG1-CB 4.34Å; V40-F174 HydrophobicContact CG2-CD2 4Å; V40-F174 HydrophobicContact CG2-CE2 4.08Å; F170-F174 HydrophobicContact CB-CD2 4.22Å; F170-F174 HydrophobicContact CB-CE2 3.98Å; F170-F174 HydrophobicContact CD1-CE2 4.3Å; F170-F174 HydrophobicContact CG-CE2 4.36Å; F170-F174 WeakPolarHBondContact O-CD2 3.14Å; F170-F174 PolarHBondContact O-N 2.99Å; F174-K177 PolarHBondContact O-N 3.3Å; F174-L178 WeakPolarHBondContact O-CG 3.19Å; F174-L178 PolarHBondContact O-N 3.24Å
175	G	97.8	Very high	94.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-40.3	177.4	0	0	0	0	0	112.1	M109 S171 L178 Y179	M109-G175 WeakPolarHBondContact CG-O 3.37Å; S171-G175 WeakPolarHBondContact O-CA 3.28Å; S171-G175 PolarHBondContact O-N 3.2Å; G175-L178 PolarHBondContact O-N 3.34Å; G175-Y179 WeakPolarHBondContact O-CB 3.38Å; G175-Y179 PolarHBondContact O-N 3.42Å
176	Y	97.9	Very high	93.7	Very high	133 Å²	133	51.3 Å²	51.3	52%	0.522	25%	0.254	S	S	.	.	H	α-helix	trans	-64	-45.1	176.3	-179	-104	0	0	0	111.7	V172 L178 Y179 C180	V172-Y176 WeakPolarHBondContact O-CB 3.49Å; V172-Y176 PolarHBondContact O-N 2.97Å; Y176-L178 VanDerWaalsContact C-N 3.32Å; Y176-L178 PolarHBondContact O-N 3.41Å; Y176-Y179 WeakPolarHBondContact O-CB 3.44Å; Y176-Y179 PolarHBondContact O-N 3.29Å; Y176-C180 PolarHBondContact O-N 3.27Å; Y176-C180 PolarHBondContact O-SG 3.43Å
177	K	96.2	Very high	92.4	Very high	98 Å²	98	56.8 Å²	56.8	43%	0.426	27%	0.271	S	S	.	.	H	α-helix	trans	-59.5	-42.7	174.9	-69.7	-73.7	-172.7	-179.9	0	111.8	L33 Y173 F174 C180 I181	L33-K177 HydrophobicContact CD1-CB 3.69Å; L33-K177 HydrophobicContact CD2-CB 4.38Å; Y173-K177 WeakPolarHBondContact O-CG 3.37Å; Y173-K177 PolarHBondContact O-N 3.48Å; F174-K177 PolarHBondContact O-N 3.3Å; K177-C180 PolarHBondContact O-N 2.84Å; K177-I181 WeakPolarHBondContact O-CG1 3.48Å; K177-I181 PolarHBondContact O-N 3.1Å; K177-I181 VanDerWaalsContact O-N 3.15Å
178	L	95.2	Very high	91	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-43.7	175.2	-75.5	176.1	0	0	0	112.1	L33 K34 I37 L101 M109 F174 G175 Y176 C180 I181 W182	L33-L178 HydrophobicContact CB-CD1 4.29Å; L33-L178 HydrophobicContact CB-CD2 3.52Å; L33-L178 HydrophobicContact CB-CG 3.78Å; L33-L178 HydrophobicContact CD1-CD2 4.14Å; L33-L178 HydrophobicContact CD1-CG 4.4Å; K34-L178 HydrophobicContact CG-CD1 4.28Å; K34-L178 HydrophobicContact CG-CD2 4.21Å; I37-L178 HydrophobicContact CD1-CD1 4.35Å; I37-L178 HydrophobicContact CG2-CD1 3.85Å; L101-L178 HydrophobicContact CD2-CD1 3.99Å; M109-L178 HydrophobicContact CE-CB 4.22Å; M109-L178 HydrophobicContact CE-CD1 4.01Å; F174-L178 WeakPolarHBondContact O-CG 3.19Å; F174-L178 PolarHBondContact O-N 3.24Å; G175-L178 PolarHBondContact O-N 3.34Å; Y176-L178 VanDerWaalsContact C-N 3.32Å; Y176-L178 PolarHBondContact O-N 3.41Å; L178-C180 VanDerWaalsContact C-N 3.34Å; L178-C180 PolarHBondContact O-N 2.93Å; L178-I181 PolarHBondContact O-N 2.97Å; L178-W182 HydrophobicContact CB-CD2 4.43Å; L178-W182 HydrophobicContact CB-CE3 4.48Å; L178-W182 HydrophobicContact CB-CH2 3.98Å; L178-W182 HydrophobicContact CB-CZ2 3.89Å; L178-W182 HydrophobicContact CB-CZ3 4.29Å; L178-W182 HydrophobicContact CD1-CH2 3.93Å; L178-W182 HydrophobicContact CD1-CZ2 3.97Å; L178-W182 HydrophobicContact CD2-CH2 4.36Å; L178-W182 HydrophobicContact CD2-CZ2 3.6Å; L178-W182 HydrophobicContact CG-CH2 4.31Å; L178-W182 HydrophobicContact CG-CZ2 4.02Å; L178-W182 PolarHBondContact O-N 3.48Å
179	Y	95.8	Very high	89.5	Confident	61 Å²	61	68.3 Å²	68.3	24%	0.239	34%	0.337	C	S	.	.	H	α-helix	trans	-56.2	-47.9	175.9	172	-104.8	0	0	0	111.4	A106 R110 L113 G175 Y176 I181 W182 S183	A106-Y179 HydrophobicContact CB-CD2 4.15Å; A106-Y179 HydrophobicContact CB-CE2 4.26Å; A106-Y179 WeakPolarHBondContact O-CD2 3.12Å; R110-Y179 HydrophobicContact CB-CD2 4.12Å; R110-Y179 HydrophobicContact CB-CE2 3.77Å; R110-Y179 HydrophobicContact CG-CE2 4.36Å; L113-Y179 HydrophobicContact CD1-CG 4.43Å; G175-Y179 WeakPolarHBondContact O-CB 3.38Å; G175-Y179 PolarHBondContact O-N 3.42Å; Y176-Y179 WeakPolarHBondContact O-CB 3.44Å; Y176-Y179 PolarHBondContact O-N 3.29Å; Y179-I181 PolarHBondContact O-N 3.28Å; Y179-W182 PolarHBondContact O-N 2.97Å; Y179-S183 VanDerWaalsContact O-CB 3.28Å; Y179-S183 WeakPolarHBondContact O-CB 3.1Å; Y179-S183 PolarHBondContact O-N 3.46Å; Y179-S183 PolarHBondContact O-OG 3.05Å; Y179-S183 VanDerWaalsContact O-OG 3.12Å
180	C	93.1	Very high	87.5	Confident	44 Å²	44	80.2 Å²	80.2	30%	0.297	37%	0.373	S	S	.	.	H	α-helix	trans	-60.3	-42.6	176.5	-66	0	0	0	0	112.6	Y176 K177 L178 S183 V184	Y176-C180 PolarHBondContact O-N 3.27Å; Y176-C180 PolarHBondContact O-SG 3.43Å; K177-C180 PolarHBondContact O-N 2.84Å; L178-C180 VanDerWaalsContact C-N 3.34Å; L178-C180 PolarHBondContact O-N 2.93Å; C180-S183 PolarHBondContact O-OG 3.06Å; C180-S183 VanDerWaalsContact O-OG 3.06Å; C180-V184 WeakPolarHBondContact O-CG2 3.26Å; C180-V184 PolarHBondContact O-N 2.8Å
181	I	91.9	Very high	86.9	Confident	23 Å²	23	79.1 Å²	79.1	12%	0.118	37%	0.369	C	S	.	.	H	α-helix	trans	-65.7	-40.7	179	-67.9	165.1	0	0	0	110.9	Q26 L29 L33 K177 L178 Y179	Q26-I181 HydrophobicContact CB-CG2 4.06Å; L29-I181 HydrophobicContact CB-CD1 4.22Å; L33-I181 HydrophobicContact CD1-CD1 3.81Å; K177-I181 WeakPolarHBondContact O-CG1 3.48Å; K177-I181 PolarHBondContact O-N 3.1Å; K177-I181 VanDerWaalsContact O-N 3.15Å; L178-I181 PolarHBondContact O-N 2.97Å; Y179-I181 PolarHBondContact O-N 3.28Å
182	W	92.2	Very high	86.3	Confident	4 Å²	4	83.2 Å²	83.2	2%	0.015	39%	0.388	C	S	.	.	H	α-helix	trans	-79.9	-30.7	-177	-58.3	-18.9	0	0	0	112.9	S30 K34 L101 S104 A106 M109 L178 Y179 V184 K185 V186	S30-W182 PolarHBondContact OG-NE1 3.19Å; S30-W182 VanDerWaalsContact OG-NE1 3.1Å; K34-W182 HydrophobicContact CD-CZ2 4.33Å; K34-W182 HydrophobicContact CG-CZ2 4.09Å; L101-W182 HydrophobicContact CD2-CH2 3.77Å; S104-W182 VanDerWaalsContact C-CE3 3.44Å; A106-W182 HydrophobicContact CB-CB 3.98Å; M109-W182 HydrophobicContact CB-CE3 4.34Å; M109-W182 HydrophobicContact CB-CZ3 4.08Å; M109-W182 HydrophobicContact CE-CH2 3.9Å; M109-W182 HydrophobicContact CE-CZ3 3.74Å; M109-W182 HydrophobicContact CG-CZ3 4.38Å; L178-W182 HydrophobicContact CB-CD2 4.43Å; L178-W182 HydrophobicContact CB-CE3 4.48Å; L178-W182 HydrophobicContact CB-CH2 3.98Å; L178-W182 HydrophobicContact CB-CZ2 3.89Å; L178-W182 HydrophobicContact CB-CZ3 4.29Å; L178-W182 HydrophobicContact CD1-CH2 3.93Å; L178-W182 HydrophobicContact CD1-CZ2 3.97Å; L178-W182 HydrophobicContact CD2-CH2 4.36Å; L178-W182 HydrophobicContact CD2-CZ2 3.6Å; L178-W182 HydrophobicContact CG-CH2 4.31Å; L178-W182 HydrophobicContact CG-CZ2 4.02Å; L178-W182 PolarHBondContact O-N 3.48Å; Y179-W182 PolarHBondContact O-N 2.97Å; W182-V184 VanDerWaalsContact C-N 3.33Å; W182-V184 PolarHBondContact O-N 3.14Å; W182-K185 PolarHBondContact O-N 2.9Å; W182-V186 WeakPolarHBondContact O-CG2 3.36Å; W182-V186 PolarHBondContact O-N 3.48Å
183	S	88.8	Confident	85.6	Confident	38 Å²	38	85.7 Å²	85.7	27%	0.266	40%	0.397	S	S	.	.	H	α-helix	trans	-67.5	-33.6	177.4	65.6	0	0	0	0	112.3	Y179 C180 K185 V186 R187	Y179-S183 VanDerWaalsContact O-CB 3.28Å; Y179-S183 WeakPolarHBondContact O-CB 3.1Å; Y179-S183 PolarHBondContact O-N 3.46Å; Y179-S183 PolarHBondContact O-OG 3.05Å; Y179-S183 VanDerWaalsContact O-OG 3.12Å; C180-S183 PolarHBondContact O-OG 3.06Å; C180-S183 VanDerWaalsContact O-OG 3.06Å; S183-K185 VanDerWaalsContact C-N 3.3Å; S183-K185 PolarHBondContact O-N 2.88Å; S183-V186 PolarHBondContact O-N 2.63Å; S183-R187 PolarHBondContact O-N 3.43Å
184	V	84	Confident	84.9	Confident	66 Å²	66	83.1 Å²	83.1	40%	0.4	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-40.5	172.8	172.8	0	0	0	0	111.3	C180 W182 R187 K188	C180-V184 WeakPolarHBondContact O-CG2 3.26Å; C180-V184 PolarHBondContact O-N 2.8Å; W182-V184 VanDerWaalsContact C-N 3.33Å; W182-V184 PolarHBondContact O-N 3.14Å; V184-R187 PolarHBondContact O-N 2.81Å; V184-K188 WeakPolarHBondContact O-CG 3.26Å; V184-K188 PolarHBondContact O-N 3.08Å; V184-K188 VanDerWaalsContact O-N 3.1Å
185	K	73.4	Confident	84	Confident	85 Å²	85	86.8 Å²	86.8	37%	0.37	41%	0.408	S	S	.	.	H	α-helix	trans	-65.6	-42.2	177.6	-66.1	-174.7	177.1	-172.6	0	111.9	W182 S183 R187 K188 A189	W182-K185 PolarHBondContact O-N 2.9Å; S183-K185 VanDerWaalsContact C-N 3.3Å; S183-K185 PolarHBondContact O-N 2.88Å; K185-R187 VanDerWaalsContact C-N 3.34Å; K185-K188 PolarHBondContact O-N 2.75Å; K185-A189 PolarHBondContact O-N 2.96Å
186	V	74.1	Confident	83.1	Confident	92 Å²	92	92.5 Å²	92.5	56%	0.558	44%	0.435	S	S	*	.	H	α-helix	trans	-63.6	-41.3	177.5	175.8	0	0	0	0	111	W182 S183 K188 A189	W182-V186 WeakPolarHBondContact O-CG2 3.36Å; W182-V186 PolarHBondContact O-N 3.48Å; S183-V186 PolarHBondContact O-N 2.63Å; V186-K188 PolarHBondContact O-N 3.12Å; V186-A189 PolarHBondContact O-N 3.2Å
187	R	72.7	Confident	82.1	Confident	210 Å²	210	89.6 Å²	89.6	79%	0.792	43%	0.429	S	S	*	.	H	α-helix	trans	-66.9	-33.3	177.9	-174.3	176.4	175.7	-176.2	-0.7	113.1	S183 V184 K185 A189	S183-R187 PolarHBondContact O-N 3.43Å; V184-R187 PolarHBondContact O-N 2.81Å; K185-R187 VanDerWaalsContact C-N 3.34Å; R187-A189 VanDerWaalsContact C-N 3.34Å
188	K	68.5	Low	81	Confident	162 Å²	162	89 Å²	89	70%	0.704	43%	0.429	S	S	*	.	H	α-helix	trans	-74.7	-22.3	177	-75.2	-172.8	177.5	-165.5	0	113.9	V184 K185 V186 R190	V184-K188 WeakPolarHBondContact O-CG 3.26Å; V184-K188 PolarHBondContact O-N 3.08Å; V184-K188 VanDerWaalsContact O-N 3.1Å; K185-K188 PolarHBondContact O-N 2.75Å; V186-K188 PolarHBondContact O-N 3.12Å; K188-R190 VanDerWaalsContact C-N 3.33Å
189	A	67.5	Low	79.8	Confident	93 Å²	93	96.4 Å²	96.4	77%	0.769	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-7.3	179.2	0	0	0	0	0	113.2	K185 V186 R187	K185-A189 PolarHBondContact O-N 2.96Å; V186-A189 PolarHBondContact O-N 3.2Å; R187-A189 VanDerWaalsContact C-N 3.34Å
190	R	55.7	Low	78.3	Confident	279 Å²	279	99.6 Å²	99.6	100%	1.053	49%	0.486	S	S	*	.			trans	-106.8	0	176.6	-175.6	-178.5	-176.1	-173.7	1.8	109.3	K188	K188-R190 VanDerWaalsContact C-N 3.33Å

Retrieved 190 of 190 residues in 45.2 ms (Link to these results)

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